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]1[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1(C)C ZINC000536668688 1032067348 /nfs/dbraw/zinc/06/73/48/1032067348.db2.gz JUTNETODAANSRX-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1(C)C ZINC000536668688 1032067349 /nfs/dbraw/zinc/06/73/49/1032067349.db2.gz JUTNETODAANSRX-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218740 1015074823 /nfs/dbraw/zinc/07/48/23/1015074823.db2.gz KXHVCLKCXYLBML-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000032801287 1015735685 /nfs/dbraw/zinc/73/56/85/1015735685.db2.gz VSOQYFKMUAAMKV-NEPJUHHUSA-N 1 1 347.802 3.926 20 5 EHBDMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282942 1015780408 /nfs/dbraw/zinc/78/04/08/1015780408.db2.gz GVQPOCQIIJDSIS-WCQYABFASA-N 1 1 328.372 3.604 20 5 EHBDMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282939 1015780428 /nfs/dbraw/zinc/78/04/28/1015780428.db2.gz GVQPOCQIIJDSIS-DGCLKSJQSA-N 1 1 328.372 3.604 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000246922487 1016083336 /nfs/dbraw/zinc/08/33/36/1016083336.db2.gz GOCYNTSAKDXIKP-QFBILLFUSA-N 1 1 345.487 3.626 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247033803 1016336281 /nfs/dbraw/zinc/33/62/81/1016336281.db2.gz MLYVLIAIEDFPKY-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247033803 1016336293 /nfs/dbraw/zinc/33/62/93/1016336293.db2.gz MLYVLIAIEDFPKY-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO COc1cnccc1[C@@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000189569584 1016534487 /nfs/dbraw/zinc/53/44/87/1016534487.db2.gz NPICOWJLBWQMIF-CYBMUJFWSA-N 1 1 329.400 3.973 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226895 1016663490 /nfs/dbraw/zinc/66/34/90/1016663490.db2.gz DJIBNAFALYIQGT-AAEUAGOBSA-N 1 1 339.823 3.697 20 5 EHBDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459701745 1032425767 /nfs/dbraw/zinc/42/57/67/1032425767.db2.gz FETYLSQXKHNBES-KRWDZBQOSA-N 1 1 345.399 3.641 20 5 EHBDMO CCOC[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459701745 1032425768 /nfs/dbraw/zinc/42/57/68/1032425768.db2.gz FETYLSQXKHNBES-KRWDZBQOSA-N 1 1 345.399 3.641 20 5 EHBDMO Cc1cc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610281962 1017614745 /nfs/dbraw/zinc/61/47/45/1017614745.db2.gz MKQYVOBZIOYWDA-SFHVURJKSA-N 1 1 325.412 3.614 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC001167325505 1018067960 /nfs/dbraw/zinc/06/79/60/1018067960.db2.gz CGGSZXVYORIEAA-GFCCVEGCSA-N 1 1 348.834 3.979 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CCO)c1ccccc1F ZINC000592402397 1032796475 /nfs/dbraw/zinc/79/64/75/1032796475.db2.gz GSWLBVZOKMYWAF-ACJLOTCBSA-N 1 1 332.375 3.817 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000419374438 1018973418 /nfs/dbraw/zinc/97/34/18/1018973418.db2.gz PVIFARGSWNYDJN-WRWGMCAJSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000419374438 1018973429 /nfs/dbraw/zinc/97/34/29/1018973429.db2.gz PVIFARGSWNYDJN-WRWGMCAJSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190850 1018989430 /nfs/dbraw/zinc/98/94/30/1018989430.db2.gz MNHFIYNNJLNKRB-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190850 1018989442 /nfs/dbraw/zinc/98/94/42/1018989442.db2.gz MNHFIYNNJLNKRB-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1)CC1CC1 ZINC000536618918 1019196496 /nfs/dbraw/zinc/19/64/96/1019196496.db2.gz NSEPDVASKFCPTR-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](c3cc(C)ccn3)C2)ccc1[N+](=O)[O-] ZINC000579608381 1019258828 /nfs/dbraw/zinc/25/88/28/1019258828.db2.gz RZURRZXMDNDFFZ-INIZCTEOSA-N 1 1 341.411 3.686 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000433606506 1019436738 /nfs/dbraw/zinc/43/67/38/1019436738.db2.gz GPBLWTPQKXPZGS-KRWDZBQOSA-N 1 1 339.439 3.864 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCN(c3ccccc3F)CC2)c(F)c1 ZINC000513397654 1019616124 /nfs/dbraw/zinc/61/61/24/1019616124.db2.gz MTHFXWRYTRKKGI-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c(F)c1 ZINC000513397654 1019616132 /nfs/dbraw/zinc/61/61/32/1019616132.db2.gz MTHFXWRYTRKKGI-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CCCC[N@H+]2C2CC2)ccc2ncccc21 ZINC000433803701 1019646172 /nfs/dbraw/zinc/64/61/72/1019646172.db2.gz NGLOZNNAGBBSQN-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC001167433887 1019991940 /nfs/dbraw/zinc/99/19/40/1019991940.db2.gz OJZOEUBAZDOELB-UHFFFAOYSA-N 1 1 344.386 3.820 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138306 1020727942 /nfs/dbraw/zinc/72/79/42/1020727942.db2.gz XTNUSENHHZKUON-UONOGXRCSA-N 1 1 333.432 3.822 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000084134083 1021005247 /nfs/dbraw/zinc/00/52/47/1021005247.db2.gz OCTBBUHPCZBUMF-INIZCTEOSA-N 1 1 344.386 3.568 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000084134083 1021005253 /nfs/dbraw/zinc/00/52/53/1021005253.db2.gz OCTBBUHPCZBUMF-INIZCTEOSA-N 1 1 344.386 3.568 20 5 EHBDMO C[N@@H+](CCc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1)C1CC1 ZINC000341236722 1021147048 /nfs/dbraw/zinc/14/70/48/1021147048.db2.gz OJADITMRZNGCSO-UHFFFAOYSA-N 1 1 345.424 3.545 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000507372149 1021225664 /nfs/dbraw/zinc/22/56/64/1021225664.db2.gz OZDLBYOQXQLRSH-MRXNPFEDSA-N 1 1 347.462 3.992 20 5 EHBDMO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC1CCCCC1 ZINC000507582923 1021372023 /nfs/dbraw/zinc/37/20/23/1021372023.db2.gz HSCHKOUMGOIBKR-UHFFFAOYSA-N 1 1 333.432 3.826 20 5 EHBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270531888 1021714929 /nfs/dbraw/zinc/71/49/29/1021714929.db2.gz UNIAHDPZAOVSNF-KDURUIRLSA-N 1 1 330.431 3.912 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000471717324 1021828055 /nfs/dbraw/zinc/82/80/55/1021828055.db2.gz YAMDKQQTSCEQED-UHFFFAOYSA-N 1 1 328.416 3.579 20 5 EHBDMO Cc1c(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000437503838 1021897173 /nfs/dbraw/zinc/89/71/73/1021897173.db2.gz FQNLBSJYZVCAHT-LJQANCHMSA-N 1 1 340.423 3.737 20 5 EHBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602625562 1033018071 /nfs/dbraw/zinc/01/80/71/1033018071.db2.gz STADXSWOUYYPLC-HNNXBMFYSA-N 1 1 346.349 3.598 20 5 EHBDMO C[N@@H+](CCc1ccccn1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602608878 1033026736 /nfs/dbraw/zinc/02/67/36/1033026736.db2.gz YHDXCFIZQNTAOH-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000517181857 1022100459 /nfs/dbraw/zinc/10/04/59/1022100459.db2.gz RMWMFJGYYZOZCE-UHFFFAOYSA-N 1 1 348.443 3.581 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441295803 1022138134 /nfs/dbraw/zinc/13/81/34/1022138134.db2.gz UATQVSYPTUBEPB-CVEARBPZSA-N 1 1 348.443 3.631 20 5 EHBDMO CC(C)[C@H]1[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000894921031 1022248786 /nfs/dbraw/zinc/24/87/86/1022248786.db2.gz VLJVRMAKDYWOFN-MRXNPFEDSA-N 1 1 338.835 3.885 20 5 EHBDMO CC[N@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000891714128 1022445129 /nfs/dbraw/zinc/44/51/29/1022445129.db2.gz SPJRAMPYBLGZCC-GFCCVEGCSA-N 1 1 346.383 3.598 20 5 EHBDMO CC[N@@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000891714128 1022445133 /nfs/dbraw/zinc/44/51/33/1022445133.db2.gz SPJRAMPYBLGZCC-GFCCVEGCSA-N 1 1 346.383 3.598 20 5 EHBDMO CC(C)(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000438588542 1022826416 /nfs/dbraw/zinc/82/64/16/1022826416.db2.gz RCGLVXFQNBVUMO-UHFFFAOYSA-N 1 1 341.411 3.834 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@H]43)o2)cc1 ZINC000430883874 1022828493 /nfs/dbraw/zinc/82/84/93/1022828493.db2.gz SQWLWQWDAZEUHB-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@H]43)o2)cc1 ZINC000430883874 1022828511 /nfs/dbraw/zinc/82/85/11/1022828511.db2.gz SQWLWQWDAZEUHB-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000510782229 1023155915 /nfs/dbraw/zinc/15/59/15/1023155915.db2.gz VOQJWOJJYDINSC-CYBMUJFWSA-N 1 1 340.370 3.678 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000510782229 1023155916 /nfs/dbraw/zinc/15/59/16/1023155916.db2.gz VOQJWOJJYDINSC-CYBMUJFWSA-N 1 1 340.370 3.678 20 5 EHBDMO CCC[C@@]1(COC)CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510798531 1023178367 /nfs/dbraw/zinc/17/83/67/1023178367.db2.gz PXATVLVBWRWAFE-INIZCTEOSA-N 1 1 328.359 3.654 20 5 EHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510798531 1023178374 /nfs/dbraw/zinc/17/83/74/1023178374.db2.gz PXATVLVBWRWAFE-INIZCTEOSA-N 1 1 328.359 3.654 20 5 EHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507189953 1023182182 /nfs/dbraw/zinc/18/21/82/1023182182.db2.gz XHEQJTCKAAEKQM-KRWDZBQOSA-N 1 1 328.416 3.616 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000178387044 1023204885 /nfs/dbraw/zinc/20/48/85/1023204885.db2.gz WZEKJEGTTMMHLD-UHFFFAOYSA-N 1 1 335.448 3.552 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276872538 1023270660 /nfs/dbraw/zinc/27/06/60/1023270660.db2.gz HRCDZQIRSLRSLG-QGZVFWFLSA-N 1 1 344.411 3.549 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOCc1ccccc1 ZINC000535820007 1023786137 /nfs/dbraw/zinc/78/61/37/1023786137.db2.gz WNVIYFKMFVKWNH-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOCc1ccccc1 ZINC000535820007 1023786146 /nfs/dbraw/zinc/78/61/46/1023786146.db2.gz WNVIYFKMFVKWNH-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO CCC1(CC)[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1OC ZINC000610845665 1023788130 /nfs/dbraw/zinc/78/81/30/1023788130.db2.gz DASJTARBDBJUOD-CVEARBPZSA-N 1 1 347.415 3.762 20 5 EHBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610845666 1023788143 /nfs/dbraw/zinc/78/81/43/1023788143.db2.gz DASJTARBDBJUOD-HOTGVXAUSA-N 1 1 347.415 3.762 20 5 EHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500306 1024242985 /nfs/dbraw/zinc/24/29/85/1024242985.db2.gz SMICETROQZKRJV-ZWNOBZJWSA-N 1 1 327.222 3.978 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000320358385 1024322474 /nfs/dbraw/zinc/32/24/74/1024322474.db2.gz MIQUXUDRGXVUBY-NSHDSACASA-N 1 1 331.338 3.756 20 5 EHBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000346275565 1024565486 /nfs/dbraw/zinc/56/54/86/1024565486.db2.gz AWVZBOPZDFMDOF-AWEZNQCLSA-N 1 1 341.411 3.504 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000065535192 1024625080 /nfs/dbraw/zinc/62/50/80/1024625080.db2.gz RRPJACIHNIRMFV-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000065535192 1024625087 /nfs/dbraw/zinc/62/50/87/1024625087.db2.gz RRPJACIHNIRMFV-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000425368424 1024882129 /nfs/dbraw/zinc/88/21/29/1024882129.db2.gz WTALRRCFRCKRJC-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000425368424 1024882140 /nfs/dbraw/zinc/88/21/40/1024882140.db2.gz WTALRRCFRCKRJC-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025424220 1024928845 /nfs/dbraw/zinc/92/88/45/1024928845.db2.gz PRELDAMHWFKVFH-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025424220 1024928847 /nfs/dbraw/zinc/92/88/47/1024928847.db2.gz PRELDAMHWFKVFH-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000129709337 1025770652 /nfs/dbraw/zinc/77/06/52/1025770652.db2.gz XAIZTKFCACXELK-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000129709337 1025770668 /nfs/dbraw/zinc/77/06/68/1025770668.db2.gz XAIZTKFCACXELK-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451412184 1025945044 /nfs/dbraw/zinc/94/50/44/1025945044.db2.gz FWFSNZZCDLBFFL-KURKYZTESA-N 1 1 348.443 3.507 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000505855008 1025980785 /nfs/dbraw/zinc/98/07/85/1025980785.db2.gz AEDHELUDVFLGMY-MRXNPFEDSA-N 1 1 342.395 3.504 20 5 EHBDMO CCOc1ccccc1OCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511109433 1026069206 /nfs/dbraw/zinc/06/92/06/1026069206.db2.gz RWKVGWOCXNZFOK-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO C[N@@H+]1CCCC[C@H]1CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097219 /nfs/dbraw/zinc/09/72/19/1026097219.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 1 1 331.460 3.649 20 5 EHBDMO C[N@H+]1CCCC[C@H]1CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097231 /nfs/dbraw/zinc/09/72/31/1026097231.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@H]1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097245 /nfs/dbraw/zinc/09/72/45/1026097245.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@H]1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097260 /nfs/dbraw/zinc/09/72/60/1026097260.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 1 1 331.460 3.649 20 5 EHBDMO Cc1nc(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451550865 1026101179 /nfs/dbraw/zinc/10/11/79/1026101179.db2.gz SRHMPICDMHUWEX-OAHLLOKOSA-N 1 1 331.441 3.782 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)on1 ZINC000511145414 1026463519 /nfs/dbraw/zinc/46/35/19/1026463519.db2.gz VSFLYBIPEBWQSQ-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)on1 ZINC000511145414 1026463521 /nfs/dbraw/zinc/46/35/21/1026463521.db2.gz VSFLYBIPEBWQSQ-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO COc1cccc(N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000475394563 1026558039 /nfs/dbraw/zinc/55/80/39/1026558039.db2.gz WLWZULMALJSBFH-JKSUJKDBSA-N 1 1 347.459 3.694 20 5 EHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000472247765 1027072705 /nfs/dbraw/zinc/07/27/05/1027072705.db2.gz SVVPBZSVMSVMJH-SFHVURJKSA-N 1 1 348.422 3.520 20 5 EHBDMO COc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1Cl ZINC000536544019 1027153289 /nfs/dbraw/zinc/15/32/89/1027153289.db2.gz PZCDZCCJNZGADO-UHFFFAOYSA-N 1 1 347.802 3.816 20 5 EHBDMO COc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1Cl ZINC000536544019 1027153302 /nfs/dbraw/zinc/15/33/02/1027153302.db2.gz PZCDZCCJNZGADO-UHFFFAOYSA-N 1 1 347.802 3.816 20 5 EHBDMO Cc1c(CN2CCC[N@@H+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000501851010 1027596495 /nfs/dbraw/zinc/59/64/95/1027596495.db2.gz MAWJVLGIJXFTSA-UHFFFAOYSA-N 1 1 339.439 3.611 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000501868775 1027611457 /nfs/dbraw/zinc/61/14/57/1027611457.db2.gz FYEOYTXYTVMHAA-KRWDZBQOSA-N 1 1 326.396 3.681 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420945041 1027906173 /nfs/dbraw/zinc/90/61/73/1027906173.db2.gz KEZDZFBYOUDFNJ-LBPRGKRZSA-N 1 1 332.322 3.638 20 5 EHBDMO Cc1cnc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656082 1028046456 /nfs/dbraw/zinc/04/64/56/1028046456.db2.gz ORPDITTUJGKMLN-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444610073 1028074238 /nfs/dbraw/zinc/07/42/38/1028074238.db2.gz NYXYVDSSNQSNTC-AWEZNQCLSA-N 1 1 336.395 3.769 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774639 1028263681 /nfs/dbraw/zinc/26/36/81/1028263681.db2.gz XIPOTSPPRPLUJG-LSDHHAIUSA-N 1 1 333.432 3.598 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C[NH3+])C1CCCC1 ZINC000423504703 1028469780 /nfs/dbraw/zinc/46/97/80/1028469780.db2.gz NUHVEZGIOZDESX-LSDHHAIUSA-N 1 1 337.489 3.573 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000183593776 1028587191 /nfs/dbraw/zinc/58/71/91/1028587191.db2.gz UXGFSIJLJLJLRH-CYBMUJFWSA-N 1 1 340.358 3.770 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cc(F)cc3cccnc31)CC2 ZINC000088606689 1028591647 /nfs/dbraw/zinc/59/16/47/1028591647.db2.gz ZUEFWSIZVVNUII-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cc(F)cc3cccnc31)CC2 ZINC000088606689 1028591654 /nfs/dbraw/zinc/59/16/54/1028591654.db2.gz ZUEFWSIZVVNUII-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000421706669 1028702446 /nfs/dbraw/zinc/70/24/46/1028702446.db2.gz VLZJCTIZZUOALV-INIZCTEOSA-N 1 1 333.435 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+](C3CCCC3)C1)CCC2 ZINC000583064227 1028715024 /nfs/dbraw/zinc/71/50/24/1028715024.db2.gz ISPNGHAGZNTJAO-DNVCBOLYSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+](C3CCCC3)C1)CCC2 ZINC000583064227 1028715039 /nfs/dbraw/zinc/71/50/39/1028715039.db2.gz ISPNGHAGZNTJAO-DNVCBOLYSA-N 1 1 329.444 3.579 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000126361946 1029339029 /nfs/dbraw/zinc/33/90/29/1029339029.db2.gz YICBLBRHGBNYHQ-LJQANCHMSA-N 1 1 326.396 3.519 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000126361946 1029339050 /nfs/dbraw/zinc/33/90/50/1029339050.db2.gz YICBLBRHGBNYHQ-LJQANCHMSA-N 1 1 326.396 3.519 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000533248717 1029526429 /nfs/dbraw/zinc/52/64/29/1029526429.db2.gz MLFHECFMTIZLJF-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285223 1029574382 /nfs/dbraw/zinc/57/43/82/1029574382.db2.gz XUAKTXAIKNBLPT-GXTWGEPZSA-N 1 1 333.432 3.741 20 5 EHBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195851 1029738799 /nfs/dbraw/zinc/73/87/99/1029738799.db2.gz SQTLWCSNZPSIRZ-UONOGXRCSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195851 1029738806 /nfs/dbraw/zinc/73/88/06/1029738806.db2.gz SQTLWCSNZPSIRZ-UONOGXRCSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195851 1029738813 /nfs/dbraw/zinc/73/88/13/1029738813.db2.gz SQTLWCSNZPSIRZ-UONOGXRCSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195851 1029738818 /nfs/dbraw/zinc/73/88/18/1029738818.db2.gz SQTLWCSNZPSIRZ-UONOGXRCSA-N 1 1 345.468 3.896 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(Cl)c(F)c3)nc2c1 ZINC000446842062 1029823606 /nfs/dbraw/zinc/82/36/06/1029823606.db2.gz CMIJMURKOHNTJJ-UHFFFAOYSA-N 1 1 334.738 3.553 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCC[C@H]1O ZINC000428458667 1029854616 /nfs/dbraw/zinc/85/46/16/1029854616.db2.gz CUPPOCCXBKFHFO-IAGOWNOFSA-N 1 1 330.384 3.590 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475648067 1029856484 /nfs/dbraw/zinc/85/64/84/1029856484.db2.gz IKUUDFIKQCGRCL-HNNXBMFYSA-N 1 1 348.447 3.598 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccsc2)CC1 ZINC000533814980 1029862025 /nfs/dbraw/zinc/86/20/25/1029862025.db2.gz JLEDWCAFSBXFJB-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO Cc1c(C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000159550097 1030264760 /nfs/dbraw/zinc/26/47/60/1030264760.db2.gz LKSYKQZNFMCRAZ-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1c(C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000159550097 1030264771 /nfs/dbraw/zinc/26/47/71/1030264771.db2.gz LKSYKQZNFMCRAZ-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532125090 1030417606 /nfs/dbraw/zinc/41/76/06/1030417606.db2.gz ZRAMYYWACYFZBX-HNNXBMFYSA-N 1 1 334.416 3.539 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1 ZINC000477440636 1031568117 /nfs/dbraw/zinc/56/81/17/1031568117.db2.gz SQQHRLRPCJIHCL-MRXNPFEDSA-N 1 1 326.352 3.661 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)c1 ZINC000477440636 1031568125 /nfs/dbraw/zinc/56/81/25/1031568125.db2.gz SQQHRLRPCJIHCL-MRXNPFEDSA-N 1 1 326.352 3.661 20 5 EHBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000595019112 1033611446 /nfs/dbraw/zinc/61/14/46/1033611446.db2.gz IGZMWIKDWWATEF-SUMWQHHRSA-N 1 1 330.384 3.642 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057260 1033635345 /nfs/dbraw/zinc/63/53/45/1033635345.db2.gz VYNJIYOEZZSXNR-HIFRSBDPSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057260 1033635359 /nfs/dbraw/zinc/63/53/59/1033635359.db2.gz VYNJIYOEZZSXNR-HIFRSBDPSA-N 1 1 335.448 3.517 20 5 EHBDMO CCCCn1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)n1 ZINC000595029197 1033650774 /nfs/dbraw/zinc/65/07/74/1033650774.db2.gz WXZAZTINBQOCGB-CQSZACIVSA-N 1 1 346.431 3.759 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(C)c1OC ZINC000595049161 1033665051 /nfs/dbraw/zinc/66/50/51/1033665051.db2.gz ZFZSYWBXAHZLKO-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599074504 1033716829 /nfs/dbraw/zinc/71/68/29/1033716829.db2.gz SWWDEZRYOIBCJQ-CRAIPNDOSA-N 1 1 340.427 3.754 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000595296303 1033721693 /nfs/dbraw/zinc/72/16/93/1033721693.db2.gz ZRPKGWABZNXCHB-CYBMUJFWSA-N 1 1 335.791 3.752 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000595324877 1033741497 /nfs/dbraw/zinc/74/14/97/1033741497.db2.gz CIORXQOOXNPBKT-INIZCTEOSA-N 1 1 344.386 3.773 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599163108 1033779239 /nfs/dbraw/zinc/77/92/39/1033779239.db2.gz AZGHGTWRFOMUSR-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000595375213 1033782937 /nfs/dbraw/zinc/78/29/37/1033782937.db2.gz QHDQMOQFNICCHK-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO COC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000595489010 1033810876 /nfs/dbraw/zinc/81/08/76/1033810876.db2.gz IZVIDAKMNZHWTG-HNNXBMFYSA-N 1 1 338.766 3.865 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)c2cccc(F)c2)c1 ZINC000593019780 1033822820 /nfs/dbraw/zinc/82/28/20/1033822820.db2.gz KZAGSJRDPDXZNI-UHFFFAOYSA-N 1 1 346.358 3.545 20 5 EHBDMO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000603853711 1033976047 /nfs/dbraw/zinc/97/60/47/1033976047.db2.gz KHPXTNFVBKJDLO-KGLIPLIRSA-N 1 1 328.416 3.818 20 5 EHBDMO COc1ccccc1C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000603857608 1033980631 /nfs/dbraw/zinc/98/06/31/1033980631.db2.gz DFXNUAQGFRHTBC-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2cccnc2[N+](=O)[O-])cc1 ZINC000603857855 1033982867 /nfs/dbraw/zinc/98/28/67/1033982867.db2.gz VQJKLBMHDSZLBK-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CCc2ccccc21 ZINC000595881795 1034017842 /nfs/dbraw/zinc/01/78/42/1034017842.db2.gz WSSMANCLKGFVCX-CQSZACIVSA-N 1 1 337.379 3.898 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688045 1034116162 /nfs/dbraw/zinc/11/61/62/1034116162.db2.gz BNGUZGQGSJRJAW-BAABZTOOSA-N 1 1 342.399 3.823 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000596308863 1034164672 /nfs/dbraw/zinc/16/46/72/1034164672.db2.gz XCMITZQLDDEYHO-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](C[C@@H]3CCOC3)C3CC3)o2)cc1 ZINC000129948554 1034232389 /nfs/dbraw/zinc/23/23/89/1034232389.db2.gz MSNIXDCYKRBHOV-AWEZNQCLSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484497 1034388687 /nfs/dbraw/zinc/38/86/87/1034388687.db2.gz XRGADLLIOPOVLK-IBGZPJMESA-N 1 1 342.395 3.906 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000060356185 1034423868 /nfs/dbraw/zinc/42/38/68/1034423868.db2.gz HXIWXVAQMKOCGX-UHFFFAOYSA-N 1 1 346.452 4.000 20 5 EHBDMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000060495833 1034600772 /nfs/dbraw/zinc/60/07/72/1034600772.db2.gz SAYKZSIPLAQHIB-UHFFFAOYSA-N 1 1 333.432 3.826 20 5 EHBDMO CC(C)(C)c1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452593 1035127318 /nfs/dbraw/zinc/12/73/18/1035127318.db2.gz YMMNZCBSAZQKRF-SFHVURJKSA-N 1 1 342.443 3.926 20 5 EHBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1=CC[N@@H+](C)CC1 ZINC000511367840 1035181926 /nfs/dbraw/zinc/18/19/26/1035181926.db2.gz ADKQOYVNDUFAFY-JTQLQIEISA-N 1 1 329.322 3.676 20 5 EHBDMO COc1cc2c(cc1OC)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000030673132 1035657422 /nfs/dbraw/zinc/65/74/22/1035657422.db2.gz RGHLVKGMYJEFOO-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000030673132 1035657430 /nfs/dbraw/zinc/65/74/30/1035657430.db2.gz RGHLVKGMYJEFOO-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCc3c[nH+]cn3C2)c(Cl)c1 ZINC000588067882 1035696385 /nfs/dbraw/zinc/69/63/85/1035696385.db2.gz XDNIOVLKESTJMQ-MRVPVSSYSA-N 1 1 327.171 3.525 20 5 EHBDMO Cc1ccc(N2CCC(Nc3cc(C)ccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000088725571 1035741642 /nfs/dbraw/zinc/74/16/42/1035741642.db2.gz NQZQIKCWQPUXAX-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO CC(C)(C)Oc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000443422989 1035777706 /nfs/dbraw/zinc/77/77/06/1035777706.db2.gz AIPVKCZTZVDCHD-HUUCEWRRSA-N 1 1 333.432 3.811 20 5 EHBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180152573 1035852110 /nfs/dbraw/zinc/85/21/10/1035852110.db2.gz CUJTXZVKEWATMC-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000492517687 1035908049 /nfs/dbraw/zinc/90/80/49/1035908049.db2.gz YLZFRYKVOXQTSA-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C2 ZINC000540910795 1035941704 /nfs/dbraw/zinc/94/17/04/1035941704.db2.gz NRTWEMOYZBLOFH-UHFFFAOYSA-N 1 1 342.395 3.560 20 5 EHBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070158 1035952634 /nfs/dbraw/zinc/95/26/34/1035952634.db2.gz DYXAJRILWJMBMK-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070158 1035952639 /nfs/dbraw/zinc/95/26/39/1035952639.db2.gz DYXAJRILWJMBMK-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070171 1035952817 /nfs/dbraw/zinc/95/28/17/1035952817.db2.gz DYXAJRILWJMBMK-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070171 1035952828 /nfs/dbraw/zinc/95/28/28/1035952828.db2.gz DYXAJRILWJMBMK-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO COc1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000595565661 1035984436 /nfs/dbraw/zinc/98/44/36/1035984436.db2.gz IQYZWEIMNXHSAI-JQWIXIFHSA-N 1 1 342.342 3.579 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000595565661 1035984447 /nfs/dbraw/zinc/98/44/47/1035984447.db2.gz IQYZWEIMNXHSAI-JQWIXIFHSA-N 1 1 342.342 3.579 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000535265765 1036260736 /nfs/dbraw/zinc/26/07/36/1036260736.db2.gz MNYRACFVDWVAGF-QGZVFWFLSA-N 1 1 334.379 3.742 20 5 EHBDMO CC1(C)CCC[N@H+]1CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572652668 1036447902 /nfs/dbraw/zinc/44/79/02/1036447902.db2.gz ZLRXOYDDGHDSML-AWEZNQCLSA-N 1 1 345.365 3.662 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)Cc2cc(C)cc(C)c2)c1 ZINC000589515121 1036488935 /nfs/dbraw/zinc/48/89/35/1036488935.db2.gz CCPBUDBTRWLKED-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)Cc2cc(C)cc(C)c2)c1 ZINC000589515121 1036488947 /nfs/dbraw/zinc/48/89/47/1036488947.db2.gz CCPBUDBTRWLKED-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135535 1036783748 /nfs/dbraw/zinc/78/37/48/1036783748.db2.gz OASBPCYQDKYZBE-NWDGAFQWSA-N 1 1 343.349 3.961 20 5 EHBDMO COC[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590175602 1036800799 /nfs/dbraw/zinc/80/07/99/1036800799.db2.gz WVNIMZSIBHPFMF-LBPRGKRZSA-N 1 1 346.349 3.862 20 5 EHBDMO C[N@H+](CCOCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464851208 1036896549 /nfs/dbraw/zinc/89/65/49/1036896549.db2.gz PCNXCGUTOWORHB-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO C[N@@H+](CCOCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464851208 1036896574 /nfs/dbraw/zinc/89/65/74/1036896574.db2.gz PCNXCGUTOWORHB-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000542049074 1037025897 /nfs/dbraw/zinc/02/58/97/1037025897.db2.gz QBNUFHDVKNYMBN-YXJHDRRASA-N 1 1 345.443 3.742 20 5 EHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)c(F)c1 ZINC000539729944 1037130596 /nfs/dbraw/zinc/13/05/96/1037130596.db2.gz YZTUOJVQVBVZGZ-UHFFFAOYSA-N 1 1 340.301 3.523 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@H]43)o2)cc1 ZINC000539891304 1037313426 /nfs/dbraw/zinc/31/34/26/1037313426.db2.gz RUDYXGBYVIUFIZ-MAUKXSAKSA-N 1 1 342.395 3.856 20 5 EHBDMO CC[N@@H+](CCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177012126 1037323335 /nfs/dbraw/zinc/32/33/35/1037323335.db2.gz NFEGWQLDCDYXDT-UHFFFAOYSA-N 1 1 325.368 3.801 20 5 EHBDMO C[N@@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C1CCCC1 ZINC000591321022 1037341055 /nfs/dbraw/zinc/34/10/55/1037341055.db2.gz NQBBOSWKMXOHRU-UHFFFAOYSA-N 1 1 347.462 3.992 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000181221544 1037465922 /nfs/dbraw/zinc/46/59/22/1037465922.db2.gz IJKPXZPNEPKPAR-KSSFIOAISA-N 1 1 344.386 3.991 20 5 EHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC(C)(C)C1 ZINC000412032929 1037485579 /nfs/dbraw/zinc/48/55/79/1037485579.db2.gz HRCFTMLPCWNPTC-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCOC1 ZINC000462868928 1037492782 /nfs/dbraw/zinc/49/27/82/1037492782.db2.gz TXBVBJIMKLOOOK-INIZCTEOSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000532490884 1037535368 /nfs/dbraw/zinc/53/53/68/1037535368.db2.gz NCACQPVFSFWSNL-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000532490884 1037535379 /nfs/dbraw/zinc/53/53/79/1037535379.db2.gz NCACQPVFSFWSNL-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000177500869 1037558079 /nfs/dbraw/zinc/55/80/79/1037558079.db2.gz OIPKMUAYWLGEBL-UHFFFAOYSA-N 1 1 336.407 3.905 20 5 EHBDMO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000549928317 1037641286 /nfs/dbraw/zinc/64/12/86/1037641286.db2.gz OMMLZGYXXQPDQQ-ZDUSSCGKSA-N 1 1 330.384 3.938 20 5 EHBDMO C[C@H]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000463070371 1037732822 /nfs/dbraw/zinc/73/28/22/1037732822.db2.gz NMCWHAFFEAAEDL-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000443321673 1037836866 /nfs/dbraw/zinc/83/68/66/1037836866.db2.gz RDPAQABPICMPGA-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000443321673 1037836886 /nfs/dbraw/zinc/83/68/86/1037836886.db2.gz RDPAQABPICMPGA-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000103479691 1037903361 /nfs/dbraw/zinc/90/33/61/1037903361.db2.gz RCNZVQXPVBMGHV-UHFFFAOYSA-N 1 1 347.365 3.950 20 5 EHBDMO Cc1cc(N[C@H]2CCc3[nH+]c[nH]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461883446 1038651685 /nfs/dbraw/zinc/65/16/85/1038651685.db2.gz JIGCTHJPEBZBOK-VIFPVBQESA-N 1 1 340.305 3.615 20 5 EHBDMO Cc1cc(N[C@H]2CCc3[nH]c[nH+]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461883446 1038651688 /nfs/dbraw/zinc/65/16/88/1038651688.db2.gz JIGCTHJPEBZBOK-VIFPVBQESA-N 1 1 340.305 3.615 20 5 EHBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000190227474 1038908807 /nfs/dbraw/zinc/90/88/07/1038908807.db2.gz MMXTWSWIUDZRAO-LJQANCHMSA-N 1 1 344.411 3.839 20 5 EHBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000033997516 1039315182 /nfs/dbraw/zinc/31/51/82/1039315182.db2.gz DZLNWIAGDHXJDX-UHFFFAOYSA-N 1 1 339.439 3.943 20 5 EHBDMO C[C@@H]1C[C@@H](CCNc2ncccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000511603748 1039429975 /nfs/dbraw/zinc/42/99/75/1039429975.db2.gz MDGPRTLCQXQBDV-NVXWUHKLSA-N 1 1 340.427 3.702 20 5 EHBDMO Cc1c(CN[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494829 1039484070 /nfs/dbraw/zinc/48/40/70/1039484070.db2.gz BEICKWFBVRKEGU-LPHOPBHVSA-N 1 1 339.439 3.828 20 5 EHBDMO Cc1c(CN[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494829 1039484080 /nfs/dbraw/zinc/48/40/80/1039484080.db2.gz BEICKWFBVRKEGU-LPHOPBHVSA-N 1 1 339.439 3.828 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974700 1039520703 /nfs/dbraw/zinc/52/07/03/1039520703.db2.gz IVNBWIURMNDNRF-CZUORRHYSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974700 1039520724 /nfs/dbraw/zinc/52/07/24/1039520724.db2.gz IVNBWIURMNDNRF-CZUORRHYSA-N 1 1 345.374 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC(N3CCCCC3)C1)CCCC2 ZINC000417328096 1039674885 /nfs/dbraw/zinc/67/48/85/1039674885.db2.gz HYHZWDWLIICTKV-NLPFYKDJSA-N 1 1 343.471 3.969 20 5 EHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555170020 1040251593 /nfs/dbraw/zinc/25/15/93/1040251593.db2.gz PVXZWQAVDIMKHL-NEPJUHHUSA-N 1 1 343.349 3.595 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[N@H+](C2CCCC2)CC1 ZINC000490013329 1040308434 /nfs/dbraw/zinc/30/84/34/1040308434.db2.gz LTXJJGGAWCTLAJ-INIZCTEOSA-N 1 1 331.460 3.915 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000490092147 1040352851 /nfs/dbraw/zinc/35/28/51/1040352851.db2.gz YVCISCVTMHAOBR-ZTFGCOKTSA-N 1 1 348.443 3.629 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069279 1040430293 /nfs/dbraw/zinc/43/02/93/1040430293.db2.gz GNHRALPPEIRXMF-HOCLYGCPSA-N 1 1 333.432 3.824 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000490309109 1040491169 /nfs/dbraw/zinc/49/11/69/1040491169.db2.gz SMQHYRDCWDFNQD-TWMKSMIVSA-N 1 1 331.460 3.993 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735775 1040885427 /nfs/dbraw/zinc/88/54/27/1040885427.db2.gz SHPRGLJINCGHBX-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000027906052 1041021628 /nfs/dbraw/zinc/02/16/28/1041021628.db2.gz AXGHYNYUSQEZOY-QGZVFWFLSA-N 1 1 339.395 3.543 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000052039917 1041147969 /nfs/dbraw/zinc/14/79/69/1041147969.db2.gz DCKUTPIVTDPRQP-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cccc(Br)c2)cs1 ZINC000042418871 1041190879 /nfs/dbraw/zinc/19/08/79/1041190879.db2.gz YGDIGTZCCPGMMP-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593194 1042375972 /nfs/dbraw/zinc/37/59/72/1042375972.db2.gz PTUAHWYBLSWISY-MRXNPFEDSA-N 1 1 326.396 3.901 20 5 EHBDMO Cc1[nH+]c(N)ccc1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC001167786431 1042477517 /nfs/dbraw/zinc/47/75/17/1042477517.db2.gz OFRCCKMIVRTNAP-UHFFFAOYSA-N 1 1 326.278 3.511 20 5 EHBDMO COc1cc(F)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000568033617 1042620757 /nfs/dbraw/zinc/62/07/57/1042620757.db2.gz TVQDPLQAYSIADI-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO COc1ccccc1OCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343933825 1042874860 /nfs/dbraw/zinc/87/48/60/1042874860.db2.gz RSUCTYKMRMQVOQ-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000330945803 1042911461 /nfs/dbraw/zinc/91/14/61/1042911461.db2.gz ABSGBCMDOZGHTE-ZDUSSCGKSA-N 1 1 332.322 3.636 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)nc1-c1ccccc1 ZINC000090090084 1043374965 /nfs/dbraw/zinc/37/49/65/1043374965.db2.gz DUUVGTTULUEXPY-OAHLLOKOSA-N 1 1 349.394 3.764 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210858 1044163626 /nfs/dbraw/zinc/16/36/26/1044163626.db2.gz FWIQXLHOROAZRZ-IRXDYDNUSA-N 1 1 331.460 3.681 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000512212894 1044174547 /nfs/dbraw/zinc/17/45/47/1044174547.db2.gz MFSWSWYNDNOWLH-LJQANCHMSA-N 1 1 343.427 3.664 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1CC(C)C ZINC000500465834 1044878726 /nfs/dbraw/zinc/87/87/26/1044878726.db2.gz KHZCEINGVSCTNK-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491632 1127499045 /nfs/dbraw/zinc/49/90/45/1127499045.db2.gz DLYJTQIFZXOEDH-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172235133 1127838512 /nfs/dbraw/zinc/83/85/12/1127838512.db2.gz IXOOHLQXTCJBRD-INIZCTEOSA-N 1 1 347.462 3.802 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cs1 ZINC000282180655 1128037086 /nfs/dbraw/zinc/03/70/86/1128037086.db2.gz VTYMTMUMFTVEAU-AWEZNQCLSA-N 1 1 346.456 3.569 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cs1 ZINC000282180655 1128037087 /nfs/dbraw/zinc/03/70/87/1128037087.db2.gz VTYMTMUMFTVEAU-AWEZNQCLSA-N 1 1 346.456 3.569 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])c1nccs1 ZINC000273134352 1128444186 /nfs/dbraw/zinc/44/41/86/1128444186.db2.gz UISXJBQKVMEFIA-SNVBAGLBSA-N 1 1 325.821 3.940 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000301554965 1128496527 /nfs/dbraw/zinc/49/65/27/1128496527.db2.gz ICXPBAWNVXSAHO-MWLCHTKSSA-N 1 1 329.322 3.651 20 5 EHBDMO COc1cc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609978 1128517237 /nfs/dbraw/zinc/51/72/37/1128517237.db2.gz BUCFYTUYAXOSQV-RHSMWYFYSA-N 1 1 341.411 3.678 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301602408 1128519733 /nfs/dbraw/zinc/51/97/33/1128519733.db2.gz WHTMXMGDPLJALI-RDJZCZTQSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000273790050 1128667549 /nfs/dbraw/zinc/66/75/49/1128667549.db2.gz YLOYFHMQAKAWQL-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2CCCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479643 1120512064 /nfs/dbraw/zinc/51/20/64/1120512064.db2.gz VFNXGYFIOWOILK-PKOBYXMFSA-N 1 1 344.411 3.998 20 5 EHBDMO Cn1cc([C@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000494821119 1120868088 /nfs/dbraw/zinc/86/80/88/1120868088.db2.gz GHBWCWLNEMJRCY-HNNXBMFYSA-N 1 1 336.823 3.859 20 5 EHBDMO CC(C)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCC1 ZINC000193202303 1120975304 /nfs/dbraw/zinc/97/53/04/1120975304.db2.gz VDESHMOBECWEDV-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000193216784 1120985505 /nfs/dbraw/zinc/98/55/05/1120985505.db2.gz AMXCVJNZMWWTIS-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301087857 1121533617 /nfs/dbraw/zinc/53/36/17/1121533617.db2.gz KEYUIKSVPRIXEO-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380199 1121596669 /nfs/dbraw/zinc/59/66/69/1121596669.db2.gz BRNLJXUGSOIIOA-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000193855384 1121721876 /nfs/dbraw/zinc/72/18/76/1121721876.db2.gz CABIXIMAWBLGAY-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccncc2)cs1 ZINC000076895685 1121970218 /nfs/dbraw/zinc/97/02/18/1121970218.db2.gz JTSPTLDVEJRIRX-LBPRGKRZSA-N 1 1 340.408 3.964 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301156647 1122184618 /nfs/dbraw/zinc/18/46/18/1122184618.db2.gz AMKHQXMTYIOXEX-INIZCTEOSA-N 1 1 343.402 3.710 20 5 EHBDMO CC(=O)N1CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000270851361 1129048024 /nfs/dbraw/zinc/04/80/24/1129048024.db2.gz HXNHQMSJEXEMQK-OAHLLOKOSA-N 1 1 345.443 3.523 20 5 EHBDMO CC(=O)N1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000270851361 1129048028 /nfs/dbraw/zinc/04/80/28/1129048028.db2.gz HXNHQMSJEXEMQK-OAHLLOKOSA-N 1 1 345.443 3.523 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCC[C@H]1O ZINC000497144530 1122351346 /nfs/dbraw/zinc/35/13/46/1122351346.db2.gz KMWNSQBAZLRDGV-CRAIPNDOSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@H](CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063476 1122800373 /nfs/dbraw/zinc/80/03/73/1122800373.db2.gz HAYGKLLVMPHCNK-DNVCBOLYSA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)[C@H]1CCc2ccccc2C1 ZINC000919951298 1123243721 /nfs/dbraw/zinc/24/37/21/1123243721.db2.gz QNXXOHVUDFGCKE-SFHVURJKSA-N 1 1 342.443 3.635 20 5 EHBDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000919951994 1123243837 /nfs/dbraw/zinc/24/38/37/1123243837.db2.gz YTTPHTBCIHNNLM-UHFFFAOYSA-N 1 1 342.374 3.952 20 5 EHBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000919951994 1123243839 /nfs/dbraw/zinc/24/38/39/1123243839.db2.gz YTTPHTBCIHNNLM-UHFFFAOYSA-N 1 1 342.374 3.952 20 5 EHBDMO CC(C)[N@H+](Cc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000919953917 1123244609 /nfs/dbraw/zinc/24/46/09/1123244609.db2.gz FHAZOFQQENAIFJ-UHFFFAOYSA-N 1 1 330.413 3.874 20 5 EHBDMO Cc1cc(F)ccc1[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744584 1123554249 /nfs/dbraw/zinc/55/42/49/1123554249.db2.gz LAXLRXJCQCVPFF-LJQANCHMSA-N 1 1 344.386 3.740 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000609705031 1123647549 /nfs/dbraw/zinc/64/75/49/1123647549.db2.gz IGENVMHWRZNIMV-UHFFFAOYSA-N 1 1 332.787 3.555 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000114469303 1129148814 /nfs/dbraw/zinc/14/88/14/1129148814.db2.gz QJMSPUQSZUHKNO-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000114469303 1129148816 /nfs/dbraw/zinc/14/88/16/1129148816.db2.gz QJMSPUQSZUHKNO-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CSCC[N@@H+]2Cc2ccccc2)s1 ZINC000617474764 1124589399 /nfs/dbraw/zinc/58/93/99/1124589399.db2.gz WJZSRFYWMCNMFY-CQSZACIVSA-N 1 1 349.481 3.686 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)s1 ZINC000617474764 1124589402 /nfs/dbraw/zinc/58/94/02/1124589402.db2.gz WJZSRFYWMCNMFY-CQSZACIVSA-N 1 1 349.481 3.686 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccc(F)c(F)c1 ZINC000618680017 1125162204 /nfs/dbraw/zinc/16/22/04/1125162204.db2.gz CJZZBOHWFQFQBW-IUODEOHRSA-N 1 1 339.367 3.792 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccc(F)c(F)c1 ZINC000618680017 1125162207 /nfs/dbraw/zinc/16/22/07/1125162207.db2.gz CJZZBOHWFQFQBW-IUODEOHRSA-N 1 1 339.367 3.792 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938965 1129394418 /nfs/dbraw/zinc/39/44/18/1129394418.db2.gz XQZDCIBXUHPQOP-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3)CC2)cc1F ZINC000374773838 1129396400 /nfs/dbraw/zinc/39/64/00/1129396400.db2.gz FEQFIQFNSFLQGQ-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@H]2CCCc3ccccc32)cc1 ZINC000531163522 1129404922 /nfs/dbraw/zinc/40/49/22/1129404922.db2.gz DNBWVWUVSBXZFN-FQEVSTJZSA-N 1 1 340.423 3.857 20 5 EHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383680 1129504571 /nfs/dbraw/zinc/50/45/71/1129504571.db2.gz CLSQHRJCGPYMRK-QWHCGFSZSA-N 1 1 326.824 3.764 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1F ZINC000173005804 1129554133 /nfs/dbraw/zinc/55/41/33/1129554133.db2.gz ZBKCHEXRUKNZBF-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](n3cccn3)C2)cc1[N+](=O)[O-] ZINC000092967771 1129570140 /nfs/dbraw/zinc/57/01/40/1129570140.db2.gz MDLDLWNTKWRMAA-INIZCTEOSA-N 1 1 328.416 3.752 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214939 1129619627 /nfs/dbraw/zinc/61/96/27/1129619627.db2.gz HVUKIXAKCTWXNN-INIZCTEOSA-N 1 1 342.395 3.602 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])s1 ZINC000390940180 1129643151 /nfs/dbraw/zinc/64/31/51/1129643151.db2.gz PETXPJUQODYMFF-CQSZACIVSA-N 1 1 346.456 3.764 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000391839310 1129687584 /nfs/dbraw/zinc/68/75/84/1129687584.db2.gz LSXIRMWTRAIZTQ-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]3C3CCCC3)n2)cc1 ZINC000055927280 1129790484 /nfs/dbraw/zinc/79/04/84/1129790484.db2.gz ZTKOZVOKWGNXQT-INIZCTEOSA-N 1 1 342.399 3.799 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245561735 1130239048 /nfs/dbraw/zinc/23/90/48/1130239048.db2.gz OHBGQELCUQLXGE-RDTXWAMCSA-N 1 1 340.427 3.760 20 5 EHBDMO CC(C)n1cnnc1[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191464 1130353888 /nfs/dbraw/zinc/35/38/88/1130353888.db2.gz UBSOWEIZGBFNTQ-GDBMZVCRSA-N 1 1 343.431 3.708 20 5 EHBDMO CC[NH+](CC)[C@@H](C(=O)OCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000732350402 1130914559 /nfs/dbraw/zinc/91/45/59/1130914559.db2.gz TWHGVACDAVVVQM-MRXNPFEDSA-N 1 1 348.424 3.783 20 5 EHBDMO CCC1CCC([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742147040 1131691259 /nfs/dbraw/zinc/69/12/59/1131691259.db2.gz YTOHJMCJVRSJPX-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO CCCCC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(=O)OC ZINC001172904967 1131886443 /nfs/dbraw/zinc/88/64/43/1131886443.db2.gz BPTTXTJYHTUVGA-WMZOPIPTSA-N 1 1 348.443 3.554 20 5 EHBDMO CC[N@@H+](Cc1ccncc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172905050 1131887042 /nfs/dbraw/zinc/88/70/42/1131887042.db2.gz BUFMIZWSTBFCNC-GOSISDBHSA-N 1 1 325.412 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1Cc3ccc(F)cc3C1)CC2 ZINC001172915242 1131902480 /nfs/dbraw/zinc/90/24/80/1131902480.db2.gz MNTQDTWKOSHQLG-SFHVURJKSA-N 1 1 326.371 3.997 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCC[C@@H](F)C(F)(F)C1)CC2 ZINC001172909604 1131916994 /nfs/dbraw/zinc/91/69/94/1131916994.db2.gz UBEKSAFZRUCDPM-GOEBONIOSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H](F)C(F)(F)C1)CC2 ZINC001172909604 1131916998 /nfs/dbraw/zinc/91/69/98/1131916998.db2.gz UBEKSAFZRUCDPM-GOEBONIOSA-N 1 1 342.361 3.911 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC(F)(F)CC2)c1F ZINC001173180688 1131992683 /nfs/dbraw/zinc/99/26/83/1131992683.db2.gz LWRVMAZTYDEPQW-NSHDSACASA-N 1 1 346.349 3.795 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCCCC2(F)F)c1F ZINC001173193742 1131995420 /nfs/dbraw/zinc/99/54/20/1131995420.db2.gz WPWCOTQDTDNDKJ-IINYFYTJSA-N 1 1 346.349 3.841 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001173189247 1131995619 /nfs/dbraw/zinc/99/56/19/1131995619.db2.gz JXACYPBALGSAIC-GHMZBOCLSA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CC2CC(F)(F)C2)c1F ZINC001173195474 1131996132 /nfs/dbraw/zinc/99/61/32/1131996132.db2.gz GONQWSJOSQRWBM-SNVBAGLBSA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H]3CCC[C@H]32)c1F ZINC001173196494 1131996762 /nfs/dbraw/zinc/99/67/62/1131996762.db2.gz NAAHBAXLNOBTRT-KCQAQPDRSA-N 1 1 336.407 3.938 20 5 EHBDMO COc1cccc2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173223962 1132005072 /nfs/dbraw/zinc/00/50/72/1132005072.db2.gz CJRGJRLXVZNVCP-AWEZNQCLSA-N 1 1 326.396 3.593 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001173229923 1132007740 /nfs/dbraw/zinc/00/77/40/1132007740.db2.gz BURQXRVNYVUIEF-LBPRGKRZSA-N 1 1 331.803 3.633 20 5 EHBDMO CC[C@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@H]1c1ccccc1 ZINC000746382061 1132504780 /nfs/dbraw/zinc/50/47/80/1132504780.db2.gz LLHYMIIRJVZQLA-FUHWJXTLSA-N 1 1 342.443 3.881 20 5 EHBDMO CC1(C)[C@@H](c2ccccc2F)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175454431 1132686603 /nfs/dbraw/zinc/68/66/03/1132686603.db2.gz STUNELFNLJBWEK-OAHLLOKOSA-N 1 1 329.375 3.897 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539513 1132781628 /nfs/dbraw/zinc/78/16/28/1132781628.db2.gz OLJXNAQUIOADKG-QAPCUYQASA-N 1 1 332.444 3.921 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001176940888 1133012684 /nfs/dbraw/zinc/01/26/84/1133012684.db2.gz WFZHFZJHJRMLBI-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001176940888 1133012688 /nfs/dbraw/zinc/01/26/88/1133012688.db2.gz WFZHFZJHJRMLBI-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766238 1133050288 /nfs/dbraw/zinc/05/02/88/1133050288.db2.gz RLKANKYCLLOLJY-AWEZNQCLSA-N 1 1 331.420 3.506 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000768093615 1133090939 /nfs/dbraw/zinc/09/09/39/1133090939.db2.gz PABCGYAWAFGTPT-GJZGRUSLSA-N 1 1 335.448 3.519 20 5 EHBDMO CC1(C)CCC[N@H+]1CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178933658 1133210696 /nfs/dbraw/zinc/21/06/96/1133210696.db2.gz BIMJCWVDAMBAOZ-UHFFFAOYSA-N 1 1 343.427 3.819 20 5 EHBDMO CC1(C)CCCN1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178933658 1133210701 /nfs/dbraw/zinc/21/07/01/1133210701.db2.gz BIMJCWVDAMBAOZ-UHFFFAOYSA-N 1 1 343.427 3.819 20 5 EHBDMO O=C1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCCN1 ZINC000769109028 1133228118 /nfs/dbraw/zinc/22/81/18/1133228118.db2.gz PNSNVVDHKLIGKU-UHFFFAOYSA-N 1 1 338.838 3.968 20 5 EHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483375 1133288982 /nfs/dbraw/zinc/28/89/82/1133288982.db2.gz MNSYVIMCBYMZKI-CPSHHHPTSA-N 1 1 340.423 3.972 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180505086 1133387016 /nfs/dbraw/zinc/38/70/16/1133387016.db2.gz FQGJBXFPEZWUHV-UHFFFAOYSA-N 1 1 342.395 3.962 20 5 EHBDMO C[C@H]1CSCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181444479 1133487922 /nfs/dbraw/zinc/48/79/22/1133487922.db2.gz ALPBRXDQWYJMIO-SNVBAGLBSA-N 1 1 334.363 3.799 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001182127294 1133574890 /nfs/dbraw/zinc/57/48/90/1133574890.db2.gz MLFFGXFDULBYJD-CQSZACIVSA-N 1 1 326.396 3.995 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001183065583 1133765431 /nfs/dbraw/zinc/76/54/31/1133765431.db2.gz MLSXESXADMACEB-UHFFFAOYSA-N 1 1 343.427 3.864 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001183065583 1133765436 /nfs/dbraw/zinc/76/54/36/1133765436.db2.gz MLSXESXADMACEB-UHFFFAOYSA-N 1 1 343.427 3.864 20 5 EHBDMO CC[N@@H+](CCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC001185179832 1134044386 /nfs/dbraw/zinc/04/43/86/1134044386.db2.gz HLJZFJIUOYXRFM-UHFFFAOYSA-N 1 1 331.338 3.818 20 5 EHBDMO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788630394 1134153906 /nfs/dbraw/zinc/15/39/06/1134153906.db2.gz GYGZNDTUHYTNKX-SNVBAGLBSA-N 1 1 344.396 3.744 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789457009 1134277545 /nfs/dbraw/zinc/27/75/45/1134277545.db2.gz PZYVNJZTYSWLJK-QGZVFWFLSA-N 1 1 348.830 3.938 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508204 1134288233 /nfs/dbraw/zinc/28/82/33/1134288233.db2.gz ZUZYNILOULPDBO-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170344337 1134758310 /nfs/dbraw/zinc/75/83/10/1134758310.db2.gz ANQYNCPAECPRFN-CQSZACIVSA-N 1 1 346.402 3.848 20 5 EHBDMO Cc1ccc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000793614187 1134973120 /nfs/dbraw/zinc/97/31/20/1134973120.db2.gz OPTZFIXGZKWIQD-UONOGXRCSA-N 1 1 329.227 3.919 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000793614187 1134973126 /nfs/dbraw/zinc/97/31/26/1134973126.db2.gz OPTZFIXGZKWIQD-UONOGXRCSA-N 1 1 329.227 3.919 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000804812739 1135201843 /nfs/dbraw/zinc/20/18/43/1135201843.db2.gz SHZWFUFIHVRMKF-HXUWFJFHSA-N 1 1 337.423 3.697 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001194101956 1135233044 /nfs/dbraw/zinc/23/30/44/1135233044.db2.gz SSHWULMHTFZTQC-QGZVFWFLSA-N 1 1 348.830 3.938 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001194101956 1135233050 /nfs/dbraw/zinc/23/30/50/1135233050.db2.gz SSHWULMHTFZTQC-QGZVFWFLSA-N 1 1 348.830 3.938 20 5 EHBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@H](C)C1 ZINC001194714603 1135311626 /nfs/dbraw/zinc/31/16/26/1135311626.db2.gz IWFYJJRIKUUNMX-YOEHRIQHSA-N 1 1 347.459 3.875 20 5 EHBDMO Cc1c(C[N@H+]2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250333 1135398857 /nfs/dbraw/zinc/39/88/57/1135398857.db2.gz MBUCTEKVNBDKTA-CZUORRHYSA-N 1 1 348.443 3.703 20 5 EHBDMO CCCCC[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329082 1135546388 /nfs/dbraw/zinc/54/63/88/1135546388.db2.gz KZTXKRFUMCOYPX-INIZCTEOSA-N 1 1 333.432 3.629 20 5 EHBDMO Cc1ccc(C[C@@]2(C)CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC001196595265 1135582509 /nfs/dbraw/zinc/58/25/09/1135582509.db2.gz RILZXLKFOXSNPH-LJQANCHMSA-N 1 1 325.412 3.895 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)c(F)c1 ZINC001197283386 1135672687 /nfs/dbraw/zinc/67/26/87/1135672687.db2.gz BHKRZLWOBZZZHT-HNNXBMFYSA-N 1 1 336.407 3.763 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001197752357 1135734630 /nfs/dbraw/zinc/73/46/30/1135734630.db2.gz ZTYSLMCQWWRNML-UHFFFAOYSA-N 1 1 326.400 3.536 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCc2nc[nH]c2C12CCCCC2 ZINC001197752357 1135734635 /nfs/dbraw/zinc/73/46/35/1135734635.db2.gz ZTYSLMCQWWRNML-UHFFFAOYSA-N 1 1 326.400 3.536 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(Nc3cc(C4CC4)cc[nH+]3)CC2)cc1 ZINC000810258748 1135944214 /nfs/dbraw/zinc/94/42/14/1135944214.db2.gz VGFKSUDGFLRGPM-UHFFFAOYSA-N 1 1 338.411 3.948 20 5 EHBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000810623583 1135982318 /nfs/dbraw/zinc/98/23/18/1135982318.db2.gz XWDHSJPTEOSWSL-JTQLQIEISA-N 1 1 345.380 3.560 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276601 1136131009 /nfs/dbraw/zinc/13/10/09/1136131009.db2.gz KUIQHEYPXLVLRI-PIGZYNQJSA-N 1 1 336.338 3.599 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279830 1136133541 /nfs/dbraw/zinc/13/35/41/1136133541.db2.gz ZELIPEADOGLSBY-BEFAXECRSA-N 1 1 328.412 3.938 20 5 EHBDMO Cc1ccc(C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000776280079 1136133717 /nfs/dbraw/zinc/13/37/17/1136133717.db2.gz ZJULPOUDGYHJKM-KRWDZBQOSA-N 1 1 334.441 3.909 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847511 1136259386 /nfs/dbraw/zinc/25/93/86/1136259386.db2.gz DSJZYOMGWITDER-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO CCCC[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173045 1136297623 /nfs/dbraw/zinc/29/76/23/1136297623.db2.gz SDRIELXOTGEIJI-YOEHRIQHSA-N 1 1 334.416 3.539 20 5 EHBDMO CCCC[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173045 1136297626 /nfs/dbraw/zinc/29/76/26/1136297626.db2.gz SDRIELXOTGEIJI-YOEHRIQHSA-N 1 1 334.416 3.539 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585017 1136442531 /nfs/dbraw/zinc/44/25/31/1136442531.db2.gz QXZCMFQLLSPSJU-VPWXQRGCSA-N 1 1 340.423 3.815 20 5 EHBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585343 1136442554 /nfs/dbraw/zinc/44/25/54/1136442554.db2.gz WASMTHCBEOFIGG-ACJLOTCBSA-N 1 1 348.830 3.845 20 5 EHBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581324 1136444962 /nfs/dbraw/zinc/44/49/62/1136444962.db2.gz CLIOXAAXPCXIEO-RBUKOAKNSA-N 1 1 328.412 3.957 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591252 1136451237 /nfs/dbraw/zinc/45/12/37/1136451237.db2.gz IETFKUXXOIPIBY-RTBURBONSA-N 1 1 344.386 3.995 20 5 EHBDMO Cn1cc(-c2ccc(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])s2)cn1 ZINC000338946462 1136464922 /nfs/dbraw/zinc/46/49/22/1136464922.db2.gz WYDGRSKXHCECAD-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1cc(-c2ccc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])s2)cn1 ZINC000338946462 1136464926 /nfs/dbraw/zinc/46/49/26/1136464926.db2.gz WYDGRSKXHCECAD-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1ccc(C(F)F)cc1[N+](=O)[O-])CC2 ZINC000853468102 1136535098 /nfs/dbraw/zinc/53/50/98/1136535098.db2.gz VWINSBKUCTXIKG-UHFFFAOYSA-N 1 1 325.359 3.597 20 5 EHBDMO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815596610 1136617001 /nfs/dbraw/zinc/61/70/01/1136617001.db2.gz YUIWBCYXVYXNOZ-LKFCYVNXSA-N 1 1 333.775 3.615 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030876 1136933851 /nfs/dbraw/zinc/93/38/51/1136933851.db2.gz BZNAVAYJTYHFIJ-RHSMWYFYSA-N 1 1 327.384 3.513 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000858038966 1136934645 /nfs/dbraw/zinc/93/46/45/1136934645.db2.gz QVAUXUNRUQCEMS-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000858038966 1136934647 /nfs/dbraw/zinc/93/46/47/1136934647.db2.gz QVAUXUNRUQCEMS-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1nc(F)ccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824820973 1137153787 /nfs/dbraw/zinc/15/37/87/1137153787.db2.gz RSALAEKRXPIWSW-MRXNPFEDSA-N 1 1 329.375 3.817 20 5 EHBDMO NC(CCC(F)(F)F)=[NH+]OCc1ccc([N+](=O)[O-])cc1Cl ZINC000863490644 1137189039 /nfs/dbraw/zinc/18/90/39/1137189039.db2.gz PELFVVVZBQWNSG-UHFFFAOYSA-N 1 1 325.674 3.589 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000794629050 1137221727 /nfs/dbraw/zinc/22/17/27/1137221727.db2.gz QUXRNFUZLZPKKQ-UHFFFAOYSA-N 1 1 345.399 3.507 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000794629050 1137221728 /nfs/dbraw/zinc/22/17/28/1137221728.db2.gz QUXRNFUZLZPKKQ-UHFFFAOYSA-N 1 1 345.399 3.507 20 5 EHBDMO CN(c1ccc([N+](=O)[O-])cc1C(F)F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000865799143 1137312668 /nfs/dbraw/zinc/31/26/68/1137312668.db2.gz JOYCKBSUJAKPDC-QYJAPNMZSA-N 1 1 325.359 3.594 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nc2cc(F)ccc2n1C ZINC000772996871 1137446443 /nfs/dbraw/zinc/44/64/43/1137446443.db2.gz HZAHFJIQJGSOIC-GFCCVEGCSA-N 1 1 342.374 3.780 20 5 EHBDMO Cc1cc(C)c(COC(=O)c2c(F)ccc([N+](=O)[O-])c2F)c(C)[nH+]1 ZINC000869430059 1137451495 /nfs/dbraw/zinc/45/14/95/1137451495.db2.gz WKPBDWCFVUCSLG-UHFFFAOYSA-N 1 1 336.294 3.550 20 5 EHBDMO CC1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC(F)(F)C1 ZINC000873198151 1137593804 /nfs/dbraw/zinc/59/38/04/1137593804.db2.gz UFPHWOZLZBMJNN-UHFFFAOYSA-N 1 1 339.367 3.996 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000877553516 1137681185 /nfs/dbraw/zinc/68/11/85/1137681185.db2.gz UPJCMYMJBBAWMB-SFHVURJKSA-N 1 1 330.428 3.603 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CCCC1 ZINC000877925049 1137695861 /nfs/dbraw/zinc/69/58/61/1137695861.db2.gz OWFFTXRVIKWULY-UHFFFAOYSA-N 1 1 336.779 3.673 20 5 EHBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000877963998 1137697293 /nfs/dbraw/zinc/69/72/93/1137697293.db2.gz ACJBAVWYYPWFGK-UHFFFAOYSA-N 1 1 336.779 3.671 20 5 EHBDMO CC[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878183168 1137706213 /nfs/dbraw/zinc/70/62/13/1137706213.db2.gz CSHMOSWWOUFWTQ-SNVBAGLBSA-N 1 1 336.779 3.530 20 5 EHBDMO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)[nH]n1 ZINC000879918307 1137762552 /nfs/dbraw/zinc/76/25/52/1137762552.db2.gz ABSUNHPTQFYEBL-AWEZNQCLSA-N 1 1 346.406 3.960 20 5 EHBDMO CC(C)c1cc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)n[nH]1 ZINC000879918307 1137762553 /nfs/dbraw/zinc/76/25/53/1137762553.db2.gz ABSUNHPTQFYEBL-AWEZNQCLSA-N 1 1 346.406 3.960 20 5 EHBDMO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)n[nH]1 ZINC000879918307 1137762554 /nfs/dbraw/zinc/76/25/54/1137762554.db2.gz ABSUNHPTQFYEBL-AWEZNQCLSA-N 1 1 346.406 3.960 20 5 EHBDMO Cc1noc(C[N@@H+]2CCCSC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000880388082 1137777654 /nfs/dbraw/zinc/77/76/54/1137777654.db2.gz IDOBHHMYPLBJLS-AWEZNQCLSA-N 1 1 333.413 3.571 20 5 EHBDMO Cc1noc(C[N@H+]2CCCSC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000880388082 1137777655 /nfs/dbraw/zinc/77/76/55/1137777655.db2.gz IDOBHHMYPLBJLS-AWEZNQCLSA-N 1 1 333.413 3.571 20 5 EHBDMO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000883329948 1137855336 /nfs/dbraw/zinc/85/53/36/1137855336.db2.gz UWMUEVKAWQXCPC-INIZCTEOSA-N 1 1 346.358 3.746 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338011827 1138723238 /nfs/dbraw/zinc/72/32/38/1138723238.db2.gz QEOCSBDLMILIHX-NEPJUHHUSA-N 1 1 333.363 3.939 20 5 EHBDMO CC(C)OC(=O)C[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275500 1141492126 /nfs/dbraw/zinc/49/21/26/1141492126.db2.gz BYVYDFNBGKKQDA-LSDHHAIUSA-N 1 1 334.416 3.710 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1C ZINC000430229894 1015134019 /nfs/dbraw/zinc/13/40/19/1015134019.db2.gz WBGYGVLBLOSGPA-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1C ZINC000430229894 1015134022 /nfs/dbraw/zinc/13/40/22/1015134022.db2.gz WBGYGVLBLOSGPA-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000339905660 1015874351 /nfs/dbraw/zinc/87/43/51/1015874351.db2.gz ACRSNBYAROOWAZ-MRXNPFEDSA-N 1 1 336.395 3.609 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000175387470 1016121942 /nfs/dbraw/zinc/12/19/42/1016121942.db2.gz OSCXTPLFXHBZBX-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000175387470 1016121943 /nfs/dbraw/zinc/12/19/43/1016121943.db2.gz OSCXTPLFXHBZBX-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO CC[C@@H](C)[N@@H+](CCc1ccccc1F)Cc1onc(C)c1[N+](=O)[O-] ZINC001167244548 1016741637 /nfs/dbraw/zinc/74/16/37/1016741637.db2.gz UPZJFGDOCVSHMD-GFCCVEGCSA-N 1 1 335.379 3.874 20 5 EHBDMO COc1ccc(C[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000414844372 1017237664 /nfs/dbraw/zinc/23/76/64/1017237664.db2.gz KTGVGBROVQZQFC-QGZVFWFLSA-N 1 1 343.427 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4c[nH]nc4c3)C2)cc1 ZINC000449500938 1032678980 /nfs/dbraw/zinc/67/89/80/1032678980.db2.gz OSNGRZIZDGBKGI-QGZVFWFLSA-N 1 1 336.395 3.851 20 5 EHBDMO CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]CC1 ZINC000414720663 1017155121 /nfs/dbraw/zinc/15/51/21/1017155121.db2.gz ZIZSWXQVIAAIDN-OAHLLOKOSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[C@@H]1C[C@@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503967 1032687679 /nfs/dbraw/zinc/68/76/79/1032687679.db2.gz VGLPYUHZRPUFTF-VDZJLULYSA-N 1 1 332.444 3.979 20 5 EHBDMO CC1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]CC1 ZINC000414933303 1017339886 /nfs/dbraw/zinc/33/98/86/1017339886.db2.gz DOMUOJZNTFEFCI-UHFFFAOYSA-N 1 1 331.441 3.555 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2cc(N)ccc2O1 ZINC000415036427 1017427871 /nfs/dbraw/zinc/42/78/71/1017427871.db2.gz NQWKWVYBOBOYAB-INIZCTEOSA-N 1 1 345.374 3.708 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000177242527 1017602137 /nfs/dbraw/zinc/60/21/37/1017602137.db2.gz SJLTUPUEZRNPAJ-JTQLQIEISA-N 1 1 344.358 3.825 20 5 EHBDMO Cc1nc2ccccc2nc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282396150 1018108176 /nfs/dbraw/zinc/10/81/76/1018108176.db2.gz HGUKHJYHDJEIKL-UHFFFAOYSA-N 1 1 336.395 3.521 20 5 EHBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000119645165 1018177877 /nfs/dbraw/zinc/17/78/77/1018177877.db2.gz MXWJCWFRCOYFNF-JTQLQIEISA-N 1 1 334.759 3.828 20 5 EHBDMO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866481 1018543639 /nfs/dbraw/zinc/54/36/39/1018543639.db2.gz AJWDMJSBDYDBJB-AAEUAGOBSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866481 1018543649 /nfs/dbraw/zinc/54/36/49/1018543649.db2.gz AJWDMJSBDYDBJB-AAEUAGOBSA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000594008453 1032771017 /nfs/dbraw/zinc/77/10/17/1032771017.db2.gz OXEPKSFPMUSJKW-INIZCTEOSA-N 1 1 341.411 3.557 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000322473399 1019119176 /nfs/dbraw/zinc/11/91/76/1019119176.db2.gz PFBGZDFNODWRKA-XGWLTEMNSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433517 1019125296 /nfs/dbraw/zinc/12/52/96/1019125296.db2.gz PJCFFHQZCSWPFS-OXJNMPFZSA-N 1 1 339.439 3.862 20 5 EHBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000513188287 1019388750 /nfs/dbraw/zinc/38/87/50/1019388750.db2.gz NYRLWHSNYMICDW-JTQLQIEISA-N 1 1 330.775 3.975 20 5 EHBDMO CC(C)C[C@H](C)N(C)C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513398686 1019615751 /nfs/dbraw/zinc/61/57/51/1019615751.db2.gz XOFFNXQTBOPOBM-INIZCTEOSA-N 1 1 349.475 3.698 20 5 EHBDMO CC(C)C[C@H](C)N(C)C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513398686 1019615763 /nfs/dbraw/zinc/61/57/63/1019615763.db2.gz XOFFNXQTBOPOBM-INIZCTEOSA-N 1 1 349.475 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3nccnc3c2)C2CC2)cc1 ZINC000602438714 1032888467 /nfs/dbraw/zinc/88/84/67/1032888467.db2.gz HVUGYWQJQMPTSE-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610476502 1020415191 /nfs/dbraw/zinc/41/51/91/1020415191.db2.gz WIKVCDAYICLDAS-USXIJHARSA-N 1 1 336.407 3.759 20 5 EHBDMO Cc1ccc(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495390 1021179108 /nfs/dbraw/zinc/17/91/08/1021179108.db2.gz LJEWIPBXNMKGSW-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495390 1021179114 /nfs/dbraw/zinc/17/91/14/1021179114.db2.gz LJEWIPBXNMKGSW-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495390 1021179122 /nfs/dbraw/zinc/17/91/22/1021179122.db2.gz LJEWIPBXNMKGSW-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO C[N@H+](CCCOCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439487872 1021478758 /nfs/dbraw/zinc/47/87/58/1021478758.db2.gz UKSJKAHCPLNDRZ-UHFFFAOYSA-N 1 1 332.375 3.773 20 5 EHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439487872 1021478760 /nfs/dbraw/zinc/47/87/60/1021478760.db2.gz UKSJKAHCPLNDRZ-UHFFFAOYSA-N 1 1 332.375 3.773 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CCCC[C@H]1CC ZINC000518746228 1021505035 /nfs/dbraw/zinc/50/50/35/1021505035.db2.gz NFLUVCGVUBHOPI-OAHLLOKOSA-N 1 1 348.447 3.543 20 5 EHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670758 1021639112 /nfs/dbraw/zinc/63/91/12/1021639112.db2.gz RHBUNVPQVBMEIP-ZIAGYGMSSA-N 1 1 334.416 3.623 20 5 EHBDMO CCC(CC)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000519192566 1021915582 /nfs/dbraw/zinc/91/55/82/1021915582.db2.gz KPUGICGZJNLRRN-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000178206078 1022147460 /nfs/dbraw/zinc/14/74/60/1022147460.db2.gz FEJMSCZAEZJKDM-AWEZNQCLSA-N 1 1 349.337 3.552 20 5 EHBDMO COc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(Cl)cc1O ZINC000602630311 1033042555 /nfs/dbraw/zinc/04/25/55/1033042555.db2.gz ANNGBZOSFAVQQB-UHFFFAOYSA-N 1 1 336.775 3.561 20 5 EHBDMO CCc1ccc(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000471802843 1022280613 /nfs/dbraw/zinc/28/06/13/1022280613.db2.gz DCSYSHOUEJPKQS-OAHLLOKOSA-N 1 1 347.459 3.542 20 5 EHBDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266489132 1022661917 /nfs/dbraw/zinc/66/19/17/1022661917.db2.gz RUIDUSKUUNXZBS-OLZOCXBDSA-N 1 1 327.384 3.965 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000550188380 1022677699 /nfs/dbraw/zinc/67/76/99/1022677699.db2.gz LLQBIONRTDOPFA-SFHVURJKSA-N 1 1 336.432 3.629 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000550188380 1022677708 /nfs/dbraw/zinc/67/77/08/1022677708.db2.gz LLQBIONRTDOPFA-SFHVURJKSA-N 1 1 336.432 3.629 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn4ccnc4s3)C2)cc1 ZINC000894722124 1022818346 /nfs/dbraw/zinc/81/83/46/1022818346.db2.gz ILSODVDMWCWXSL-CQSZACIVSA-N 1 1 342.424 3.684 20 5 EHBDMO Cc1c(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697645 1022903434 /nfs/dbraw/zinc/90/34/34/1022903434.db2.gz IEQQEGLSNQLCNF-HXUWFJFHSA-N 1 1 340.423 3.775 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@H]4CCCC[C@@H]43)nc2c1 ZINC000610619597 1023010599 /nfs/dbraw/zinc/01/05/99/1023010599.db2.gz JAAPWJNVWHQAPU-ZFWWWQNUSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@H]4CCCC[C@@H]43)nc2c1 ZINC000610619597 1023010612 /nfs/dbraw/zinc/01/06/12/1023010612.db2.gz JAAPWJNVWHQAPU-ZFWWWQNUSA-N 1 1 333.413 3.596 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003549 1023081621 /nfs/dbraw/zinc/08/16/21/1023081621.db2.gz WLQJUULOZPGUBZ-ZFWWWQNUSA-N 1 1 329.375 3.981 20 5 EHBDMO COc1ccc(OCC[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000441476440 1023097759 /nfs/dbraw/zinc/09/77/59/1023097759.db2.gz POUOFLFSBIRUEM-IJEWVQPXSA-N 1 1 334.416 3.635 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000276979530 1023536014 /nfs/dbraw/zinc/53/60/14/1023536014.db2.gz YCNBOSQEFLDZJM-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000276979530 1023536022 /nfs/dbraw/zinc/53/60/22/1023536022.db2.gz YCNBOSQEFLDZJM-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1[N+](=O)[O-] ZINC000895346570 1024345605 /nfs/dbraw/zinc/34/56/05/1024345605.db2.gz JDKGCTAEYLKSFE-MRXNPFEDSA-N 1 1 348.374 3.935 20 5 EHBDMO Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000507796902 1024424585 /nfs/dbraw/zinc/42/45/85/1024424585.db2.gz OJTRLODBPUKXIC-AWEZNQCLSA-N 1 1 346.818 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000505559741 1024484204 /nfs/dbraw/zinc/48/42/04/1024484204.db2.gz MGMNOTLBAWHEJC-HXUWFJFHSA-N 1 1 340.423 3.819 20 5 EHBDMO CS[C@@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538796205 1024509966 /nfs/dbraw/zinc/50/99/66/1024509966.db2.gz USEJVXAYWWIOKS-CYBMUJFWSA-N 1 1 346.399 3.914 20 5 EHBDMO CS[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538796205 1024509979 /nfs/dbraw/zinc/50/99/79/1024509979.db2.gz USEJVXAYWWIOKS-CYBMUJFWSA-N 1 1 346.399 3.914 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@@H]12 ZINC000248454667 1024770155 /nfs/dbraw/zinc/77/01/55/1024770155.db2.gz ZOMHRVPJMGIDPC-KCXAZCMYSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@@H]1C[C@H](C[NH3+])CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371218 1024856167 /nfs/dbraw/zinc/85/61/67/1024856167.db2.gz LYFSNRFNLKWPGL-VXGBXAGGSA-N 1 1 349.818 3.677 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602889967 1033244323 /nfs/dbraw/zinc/24/43/23/1033244323.db2.gz XROGWXZLYJIYCE-HNNXBMFYSA-N 1 1 334.379 3.528 20 5 EHBDMO O=[N+]([O-])c1cccc(CNC[C@H]2CCC[N@H+]2CC2CCCCC2)c1 ZINC000520974069 1025141234 /nfs/dbraw/zinc/14/12/34/1025141234.db2.gz QPSHVGQERVHJQE-LJQANCHMSA-N 1 1 331.460 3.729 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896227662 1025262380 /nfs/dbraw/zinc/26/23/80/1025262380.db2.gz NUNQXHYFWUEOTB-MFBWXBCUSA-N 1 1 344.308 3.974 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C1CCCC1 ZINC000425440809 1025285544 /nfs/dbraw/zinc/28/55/44/1025285544.db2.gz CFJDDMVXZVKDGE-CQSZACIVSA-N 1 1 328.416 3.834 20 5 EHBDMO CC(C)C[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000092008613 1025350361 /nfs/dbraw/zinc/35/03/61/1025350361.db2.gz ISSUCOHKWBOKEZ-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000521424639 1025382332 /nfs/dbraw/zinc/38/23/32/1025382332.db2.gz QWNHDIBXDHKWKR-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240800 1025489289 /nfs/dbraw/zinc/48/92/89/1025489289.db2.gz RFGPMOAFHOPEDG-TZMCWYRMSA-N 1 1 333.432 3.741 20 5 EHBDMO CCn1c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)nc2cc(F)ccc21 ZINC000451101488 1025559741 /nfs/dbraw/zinc/55/97/41/1025559741.db2.gz DDYPTNWDJSJBDY-LBPRGKRZSA-N 1 1 342.374 3.954 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478227 1025658976 /nfs/dbraw/zinc/65/89/76/1025658976.db2.gz HEEKVOKEPUDIPW-OCCSQVGLSA-N 1 1 330.388 3.655 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000451376244 1025907861 /nfs/dbraw/zinc/90/78/61/1025907861.db2.gz ODCSZQPHIPMMJW-UHFFFAOYSA-N 1 1 349.818 3.901 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000020813829 1025984953 /nfs/dbraw/zinc/98/49/53/1025984953.db2.gz TUJZMIWHRBSYKU-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000020813829 1025984965 /nfs/dbraw/zinc/98/49/65/1025984965.db2.gz TUJZMIWHRBSYKU-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000451544728 1026091112 /nfs/dbraw/zinc/09/11/12/1026091112.db2.gz FPIIBRHRPQTHED-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000451544728 1026091130 /nfs/dbraw/zinc/09/11/30/1026091130.db2.gz FPIIBRHRPQTHED-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO Cc1nccn1CCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552113 1026105250 /nfs/dbraw/zinc/10/52/50/1026105250.db2.gz VQYRHQSTVZTRPE-GOSISDBHSA-N 1 1 342.443 3.760 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1NCC2 ZINC000469870662 1026124999 /nfs/dbraw/zinc/12/49/99/1026124999.db2.gz LDHXDAKYBROUKM-UHFFFAOYSA-N 1 1 325.412 3.973 20 5 EHBDMO CCC(CC)n1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511124607 1026241520 /nfs/dbraw/zinc/24/15/20/1026241520.db2.gz SWGNCGZRIZXXSA-UHFFFAOYSA-N 1 1 330.432 3.827 20 5 EHBDMO CCC(CC)n1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511124607 1026241528 /nfs/dbraw/zinc/24/15/28/1026241528.db2.gz SWGNCGZRIZXXSA-UHFFFAOYSA-N 1 1 330.432 3.827 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCc4ccccc4CC3)nc2c1 ZINC000451711836 1026244687 /nfs/dbraw/zinc/24/46/87/1026244687.db2.gz PKBPWJNNDMXYOL-UHFFFAOYSA-N 1 1 337.379 3.727 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000523010913 1026356502 /nfs/dbraw/zinc/35/65/02/1026356502.db2.gz ZSNBQSLSJYTZNR-HNNXBMFYSA-N 1 1 344.386 3.807 20 5 EHBDMO CC(=O)c1ccc(NCCCC[N@@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000076795445 1027323593 /nfs/dbraw/zinc/32/35/93/1027323593.db2.gz PGLAFOHJCRRWLA-AWEZNQCLSA-N 1 1 333.432 3.721 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccccc2)CC2(CO)CC2)cc1[N+](=O)[O-] ZINC000342863857 1027719853 /nfs/dbraw/zinc/71/98/53/1027719853.db2.gz SLMHSBZSBIVJCF-UHFFFAOYSA-N 1 1 340.423 3.678 20 5 EHBDMO CCC[N@@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000533397913 1027766681 /nfs/dbraw/zinc/76/66/81/1027766681.db2.gz DJZKMVFLGKPNPW-GOSISDBHSA-N 1 1 341.411 3.925 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000420955711 1027924405 /nfs/dbraw/zinc/92/44/05/1027924405.db2.gz WZCMMJLKOBGGRV-LBPRGKRZSA-N 1 1 332.322 3.638 20 5 EHBDMO N[C@@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915003 1028048929 /nfs/dbraw/zinc/04/89/29/1028048929.db2.gz AFEQBXDCYLHTAI-RTBURBONSA-N 1 1 325.412 3.652 20 5 EHBDMO CCOc1cccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444680630 1028152143 /nfs/dbraw/zinc/15/21/43/1028152143.db2.gz QKMOBBIFQMUWGK-LBPRGKRZSA-N 1 1 340.383 3.721 20 5 EHBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(F)c1 ZINC000444684106 1028154801 /nfs/dbraw/zinc/15/48/01/1028154801.db2.gz KJJBLJPEZRAQQI-UHFFFAOYSA-N 1 1 328.347 3.635 20 5 EHBDMO Cc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444746182 1028233313 /nfs/dbraw/zinc/23/33/13/1028233313.db2.gz VADPJBNAFFWQQC-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444746182 1028233331 /nfs/dbraw/zinc/23/33/31/1028233331.db2.gz VADPJBNAFFWQQC-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC1CCC1)C(C)C ZINC000444776237 1028266934 /nfs/dbraw/zinc/26/69/34/1028266934.db2.gz OWCFZNOEDHSHOM-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[NH2+]C[C@@H](C)CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285342 1028324065 /nfs/dbraw/zinc/32/40/65/1028324065.db2.gz ZJWABFRPJBNPGT-CHWSQXEVSA-N 1 1 333.457 3.829 20 5 EHBDMO COCC[N@@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000519918403 1028358071 /nfs/dbraw/zinc/35/80/71/1028358071.db2.gz QBQJMQJTTYINFF-UHFFFAOYSA-N 1 1 328.412 3.594 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755655 1028799793 /nfs/dbraw/zinc/79/97/93/1028799793.db2.gz IEFLGEFNMYCIEZ-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1ccccc1N1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000487513863 1028811345 /nfs/dbraw/zinc/81/13/45/1028811345.db2.gz LMDLGEYFWKCLEM-INIZCTEOSA-N 1 1 325.412 3.786 20 5 EHBDMO C[N@@H+](CCc1ccccn1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183734320 1029320390 /nfs/dbraw/zinc/32/03/90/1029320390.db2.gz BUBQRPFOAYIHBC-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000524755274 1029485098 /nfs/dbraw/zinc/48/50/98/1029485098.db2.gz LKSWVULIBUDBKR-GOSISDBHSA-N 1 1 325.412 3.998 20 5 EHBDMO CC(C)CCn1cccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446843709 1029824721 /nfs/dbraw/zinc/82/47/21/1029824721.db2.gz PBZPWFZFJYFBAX-UHFFFAOYSA-N 1 1 341.415 3.609 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594503 1030331341 /nfs/dbraw/zinc/33/13/41/1030331341.db2.gz ZHZQKXUOYBHFRW-WMLDXEAASA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594503 1030331352 /nfs/dbraw/zinc/33/13/52/1030331352.db2.gz ZHZQKXUOYBHFRW-WMLDXEAASA-N 1 1 347.459 3.661 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)n1 ZINC000526954269 1030503035 /nfs/dbraw/zinc/50/30/35/1030503035.db2.gz DPUKKFPPBRUGII-FRRDWIJNSA-N 1 1 330.388 3.887 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623431 1030793652 /nfs/dbraw/zinc/79/36/52/1030793652.db2.gz AFUFJFGCNGIEKP-XHDPSFHLSA-N 1 1 339.823 3.697 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000448373541 1031008337 /nfs/dbraw/zinc/00/83/37/1031008337.db2.gz QXENEWKJHXDPNB-INIZCTEOSA-N 1 1 332.425 3.526 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245073 1031052045 /nfs/dbraw/zinc/05/20/45/1031052045.db2.gz GVPCKCZBQIEQLU-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+](CC2CC2)CC2CCC2)cccc1[N+](=O)[O-] ZINC000483269248 1031078730 /nfs/dbraw/zinc/07/87/30/1031078730.db2.gz RECUWKIQMLSUMT-UHFFFAOYSA-N 1 1 345.443 3.744 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000475741016 1031736558 /nfs/dbraw/zinc/73/65/58/1031736558.db2.gz WHJUIDMUBJQCLR-IPYPFGDCSA-N 1 1 333.432 3.598 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485948 1033365720 /nfs/dbraw/zinc/36/57/20/1033365720.db2.gz TZRWEYUWGDVNRN-HIFRSBDPSA-N 1 1 334.445 3.508 20 5 EHBDMO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594522407 1033431220 /nfs/dbraw/zinc/43/12/20/1033431220.db2.gz LGXPWCOLLGVUPP-WQFPPAFTSA-N 1 1 328.343 3.833 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000595039017 1033658641 /nfs/dbraw/zinc/65/86/41/1033658641.db2.gz CFDYWXQKFAFKCC-ZDUSSCGKSA-N 1 1 341.411 3.728 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000599072757 1033714075 /nfs/dbraw/zinc/71/40/75/1033714075.db2.gz HIKYCHLDMIVTKF-MAUKXSAKSA-N 1 1 340.427 3.754 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073934 1033717368 /nfs/dbraw/zinc/71/73/68/1033717368.db2.gz NDPCZMGQGRPLNZ-PBHICJAKSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073934 1033717385 /nfs/dbraw/zinc/71/73/85/1033717385.db2.gz NDPCZMGQGRPLNZ-PBHICJAKSA-N 1 1 347.459 3.661 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](C)c2ccccc2)c1 ZINC000592996992 1033778532 /nfs/dbraw/zinc/77/85/32/1033778532.db2.gz PAGYXHZLHPASGZ-CYBMUJFWSA-N 1 1 328.368 3.574 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)c2ccccc2)c1 ZINC000592996992 1033778540 /nfs/dbraw/zinc/77/85/40/1033778540.db2.gz PAGYXHZLHPASGZ-CYBMUJFWSA-N 1 1 328.368 3.574 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000595375214 1033783432 /nfs/dbraw/zinc/78/34/32/1033783432.db2.gz QHDQMOQFNICCHK-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595393694 1033785761 /nfs/dbraw/zinc/78/57/61/1033785761.db2.gz QAYPBKGMRXWWPQ-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595393694 1033785772 /nfs/dbraw/zinc/78/57/72/1033785772.db2.gz QAYPBKGMRXWWPQ-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO Cc1noc(C[N@H+]2CCCC[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595404028 1033809477 /nfs/dbraw/zinc/80/94/77/1033809477.db2.gz PBIQVVGSMXCURZ-MRXNPFEDSA-N 1 1 329.400 3.879 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2F)[C@H](C)O)cc1[N+](=O)[O-] ZINC000593714637 1033820831 /nfs/dbraw/zinc/82/08/31/1033820831.db2.gz IODILSKDWOLKSC-ZJNRKIDTSA-N 1 1 332.375 3.815 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1CC=CC1)[C@H]1CC[C@H](O)CC1 ZINC000595562811 1033844352 /nfs/dbraw/zinc/84/43/52/1033844352.db2.gz MFJDXHRVTHWPNJ-IYARVYRRSA-N 1 1 330.428 3.667 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCCO2 ZINC000063994965 1033934447 /nfs/dbraw/zinc/93/44/47/1033934447.db2.gz TUEPMHCQXQWJPT-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1c(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976012 1033969319 /nfs/dbraw/zinc/96/93/19/1033969319.db2.gz KRQPAHPXSNRLEN-AUUYWEPGSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976012 1033969329 /nfs/dbraw/zinc/96/93/29/1033969329.db2.gz KRQPAHPXSNRLEN-AUUYWEPGSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)C1 ZINC000603855872 1033980522 /nfs/dbraw/zinc/98/05/22/1033980522.db2.gz CBQHJWPKTVVVRN-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](C4CCC4)C3)o2)cc1 ZINC000595839450 1034004254 /nfs/dbraw/zinc/00/42/54/1034004254.db2.gz YMGJOYDFBOOJOV-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552826 1034005124 /nfs/dbraw/zinc/00/51/24/1034005124.db2.gz JJJGQWKPRCJDNY-CVEARBPZSA-N 1 1 336.457 3.852 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000596308485 1034165046 /nfs/dbraw/zinc/16/50/46/1034165046.db2.gz STONXNBSUVACKW-CYBMUJFWSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3CCC[N@@H+](CC4CC4)C3)c2c1 ZINC000596570368 1034293715 /nfs/dbraw/zinc/29/37/15/1034293715.db2.gz IQQLELYAFRUDDQ-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO CC(C)[N@H+](Cc1ccnn1CC1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980212 1034478628 /nfs/dbraw/zinc/47/86/28/1034478628.db2.gz WFNZBPKRXHGBDE-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO CC(C)[N@@H+](Cc1ccnn1CC1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980212 1034478634 /nfs/dbraw/zinc/47/86/34/1034478634.db2.gz WFNZBPKRXHGBDE-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000534473967 1034599242 /nfs/dbraw/zinc/59/92/42/1034599242.db2.gz DYFUIKPECIEVCP-UHFFFAOYSA-N 1 1 338.407 3.707 20 5 EHBDMO CC(C)c1ccc([C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000534665854 1034791234 /nfs/dbraw/zinc/79/12/34/1034791234.db2.gz OBDZWWVZYXQTHK-KRWDZBQOSA-N 1 1 328.416 3.752 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000412001750 1035275012 /nfs/dbraw/zinc/27/50/12/1035275012.db2.gz QZQJEBMFOIQPQV-LJQANCHMSA-N 1 1 338.407 3.949 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000412001750 1035275015 /nfs/dbraw/zinc/27/50/15/1035275015.db2.gz QZQJEBMFOIQPQV-LJQANCHMSA-N 1 1 338.407 3.949 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CCCC[N@@H+]1CC(C)C ZINC000443386890 1035612268 /nfs/dbraw/zinc/61/22/68/1035612268.db2.gz NOXJWHYFXGQWCJ-MRXNPFEDSA-N 1 1 348.447 3.535 20 5 EHBDMO O=[N+]([O-])c1cccnc1NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000386471252 1035661907 /nfs/dbraw/zinc/66/19/07/1035661907.db2.gz UUMXEUUIOZNXEC-KRWDZBQOSA-N 1 1 340.427 3.704 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(C)n2)cc1[N+](=O)[O-] ZINC000414165716 1035847681 /nfs/dbraw/zinc/84/76/81/1035847681.db2.gz MLWUJOGNRDKSIM-CQSZACIVSA-N 1 1 329.400 3.856 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C)c(C)n2)cc1[N+](=O)[O-] ZINC000414165715 1035849774 /nfs/dbraw/zinc/84/97/74/1035849774.db2.gz MLWUJOGNRDKSIM-AWEZNQCLSA-N 1 1 329.400 3.856 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2c(F)cccc2OC)ccc1[N+](=O)[O-] ZINC000492579587 1036026065 /nfs/dbraw/zinc/02/60/65/1036026065.db2.gz BBRKLTAALYJSCU-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCO1 ZINC000511505769 1036273324 /nfs/dbraw/zinc/27/33/24/1036273324.db2.gz FZRMAPSMYZQSHX-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO CCCC[C@@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000589310156 1036355596 /nfs/dbraw/zinc/35/55/96/1036355596.db2.gz ZDZOOFJMMWZDCK-LLVKDONJSA-N 1 1 327.812 3.697 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120123649 1036356718 /nfs/dbraw/zinc/35/67/18/1036356718.db2.gz APSJKHFVNMHLIA-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120123649 1036356738 /nfs/dbraw/zinc/35/67/38/1036356738.db2.gz APSJKHFVNMHLIA-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000589500078 1036439867 /nfs/dbraw/zinc/43/98/67/1036439867.db2.gz QXFGMDVUMSYHOA-LJQANCHMSA-N 1 1 344.411 3.704 20 5 EHBDMO Cc1ccc([C@@H](O)C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000174709973 1036615736 /nfs/dbraw/zinc/61/57/36/1036615736.db2.gz OXOQQNWJKIQPGN-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO Cc1ccc([C@@H](O)C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000174709973 1036615743 /nfs/dbraw/zinc/61/57/43/1036615743.db2.gz OXOQQNWJKIQPGN-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000464690477 1036670671 /nfs/dbraw/zinc/67/06/71/1036670671.db2.gz VZYPBGXYAJZHJM-ZDUSSCGKSA-N 1 1 342.436 3.850 20 5 EHBDMO C[C@H](CNc1cccc(F)c1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000057138167 1036720010 /nfs/dbraw/zinc/72/00/10/1036720010.db2.gz NIXOZLGOYZZSBM-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO Cc1ccccc1[C@@H]([C@@H](C)NCc1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000443004429 1036794628 /nfs/dbraw/zinc/79/46/28/1036794628.db2.gz DCUCOYVGOFRNTM-OXQOHEQNSA-N 1 1 341.455 3.993 20 5 EHBDMO O=[N+]([O-])c1cc2c(cc1CNc1ccc(C3CCC3)c[nH+]1)OCCO2 ZINC000590196139 1036796178 /nfs/dbraw/zinc/79/61/78/1036796178.db2.gz SCMHTWNPLQLVMU-UHFFFAOYSA-N 1 1 341.367 3.641 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2CCCc2ccccc2)n1 ZINC000443637414 1036914026 /nfs/dbraw/zinc/91/40/26/1036914026.db2.gz IYBLFRPPGGQMPV-GOSISDBHSA-N 1 1 342.443 3.669 20 5 EHBDMO COc1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1OC ZINC000892632005 1036952032 /nfs/dbraw/zinc/95/20/32/1036952032.db2.gz QZRWYTPBMWBWRM-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO C[N@@H+](CCCNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000761522474 1037089816 /nfs/dbraw/zinc/08/98/16/1037089816.db2.gz QKUHVTGCPTZJLX-UHFFFAOYSA-N 1 1 347.846 3.860 20 5 EHBDMO CN(CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000761522474 1037089834 /nfs/dbraw/zinc/08/98/34/1037089834.db2.gz QKUHVTGCPTZJLX-UHFFFAOYSA-N 1 1 347.846 3.860 20 5 EHBDMO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1CCCC[C@@H]1C ZINC000761520409 1037098287 /nfs/dbraw/zinc/09/82/87/1037098287.db2.gz FAYVCUCMLRBQLX-STQMWFEESA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@@H]1C ZINC000761520409 1037098306 /nfs/dbraw/zinc/09/83/06/1037098306.db2.gz FAYVCUCMLRBQLX-STQMWFEESA-N 1 1 325.840 3.601 20 5 EHBDMO CCC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824618 1037226540 /nfs/dbraw/zinc/22/65/40/1037226540.db2.gz JBFXZQMYXOGVGJ-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824618 1037226556 /nfs/dbraw/zinc/22/65/56/1037226556.db2.gz JBFXZQMYXOGVGJ-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000016445412 1037238739 /nfs/dbraw/zinc/23/87/39/1037238739.db2.gz DGMKHVIINGYSLN-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cc2ncc([C@H](C)[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])c(C)n2n1 ZINC000271834735 1037429006 /nfs/dbraw/zinc/42/90/06/1037429006.db2.gz VALVTDXIFSZFNC-STQMWFEESA-N 1 1 339.399 3.666 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](NCC[NH+]2CCCCC2)c2ccccc2)c1 ZINC000491383429 1037437117 /nfs/dbraw/zinc/43/71/17/1037437117.db2.gz RKUXIADBPDDEFC-HXUWFJFHSA-N 1 1 339.439 3.760 20 5 EHBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789393 1037532319 /nfs/dbraw/zinc/53/23/19/1037532319.db2.gz MCQOUCOXQPPUKP-HBUWYVDXSA-N 1 1 344.411 3.836 20 5 EHBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000491595644 1037575340 /nfs/dbraw/zinc/57/53/40/1037575340.db2.gz CDVYCOQPSXPJTF-CYBMUJFWSA-N 1 1 333.457 3.611 20 5 EHBDMO Cc1ccc(NC(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000045951309 1037579637 /nfs/dbraw/zinc/57/96/37/1037579637.db2.gz QQHNQPUFYLLNKR-HNNXBMFYSA-N 1 1 348.447 3.679 20 5 EHBDMO COc1cc(C[NH2+]C2(c3ccccc3C)CC2)c([N+](=O)[O-])cc1F ZINC000592139421 1037857475 /nfs/dbraw/zinc/85/74/75/1037857475.db2.gz FVEPNYZZBHIUBI-UHFFFAOYSA-N 1 1 330.359 3.830 20 5 EHBDMO Cc1ccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC2CC2)cn1 ZINC000592145498 1037867208 /nfs/dbraw/zinc/86/72/08/1037867208.db2.gz SLTLNIHQOIFUMG-UHFFFAOYSA-N 1 1 325.412 3.753 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000251926361 1037884902 /nfs/dbraw/zinc/88/49/02/1037884902.db2.gz STHCQQPZNJQXQX-YOEHRIQHSA-N 1 1 347.459 3.521 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc3cc(Cl)ccc3n2C)cc1[N+](=O)[O-] ZINC000494221571 1037913443 /nfs/dbraw/zinc/91/34/43/1037913443.db2.gz YUEGOFKDWXXJKF-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO CC[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104673464 1038451630 /nfs/dbraw/zinc/45/16/30/1038451630.db2.gz GLUFCWJTGIKWFU-AWEZNQCLSA-N 1 1 329.400 3.914 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC(C)(C)O ZINC000538726563 1038508824 /nfs/dbraw/zinc/50/88/24/1038508824.db2.gz DWQNJZBVENZTAX-UHFFFAOYSA-N 1 1 334.441 3.916 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000365794661 1038540333 /nfs/dbraw/zinc/54/03/33/1038540333.db2.gz KSULLOJIQAOJOW-MRXNPFEDSA-N 1 1 343.339 3.546 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000365794661 1038540338 /nfs/dbraw/zinc/54/03/38/1038540338.db2.gz KSULLOJIQAOJOW-MRXNPFEDSA-N 1 1 343.339 3.546 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461962776 1038698727 /nfs/dbraw/zinc/69/87/27/1038698727.db2.gz XNBQVPIGJGCHMY-GFCCVEGCSA-N 1 1 345.365 3.700 20 5 EHBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511562609 1038731076 /nfs/dbraw/zinc/73/10/76/1038731076.db2.gz WUQAULMKRJOFIL-SJORKVTESA-N 1 1 336.432 3.507 20 5 EHBDMO Cc1cccc([C@H]2CCCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000478008174 1039112668 /nfs/dbraw/zinc/11/26/68/1039112668.db2.gz CVADXDOSTQAOSJ-QGZVFWFLSA-N 1 1 328.416 3.717 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](O)C23CCCC3)o1 ZINC000552316901 1039200286 /nfs/dbraw/zinc/20/02/86/1039200286.db2.gz RXOQSCQKQBJZOH-GOSISDBHSA-N 1 1 342.395 3.734 20 5 EHBDMO COc1cc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000485548154 1039228881 /nfs/dbraw/zinc/22/88/81/1039228881.db2.gz TVSFCUVGNHRLLH-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000015366927 1039277277 /nfs/dbraw/zinc/27/72/77/1039277277.db2.gz JETZQMOLTQZULR-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000015366927 1039277286 /nfs/dbraw/zinc/27/72/86/1039277286.db2.gz JETZQMOLTQZULR-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1Br ZINC000190319201 1039304651 /nfs/dbraw/zinc/30/46/51/1039304651.db2.gz WVFFMNAUPHPIAB-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417553 1039430806 /nfs/dbraw/zinc/43/08/06/1039430806.db2.gz NTJAGIRNARRXBM-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000054669943 1039453730 /nfs/dbraw/zinc/45/37/30/1039453730.db2.gz QORLRXRZTAMMRP-GOSISDBHSA-N 1 1 340.379 3.798 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cn3ccccc3n1)CCCC2 ZINC000417308086 1039660454 /nfs/dbraw/zinc/66/04/54/1039660454.db2.gz FAMNDVICFNRUJH-SFHVURJKSA-N 1 1 336.395 3.800 20 5 EHBDMO COc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991068 1039764344 /nfs/dbraw/zinc/76/43/44/1039764344.db2.gz BOYFCGANNOVSKY-KDOFPFPSSA-N 1 1 345.374 3.600 20 5 EHBDMO O=[N+]([O-])c1cc(CNc2[nH]c3ccccc3[nH+]2)cc(C(F)(F)F)c1 ZINC000486035247 1039787235 /nfs/dbraw/zinc/78/72/35/1039787235.db2.gz JLKBUWGDMLIHDI-UHFFFAOYSA-N 1 1 336.273 3.524 20 5 EHBDMO O=C(CC[N@@H+](Cc1cccs1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000027109479 1039897885 /nfs/dbraw/zinc/89/78/85/1039897885.db2.gz JTHLFYRIYAWHIF-UHFFFAOYSA-N 1 1 345.424 3.650 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+](C)[C@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883321 1039906162 /nfs/dbraw/zinc/90/61/62/1039906162.db2.gz CBQBIHZRHARFPP-CQSZACIVSA-N 1 1 346.452 3.867 20 5 EHBDMO C[C@@H]([N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000027132900 1039938550 /nfs/dbraw/zinc/93/85/50/1039938550.db2.gz NEJSCMALINTLCJ-SNVBAGLBSA-N 1 1 327.812 3.553 20 5 EHBDMO CC(C)CO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549472534 1039957753 /nfs/dbraw/zinc/95/77/53/1039957753.db2.gz XIAILNLYEJCWGM-AWEZNQCLSA-N 1 1 346.349 3.861 20 5 EHBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549472534 1039957770 /nfs/dbraw/zinc/95/77/70/1039957770.db2.gz XIAILNLYEJCWGM-AWEZNQCLSA-N 1 1 346.349 3.861 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000490019317 1040310783 /nfs/dbraw/zinc/31/07/83/1040310783.db2.gz JGWSERDMQYZCOK-GOSISDBHSA-N 1 1 325.412 3.714 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042479 1040317232 /nfs/dbraw/zinc/31/72/32/1040317232.db2.gz VQNBYVJQIFRNLF-LJQANCHMSA-N 1 1 326.396 3.767 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000486772277 1040427854 /nfs/dbraw/zinc/42/78/54/1040427854.db2.gz KPEPJLIIRNVDEB-CQSZACIVSA-N 1 1 349.431 3.587 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000600198327 1040821147 /nfs/dbraw/zinc/82/11/47/1040821147.db2.gz WMOWPLBDTPRTQR-ZBFHGGJFSA-N 1 1 348.443 3.703 20 5 EHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182645 1040944484 /nfs/dbraw/zinc/94/44/84/1040944484.db2.gz NEFVVCIDCFUKLO-LLVKDONJSA-N 1 1 346.374 3.868 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721023 1041043671 /nfs/dbraw/zinc/04/36/71/1041043671.db2.gz FJQLBDLEXLWSPX-LSDHHAIUSA-N 1 1 342.399 3.655 20 5 EHBDMO CC(=O)c1cc(NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000587257381 1041167630 /nfs/dbraw/zinc/16/76/30/1041167630.db2.gz OBXUWRGXZJIHDH-GASCZTMLSA-N 1 1 347.459 3.967 20 5 EHBDMO CC(=O)Oc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000155721954 1041197033 /nfs/dbraw/zinc/19/70/33/1041197033.db2.gz LXAVTOUNKHEOEC-UHFFFAOYSA-N 1 1 340.379 3.685 20 5 EHBDMO Cc1ccc(CNc2c(C)cccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000119527201 1042380736 /nfs/dbraw/zinc/38/07/36/1042380736.db2.gz WVKKMTLNSBSCKF-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000093889139 1042577314 /nfs/dbraw/zinc/57/73/14/1042577314.db2.gz BOLIXRGAGDXEAI-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000093889139 1042577317 /nfs/dbraw/zinc/57/73/17/1042577317.db2.gz BOLIXRGAGDXEAI-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697750 1126856744 /nfs/dbraw/zinc/85/67/44/1126856744.db2.gz SIPRZQUQFUHMJU-DZGCQCFKSA-N 1 1 329.400 3.913 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000083170875 1127221153 /nfs/dbraw/zinc/22/11/53/1127221153.db2.gz AVFYGWYVPCSIGW-ZDUSSCGKSA-N 1 1 341.342 3.865 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000764490315 1127498420 /nfs/dbraw/zinc/49/84/20/1127498420.db2.gz PFKJYYJDIXNFRW-UHFFFAOYSA-N 1 1 341.367 3.710 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039955 1127568889 /nfs/dbraw/zinc/56/88/89/1127568889.db2.gz USRGYCZPIAHOLJ-DZGCQCFKSA-N 1 1 348.472 3.816 20 5 EHBDMO COC(=O)c1csc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000552275257 1127728256 /nfs/dbraw/zinc/72/82/56/1127728256.db2.gz PNLCMCUPRXDAGX-GHMZBOCLSA-N 1 1 334.397 3.855 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CCCC3)C2)cc1OC(F)F ZINC000301390937 1127741647 /nfs/dbraw/zinc/74/16/47/1127741647.db2.gz GSUPZOMURGVWEL-LBPRGKRZSA-N 1 1 341.358 3.625 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ncc(C)cc2[N+](=O)[O-])cc1F ZINC000301411688 1127742660 /nfs/dbraw/zinc/74/26/60/1127742660.db2.gz ACSJQRQKQBJUQT-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO Cc1cnc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444914 1127892063 /nfs/dbraw/zinc/89/20/63/1127892063.db2.gz NRPXYXQGNBOLEV-XJKSGUPXSA-N 1 1 346.456 3.855 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000301459489 1128337020 /nfs/dbraw/zinc/33/70/20/1128337020.db2.gz YLVFVAIHBNFXIL-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NCCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000301570342 1128501077 /nfs/dbraw/zinc/50/10/77/1128501077.db2.gz OBAIRNQITFOYQS-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO Cc1cc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000301650586 1128849667 /nfs/dbraw/zinc/84/96/67/1128849667.db2.gz GHWWXSUNMNQIAG-INIZCTEOSA-N 1 1 346.475 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000609196220 1120543564 /nfs/dbraw/zinc/54/35/64/1120543564.db2.gz HBVXKTCUJRYNNT-MRXNPFEDSA-N 1 1 344.386 3.992 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000301057862 1121198246 /nfs/dbraw/zinc/19/82/46/1121198246.db2.gz CDXCYGIDWPWLSM-UHFFFAOYSA-N 1 1 347.365 3.950 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2sccc2C1 ZINC000301061723 1121281854 /nfs/dbraw/zinc/28/18/54/1121281854.db2.gz CIOAHWUAPDWDEA-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2sccc2C1 ZINC000301061723 1121281856 /nfs/dbraw/zinc/28/18/56/1121281856.db2.gz CIOAHWUAPDWDEA-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000301064037 1121293083 /nfs/dbraw/zinc/29/30/83/1121293083.db2.gz CQUJEELNPRZTKX-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[NH+](C)C ZINC000609223261 1121569006 /nfs/dbraw/zinc/56/90/06/1121569006.db2.gz CHQFUIWLOAKYPU-LLVKDONJSA-N 1 1 337.807 3.548 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000301100849 1121692227 /nfs/dbraw/zinc/69/22/27/1121692227.db2.gz OIRKZNIQPGXCHA-YVMONPNESA-N 1 1 341.386 3.569 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000272722562 1121963865 /nfs/dbraw/zinc/96/38/65/1121963865.db2.gz XSTVDMBNNZSCNK-OWCLPIDISA-N 1 1 331.460 3.898 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000153801552 1122016922 /nfs/dbraw/zinc/01/69/22/1122016922.db2.gz HKBFEXFYPQVOCO-LBPRGKRZSA-N 1 1 333.388 3.956 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301788529 1129071203 /nfs/dbraw/zinc/07/12/03/1129071203.db2.gz PWIIBULWHPASRI-DOMZBBRYSA-N 1 1 335.835 3.701 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894618 1123172002 /nfs/dbraw/zinc/17/20/02/1123172002.db2.gz CLXAZBCJPHOICK-SFHVURJKSA-N 1 1 342.439 3.754 20 5 EHBDMO C[N@H+]1CCC[C@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486195 1123375042 /nfs/dbraw/zinc/37/50/42/1123375042.db2.gz SGADYMTWMPUJBV-QMMMGPOBSA-N 1 1 337.729 3.773 20 5 EHBDMO CC(C)[N@H+](CC(=O)NC1CCCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350525 1123573536 /nfs/dbraw/zinc/57/35/36/1123573536.db2.gz KGTHOEACINWVKJ-UHFFFAOYSA-N 1 1 347.459 3.644 20 5 EHBDMO CC(C)[N@@H+](CC(=O)NC1CCCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350525 1123573538 /nfs/dbraw/zinc/57/35/38/1123573538.db2.gz KGTHOEACINWVKJ-UHFFFAOYSA-N 1 1 347.459 3.644 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])s3)CC2)s1 ZINC000609965178 1123698943 /nfs/dbraw/zinc/69/89/43/1123698943.db2.gz GSQJJYRPEMRZID-UHFFFAOYSA-N 1 1 337.470 3.602 20 5 EHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001842 1123710449 /nfs/dbraw/zinc/71/04/49/1123710449.db2.gz DSIHTARBBOQNJP-CXAGYDPISA-N 1 1 334.416 3.862 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000610003515 1123711688 /nfs/dbraw/zinc/71/16/88/1123711688.db2.gz GUFJCGIUAPDLOV-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO CCCN1CCC([NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652743 1123727622 /nfs/dbraw/zinc/72/76/22/1123727622.db2.gz MSVNPZWOQGSMKV-CQSZACIVSA-N 1 1 335.448 3.519 20 5 EHBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(OC)c1 ZINC000195677104 1123734377 /nfs/dbraw/zinc/73/43/77/1123734377.db2.gz HJTMVJMMBKFRJC-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610133495 1123739341 /nfs/dbraw/zinc/73/93/41/1123739341.db2.gz TXKNXJHAQJDJTI-CSMYWGQOSA-N 1 1 336.407 3.759 20 5 EHBDMO CO[C@H](C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808755 1125410439 /nfs/dbraw/zinc/41/04/39/1125410439.db2.gz ZIJBKBQBJGCBEK-LJQANCHMSA-N 1 1 326.396 3.947 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735493607 1131353642 /nfs/dbraw/zinc/35/36/42/1131353642.db2.gz YRAHKXJKGUYCEQ-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000301972796 1129466017 /nfs/dbraw/zinc/46/60/17/1129466017.db2.gz IQIMZINESXNHAG-ZDUSSCGKSA-N 1 1 339.411 3.522 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439706 1129489990 /nfs/dbraw/zinc/48/99/90/1129489990.db2.gz HHOAKQILQQZDBW-HXUWFJFHSA-N 1 1 340.423 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000391464447 1129668252 /nfs/dbraw/zinc/66/82/52/1129668252.db2.gz ZDSQZFTUUYPUFJ-UXLLHSPISA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000302013103 1129763440 /nfs/dbraw/zinc/76/34/40/1129763440.db2.gz ZQZTYSPZFDRXMG-UHFFFAOYSA-N 1 1 345.468 3.801 20 5 EHBDMO C[C@@H]1CCN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302016334 1129763498 /nfs/dbraw/zinc/76/34/98/1129763498.db2.gz LVBGUAKCUYQTLL-CQSZACIVSA-N 1 1 331.441 3.757 20 5 EHBDMO Cc1cc(N2CC[NH+](C3CCCC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302211957 1129773732 /nfs/dbraw/zinc/77/37/32/1129773732.db2.gz YWHWMEOYKGAUBZ-UHFFFAOYSA-N 1 1 340.427 3.516 20 5 EHBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000031002396 1129937287 /nfs/dbraw/zinc/93/72/87/1129937287.db2.gz RMGRAMGAWDYTBZ-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000031002396 1129937290 /nfs/dbraw/zinc/93/72/90/1129937290.db2.gz RMGRAMGAWDYTBZ-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@@H]21 ZINC000133725272 1129960962 /nfs/dbraw/zinc/96/09/62/1129960962.db2.gz VMMSMZOUGUFLHJ-FZMZJTMJSA-N 1 1 343.349 3.534 20 5 EHBDMO COC(=O)c1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000429234699 1130138955 /nfs/dbraw/zinc/13/89/55/1130138955.db2.gz HETFKVOOSVSGHP-UHFFFAOYSA-N 1 1 346.358 3.545 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000245472201 1130219946 /nfs/dbraw/zinc/21/99/46/1130219946.db2.gz OSCXTPLFXHBZBX-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1c(C[N@H+](C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000245472201 1130219951 /nfs/dbraw/zinc/21/99/51/1130219951.db2.gz OSCXTPLFXHBZBX-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094962 1130342603 /nfs/dbraw/zinc/34/26/03/1130342603.db2.gz AJWDMJSBDYDBJB-DGCLKSJQSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094962 1130342609 /nfs/dbraw/zinc/34/26/09/1130342609.db2.gz AJWDMJSBDYDBJB-DGCLKSJQSA-N 1 1 348.353 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCOC3(CCCCC3)C1)CC2 ZINC001172919218 1131903882 /nfs/dbraw/zinc/90/38/82/1131903882.db2.gz FJECSIYOXIKXDK-GOSISDBHSA-N 1 1 344.455 3.877 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC4(CCCC4)C3)c2)cc1 ZINC000743390563 1131909151 /nfs/dbraw/zinc/90/91/51/1131909151.db2.gz GAPXXCZXVIDYNE-UHFFFAOYSA-N 1 1 326.400 3.682 20 5 EHBDMO CCC(CC)[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015415 1131935310 /nfs/dbraw/zinc/93/53/10/1131935310.db2.gz PLNOAXBNNNICFH-UHFFFAOYSA-N 1 1 341.402 3.962 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223967 1132005292 /nfs/dbraw/zinc/00/52/92/1132005292.db2.gz CKWYELAXGZOPQT-ZKYQVNSYSA-N 1 1 334.313 3.606 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173229401 1132008550 /nfs/dbraw/zinc/00/85/50/1132008550.db2.gz UEOARKIPPZGBHD-CQSZACIVSA-N 1 1 326.396 3.593 20 5 EHBDMO COc1ccc(CC[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173232749 1132010113 /nfs/dbraw/zinc/01/01/13/1132010113.db2.gz HNKHKFZLCJWVHP-OAHLLOKOSA-N 1 1 328.412 3.709 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC/C=C/c1cccnc1 ZINC001173233419 1132010613 /nfs/dbraw/zinc/01/06/13/1132010613.db2.gz WNEIFMGALGZERO-GIZXNFQBSA-N 1 1 325.412 3.956 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001173238089 1132027743 /nfs/dbraw/zinc/02/77/43/1132027743.db2.gz MXBKHSMOVKBUDF-MRXNPFEDSA-N 1 1 345.487 3.865 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](CCc2ccccc2)C2CC2)cc1 ZINC000746114430 1132377463 /nfs/dbraw/zinc/37/74/63/1132377463.db2.gz HGBNGDPRAZNVLJ-UHFFFAOYSA-N 1 1 326.396 3.681 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC001175759555 1132759495 /nfs/dbraw/zinc/75/94/95/1132759495.db2.gz XITDGFOHENTEOR-SNVBAGLBSA-N 1 1 327.222 3.978 20 5 EHBDMO CCOc1ccc(CC[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001176832833 1133004881 /nfs/dbraw/zinc/00/48/81/1133004881.db2.gz KFMBXLFNWRAJQJ-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCC1 ZINC001177133521 1133033603 /nfs/dbraw/zinc/03/36/03/1133033603.db2.gz XMYGUZZPPJYUEX-UHFFFAOYSA-N 1 1 343.427 3.819 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@@H+]1CCC[C@@H](C)C1 ZINC001177474814 1133066267 /nfs/dbraw/zinc/06/62/67/1133066267.db2.gz HCKJYVKLBDDKOT-YKOQKNPDSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001177474814 1133066270 /nfs/dbraw/zinc/06/62/70/1133066270.db2.gz HCKJYVKLBDDKOT-YKOQKNPDSA-N 1 1 331.460 3.708 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000768093618 1133091543 /nfs/dbraw/zinc/09/15/43/1133091543.db2.gz PABCGYAWAFGTPT-LSDHHAIUSA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c2c(n1)CCCC2 ZINC001180011596 1133316453 /nfs/dbraw/zinc/31/64/53/1133316453.db2.gz PLBKSBVJNRCHTO-UHFFFAOYSA-N 1 1 325.412 3.809 20 5 EHBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c2c(n1)CCCC2 ZINC001180011596 1133316458 /nfs/dbraw/zinc/31/64/58/1133316458.db2.gz PLBKSBVJNRCHTO-UHFFFAOYSA-N 1 1 325.412 3.809 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954225 1133365734 /nfs/dbraw/zinc/36/57/34/1133365734.db2.gz QJRIHCWEQBEFPK-VLXJIEOASA-N 1 1 344.386 3.775 20 5 EHBDMO Cc1nn(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000770669182 1133457122 /nfs/dbraw/zinc/45/71/22/1133457122.db2.gz BQOZKNXVQIFMKS-CYBMUJFWSA-N 1 1 328.416 3.723 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC1CC1 ZINC000771283681 1133530254 /nfs/dbraw/zinc/53/02/54/1133530254.db2.gz HWHDKSINUNSYOS-UHFFFAOYSA-N 1 1 331.460 3.933 20 5 EHBDMO O=[N+]([O-])c1cc2cnn(C[N@@H+](C3CC3)C3CCCC3)c2c(Cl)c1 ZINC000774634402 1133809168 /nfs/dbraw/zinc/80/91/68/1133809168.db2.gz HJQZVXWRPOSAMI-UHFFFAOYSA-N 1 1 334.807 3.962 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000774733146 1133912976 /nfs/dbraw/zinc/91/29/76/1133912976.db2.gz KZQTZDOKSUAHBE-UHFFFAOYSA-N 1 1 347.802 3.999 20 5 EHBDMO C[C@@H](OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879804 1133923562 /nfs/dbraw/zinc/92/35/62/1133923562.db2.gz DVQCHOSYMBRABG-DYVFJYSZSA-N 1 1 332.400 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000746666723 1133986484 /nfs/dbraw/zinc/98/64/84/1133986484.db2.gz PPCBXXNUHCDAGK-UHFFFAOYSA-N 1 1 332.787 3.555 20 5 EHBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120042 1134079525 /nfs/dbraw/zinc/07/95/25/1134079525.db2.gz PQAPPXSIVUFZQG-JSGCOSHPSA-N 1 1 346.408 3.593 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000774883952 1134092602 /nfs/dbraw/zinc/09/26/02/1134092602.db2.gz FTCFWZAMIJRFEL-CYBMUJFWSA-N 1 1 345.330 3.632 20 5 EHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788471806 1134129486 /nfs/dbraw/zinc/12/94/86/1134129486.db2.gz UDAHJPFBAOMKSI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329060 1134749049 /nfs/dbraw/zinc/74/90/49/1134749049.db2.gz NVNNDWBXFAZDSU-KBXCAEBGSA-N 1 1 341.411 3.767 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329028 1134749433 /nfs/dbraw/zinc/74/94/33/1134749433.db2.gz NGJAINQNLUDCDD-NHYWBVRUSA-N 1 1 346.349 3.604 20 5 EHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191538674 1134881327 /nfs/dbraw/zinc/88/13/27/1134881327.db2.gz CKZWOWSYDQYTQY-LLVKDONJSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192213383 1134981599 /nfs/dbraw/zinc/98/15/99/1134981599.db2.gz IHPLHGOLBBFRLH-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192213383 1134981602 /nfs/dbraw/zinc/98/16/02/1134981602.db2.gz IHPLHGOLBBFRLH-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(n3c[nH+]c4c3CCCC4)CC2)cc1 ZINC000793971747 1135008525 /nfs/dbraw/zinc/00/85/25/1135008525.db2.gz NRTZPPFOVYBYNT-UHFFFAOYSA-N 1 1 326.400 3.512 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000804564494 1135121867 /nfs/dbraw/zinc/12/18/67/1135121867.db2.gz WWXZAOGNVYCPLP-DOMZBBRYSA-N 1 1 335.835 3.701 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCCCC2 ZINC001194476959 1135276454 /nfs/dbraw/zinc/27/64/54/1135276454.db2.gz GJINHGCPKJEPKG-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834348 1135333012 /nfs/dbraw/zinc/33/30/12/1135333012.db2.gz FXIKGSHGOYLJKN-MSOLQXFVSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccc(C)cc1C)CC(C)C ZINC001195413701 1135420852 /nfs/dbraw/zinc/42/08/52/1135420852.db2.gz QTSUAKATQJGOQV-UHFFFAOYSA-N 1 1 344.459 3.875 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC001195842863 1135479985 /nfs/dbraw/zinc/47/99/85/1135479985.db2.gz IKJSFKKMXFPHHX-UHFFFAOYSA-N 1 1 341.411 3.791 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@]1(C)Cc1ccc(C)cc1 ZINC001196595337 1135582301 /nfs/dbraw/zinc/58/23/01/1135582301.db2.gz SBTSZDVGSYZOQJ-IBGZPJMESA-N 1 1 342.443 3.505 20 5 EHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761673 1135729464 /nfs/dbraw/zinc/72/94/64/1135729464.db2.gz QHDLGQJFXNWVHT-OALUTQOASA-N 1 1 344.411 3.720 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001198790271 1135853606 /nfs/dbraw/zinc/85/36/06/1135853606.db2.gz FXSAWFLHBIYWMK-OAHLLOKOSA-N 1 1 326.824 3.885 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001198790271 1135853609 /nfs/dbraw/zinc/85/36/09/1135853609.db2.gz FXSAWFLHBIYWMK-OAHLLOKOSA-N 1 1 326.824 3.885 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809768236 1135880700 /nfs/dbraw/zinc/88/07/00/1135880700.db2.gz FORJQKUYNLGZJU-OAHLLOKOSA-N 1 1 334.807 3.925 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809768236 1135880704 /nfs/dbraw/zinc/88/07/04/1135880704.db2.gz FORJQKUYNLGZJU-OAHLLOKOSA-N 1 1 334.807 3.925 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965233 1135904396 /nfs/dbraw/zinc/90/43/96/1135904396.db2.gz FUGYVOLCQFZBPS-GFCCVEGCSA-N 1 1 333.215 3.637 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965233 1135904397 /nfs/dbraw/zinc/90/43/97/1135904397.db2.gz FUGYVOLCQFZBPS-GFCCVEGCSA-N 1 1 333.215 3.637 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000810224686 1135940433 /nfs/dbraw/zinc/94/04/33/1135940433.db2.gz ZSTWPYXLLBQEAY-SNVBAGLBSA-N 1 1 336.189 3.603 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473921 1136095587 /nfs/dbraw/zinc/09/55/87/1136095587.db2.gz QTAJEAPOBLEXLW-LLVKDONJSA-N 1 1 346.258 3.723 20 5 EHBDMO C[C@@H]1CCCN(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473921 1136095588 /nfs/dbraw/zinc/09/55/88/1136095588.db2.gz QTAJEAPOBLEXLW-LLVKDONJSA-N 1 1 346.258 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276945 1136130677 /nfs/dbraw/zinc/13/06/77/1136130677.db2.gz LXKCYTDSODXMBI-ZWKOTPCHSA-N 1 1 330.359 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000776279658 1136134616 /nfs/dbraw/zinc/13/46/16/1136134616.db2.gz XDXHXWVNBADCLK-IBGZPJMESA-N 1 1 342.370 3.557 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851551 1136261505 /nfs/dbraw/zinc/26/15/05/1136261505.db2.gz SMMDYKIBYGWRCN-SCLBCKFNSA-N 1 1 332.375 3.678 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000813329306 1136322745 /nfs/dbraw/zinc/32/27/45/1136322745.db2.gz OJIBROYPDICBRN-KGLIPLIRSA-N 1 1 328.416 3.848 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582928 1136442411 /nfs/dbraw/zinc/44/24/11/1136442411.db2.gz DHHYJAJJTFQEHK-OALUTQOASA-N 1 1 326.396 3.638 20 5 EHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585577 1136448489 /nfs/dbraw/zinc/44/84/89/1136448489.db2.gz XDJNZWMDQFOBOV-PMACEKPBSA-N 1 1 340.423 3.644 20 5 EHBDMO Cc1cc(NC(=O)[C@@H](c2ccc(Cl)cc2)[NH+](C)C)cc([N+](=O)[O-])c1 ZINC001134962836 1136580099 /nfs/dbraw/zinc/58/00/99/1136580099.db2.gz JHRZJGYQZYWFHM-MRXNPFEDSA-N 1 1 347.802 3.798 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)C1 ZINC000339002124 1136838988 /nfs/dbraw/zinc/83/89/88/1136838988.db2.gz HVWVESQJPOBOEC-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859585272 1137021233 /nfs/dbraw/zinc/02/12/33/1137021233.db2.gz MMZIJTMMDVNQFC-DNVCBOLYSA-N 1 1 326.396 3.639 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093522 1137043994 /nfs/dbraw/zinc/04/39/94/1137043994.db2.gz CSSSCTKJTPVJBS-CHWSQXEVSA-N 1 1 337.420 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)c1 ZINC000862540694 1137149088 /nfs/dbraw/zinc/14/90/88/1137149088.db2.gz JWBRSHJWBYJPBM-ZDUSSCGKSA-N 1 1 332.787 3.943 20 5 EHBDMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000846972518 1137377832 /nfs/dbraw/zinc/37/78/32/1137377832.db2.gz GSCPAUGTXOFRKV-CYBMUJFWSA-N 1 1 331.803 3.941 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872281402 1137577862 /nfs/dbraw/zinc/57/78/62/1137577862.db2.gz UXTLGYORBZBFKF-QGZVFWFLSA-N 1 1 334.416 3.527 20 5 EHBDMO Cc1cc([NH+]2CCCC2)ccc1NC1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876818090 1137662559 /nfs/dbraw/zinc/66/25/59/1137662559.db2.gz MKLLTWJUOPZHKD-UHFFFAOYSA-N 1 1 341.415 3.516 20 5 EHBDMO CC(C)(C)C1=CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878308175 1137710509 /nfs/dbraw/zinc/71/05/09/1137710509.db2.gz WDSAIQJJBPHBHE-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878308175 1137710510 /nfs/dbraw/zinc/71/05/10/1137710510.db2.gz WDSAIQJJBPHBHE-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055380 1137766749 /nfs/dbraw/zinc/76/67/49/1137766749.db2.gz XCOWUPZUBYOBNT-JTNHKYCSSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055380 1137766750 /nfs/dbraw/zinc/76/67/50/1137766750.db2.gz XCOWUPZUBYOBNT-JTNHKYCSSA-N 1 1 332.322 3.698 20 5 EHBDMO COc1cccc([C@H]2CC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2(C)C)c1 ZINC000880284598 1137773208 /nfs/dbraw/zinc/77/32/08/1137773208.db2.gz AYJWMOSIBCLGBM-OAHLLOKOSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000883257957 1137850852 /nfs/dbraw/zinc/85/08/52/1137850852.db2.gz OHVZAARMNSDNRQ-UHFFFAOYSA-N 1 1 330.359 3.910 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034156 1137929374 /nfs/dbraw/zinc/92/93/74/1137929374.db2.gz ZVOFYHWMPOOBNR-CUDZTTRCSA-N 1 1 332.444 3.917 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1ccc(Cl)cc1)C1CC1 ZINC000135226326 1137964767 /nfs/dbraw/zinc/96/47/67/1137964767.db2.gz FNCXHPUHIQDXAF-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000886022465 1138032795 /nfs/dbraw/zinc/03/27/95/1138032795.db2.gz CAWSCRNTSBCBHR-CQSZACIVSA-N 1 1 329.425 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000075863911 1138129120 /nfs/dbraw/zinc/12/91/20/1138129120.db2.gz QTXAKXKAMYCKCZ-GOSISDBHSA-N 1 1 326.396 3.634 20 5 EHBDMO C[NH+](C)Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)ccc1Cl ZINC000337256441 1138510604 /nfs/dbraw/zinc/51/06/04/1138510604.db2.gz RYQRXWOYRYOVKV-UHFFFAOYSA-N 1 1 339.804 3.624 20 5 EHBDMO C[C@H]([N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C)CC1 ZINC000177254061 1139607995 /nfs/dbraw/zinc/60/79/95/1139607995.db2.gz ZEIQNZJWYHELPT-ZDUSSCGKSA-N 1 1 329.400 3.913 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000178729893 1139715650 /nfs/dbraw/zinc/71/56/50/1139715650.db2.gz QDOPWEJGIPEJSK-INIZCTEOSA-N 1 1 328.368 3.607 20 5 EHBDMO COC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000181436066 1139906654 /nfs/dbraw/zinc/90/66/54/1139906654.db2.gz YJLRUJBXUHHTOM-MRXNPFEDSA-N 1 1 336.338 3.659 20 5 EHBDMO Cc1c(CN[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722997 1140166777 /nfs/dbraw/zinc/16/67/77/1140166777.db2.gz DVMCVPBQPOBQTI-WBVHZDCISA-N 1 1 331.460 3.646 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000267441946 1140791762 /nfs/dbraw/zinc/79/17/62/1140791762.db2.gz IDZVVRPXWQOADD-HOCLYGCPSA-N 1 1 332.425 3.744 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)cs1 ZINC000267468774 1140794901 /nfs/dbraw/zinc/79/49/01/1140794901.db2.gz WPHUEEAETYBLSX-QWHCGFSZSA-N 1 1 338.454 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)cs1 ZINC000267468774 1140794906 /nfs/dbraw/zinc/79/49/06/1140794906.db2.gz WPHUEEAETYBLSX-QWHCGFSZSA-N 1 1 338.454 3.806 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687389 1141135539 /nfs/dbraw/zinc/13/55/39/1141135539.db2.gz TVZMAYBXGOUAOA-ZWKOTPCHSA-N 1 1 330.359 3.604 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCC2 ZINC000271281793 1141338920 /nfs/dbraw/zinc/33/89/20/1141338920.db2.gz AEETUFWELXUNMV-CYBMUJFWSA-N 1 1 342.399 3.657 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271490623 1141379046 /nfs/dbraw/zinc/37/90/46/1141379046.db2.gz OVVIBSFXKAMMRV-LRDDRELGSA-N 1 1 348.374 3.517 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575522 1141521067 /nfs/dbraw/zinc/52/10/67/1141521067.db2.gz VOGCUFNGAHPJMZ-PWSUYJOCSA-N 1 1 344.358 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000176815049 1032058560 /nfs/dbraw/zinc/05/85/60/1032058560.db2.gz WURUUSAJZMMITO-UHFFFAOYSA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000176815049 1032058576 /nfs/dbraw/zinc/05/85/76/1032058576.db2.gz WURUUSAJZMMITO-UHFFFAOYSA-N 1 1 342.321 3.566 20 5 EHBDMO COc1cc(C[NH2+]Cc2coc3ccccc23)c([N+](=O)[O-])cc1OC ZINC000339407460 1014369741 /nfs/dbraw/zinc/36/97/41/1014369741.db2.gz MYIAGKMPBJVJHC-UHFFFAOYSA-N 1 1 342.351 3.648 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000610215038 1015006660 /nfs/dbraw/zinc/00/66/60/1015006660.db2.gz YELKGCHBPYNEKH-MRXNPFEDSA-N 1 1 326.396 3.668 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000430226730 1015123570 /nfs/dbraw/zinc/12/35/70/1015123570.db2.gz NQMFNJVEKFLXMX-KBAYOESNSA-N 1 1 348.443 3.629 20 5 EHBDMO O=[N+]([O-])c1sc(C[N@@H+]2CCC[C@H]2C2CC2)cc1Br ZINC001658936311 1120103628 /nfs/dbraw/zinc/10/36/28/1120103628.db2.gz RSQWREVAJXAJIN-NSHDSACASA-N 1 1 331.235 3.793 20 5 EHBDMO O=[N+]([O-])c1sc(C[N@H+]2CCC[C@H]2C2CC2)cc1Br ZINC001658936311 1120103630 /nfs/dbraw/zinc/10/36/30/1120103630.db2.gz RSQWREVAJXAJIN-NSHDSACASA-N 1 1 331.235 3.793 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](CO)C3)s2)cc1 ZINC000154589809 1015620210 /nfs/dbraw/zinc/62/02/10/1015620210.db2.gz LPKYKVMQWBASNC-CYBMUJFWSA-N 1 1 332.425 3.528 20 5 EHBDMO CSCCCCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000274943350 1015673333 /nfs/dbraw/zinc/67/33/33/1015673333.db2.gz QUCQWAQVZAADMA-MRXNPFEDSA-N 1 1 348.472 3.541 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091919188 1016080216 /nfs/dbraw/zinc/08/02/16/1016080216.db2.gz YHXBEXIINQZPCJ-AWEZNQCLSA-N 1 1 328.416 3.617 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCc2ccccn2)Cc2cccnc2)c1 ZINC000430328409 1016374732 /nfs/dbraw/zinc/37/47/32/1016374732.db2.gz ZQFZZUROVOIKGX-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccccn2)Cc2cccnc2)c1 ZINC000430328409 1016374746 /nfs/dbraw/zinc/37/47/46/1016374746.db2.gz ZQFZZUROVOIKGX-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO Cc1ccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683108 1032147328 /nfs/dbraw/zinc/14/73/28/1032147328.db2.gz JZBNCHCRKCRQKA-IBGZPJMESA-N 1 1 340.423 3.775 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)cc1 ZINC000340184285 1016634646 /nfs/dbraw/zinc/63/46/46/1016634646.db2.gz SRTFLQKGOJYZSD-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000074742657 1032215086 /nfs/dbraw/zinc/21/50/86/1032215086.db2.gz UCDXUVODZUSWTQ-HOCLYGCPSA-N 1 1 326.400 3.546 20 5 EHBDMO Cc1c([C@@H](C)[NH2+][C@@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368978 1032251647 /nfs/dbraw/zinc/25/16/47/1032251647.db2.gz PVQVZKDNOAOGGV-KDOFPFPSSA-N 1 1 345.418 3.996 20 5 EHBDMO CCc1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495956 1032665782 /nfs/dbraw/zinc/66/57/82/1032665782.db2.gz FQCKMSDVWBLHTP-AWEZNQCLSA-N 1 1 331.441 3.993 20 5 EHBDMO COc1cc(C[N@@H+]2CCC23CCCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000593038287 1032673713 /nfs/dbraw/zinc/67/37/13/1032673713.db2.gz GQWKSPOBTDKSGY-UHFFFAOYSA-N 1 1 342.342 3.723 20 5 EHBDMO COc1cc(C[N@H+]2CCC23CCCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000593038287 1032673723 /nfs/dbraw/zinc/67/37/23/1032673723.db2.gz GQWKSPOBTDKSGY-UHFFFAOYSA-N 1 1 342.342 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc4ccccn34)C2)cc1 ZINC000449501113 1032681119 /nfs/dbraw/zinc/68/11/19/1032681119.db2.gz OWKMUKZDFSLCQP-MRXNPFEDSA-N 1 1 336.395 3.622 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)o1 ZINC000377237750 1017513280 /nfs/dbraw/zinc/51/32/80/1017513280.db2.gz JFZQRUOEUOTLIW-LSDHHAIUSA-N 1 1 342.395 3.713 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c(F)c1 ZINC000449516938 1032708878 /nfs/dbraw/zinc/70/88/78/1032708878.db2.gz IHLHEZXVZBIIID-WBVHZDCISA-N 1 1 334.391 3.515 20 5 EHBDMO CCC[C@@H](Cc1ccccc1)[N@@H+](CCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001167306699 1017728111 /nfs/dbraw/zinc/72/81/11/1017728111.db2.gz IGQYRKRDMGHIGH-SFHVURJKSA-N 1 1 344.459 3.952 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597861017 1032721769 /nfs/dbraw/zinc/72/17/69/1032721769.db2.gz RHLCKHJOSGNXCB-AWEZNQCLSA-N 1 1 347.459 3.568 20 5 EHBDMO Cc1cc(-n2ccnc2)ccc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000574104113 1032724073 /nfs/dbraw/zinc/72/40/73/1032724073.db2.gz ULCOYCISDXHXKU-UHFFFAOYSA-N 1 1 348.406 3.647 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214641 1018547246 /nfs/dbraw/zinc/54/72/46/1018547246.db2.gz SDHQLKUHSZJTOA-YPMHNXCESA-N 1 1 335.429 3.842 20 5 EHBDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584058 /nfs/dbraw/zinc/58/40/58/1018584058.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584065 /nfs/dbraw/zinc/58/40/65/1018584065.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584075 /nfs/dbraw/zinc/58/40/75/1018584075.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404507 1032776567 /nfs/dbraw/zinc/77/65/67/1032776567.db2.gz ZARRCMMRNNKBKZ-DYVFJYSZSA-N 1 1 332.375 3.817 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190853 1018988804 /nfs/dbraw/zinc/98/88/04/1018988804.db2.gz MNHFIYNNJLNKRB-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190853 1018988819 /nfs/dbraw/zinc/98/88/19/1018988819.db2.gz MNHFIYNNJLNKRB-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@H+]1CC[C@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000729264091 1019252115 /nfs/dbraw/zinc/25/21/15/1019252115.db2.gz VLWZLZMESYOENG-MRVPVSSYSA-N 1 1 337.729 3.631 20 5 EHBDMO CC[C@@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000168006341 1020391094 /nfs/dbraw/zinc/39/10/94/1020391094.db2.gz WMPPUUPDTOSYME-CVEARBPZSA-N 1 1 343.431 3.886 20 5 EHBDMO O=C(CC[N@@H+](CC1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000501110123 1020711620 /nfs/dbraw/zinc/71/16/20/1020711620.db2.gz JVTFXFWIKKEPRV-UHFFFAOYSA-N 1 1 345.443 3.968 20 5 EHBDMO CC(C)CC1CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000760399641 1032929997 /nfs/dbraw/zinc/92/99/97/1032929997.db2.gz YSSXLHXHVMQNOZ-UHFFFAOYSA-N 1 1 343.431 3.569 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000360870462 1020846877 /nfs/dbraw/zinc/84/68/77/1020846877.db2.gz ILZWXTJIFMIPQM-NVXWUHKLSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1nn(C[N@@H+]2CCCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000760409291 1032940264 /nfs/dbraw/zinc/94/02/64/1032940264.db2.gz QNKKLZLJXPWFSX-OAHLLOKOSA-N 1 1 345.447 3.896 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000507372146 1021225643 /nfs/dbraw/zinc/22/56/43/1021225643.db2.gz OZDLBYOQXQLRSH-INIZCTEOSA-N 1 1 347.462 3.992 20 5 EHBDMO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439258338 1021282122 /nfs/dbraw/zinc/28/21/22/1021282122.db2.gz LAEUCPNFGAGODJ-IBGZPJMESA-N 1 1 346.402 3.897 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439258338 1021282135 /nfs/dbraw/zinc/28/21/35/1021282135.db2.gz LAEUCPNFGAGODJ-IBGZPJMESA-N 1 1 346.402 3.897 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2cc(C)c(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000507616823 1021402300 /nfs/dbraw/zinc/40/23/00/1021402300.db2.gz QMAOUGQGNUTDLR-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1cccc2c1CC[C@@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602568704 1032981767 /nfs/dbraw/zinc/98/17/67/1032981767.db2.gz KZMGTISIHZUQCD-AWEZNQCLSA-N 1 1 339.351 3.522 20 5 EHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015300614 1021659700 /nfs/dbraw/zinc/65/97/00/1021659700.db2.gz FXTWRKNUBLTVNO-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015300614 1021659706 /nfs/dbraw/zinc/65/97/06/1021659706.db2.gz FXTWRKNUBLTVNO-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO CCn1cc(C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000593677283 1033002862 /nfs/dbraw/zinc/00/28/62/1033002862.db2.gz XCYJMFQFZBOVSN-VQHVLOKHSA-N 1 1 328.416 3.735 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCN(c2ccccc2)C1 ZINC000602652408 1033039391 /nfs/dbraw/zinc/03/93/91/1033039391.db2.gz YLNFYFOVOLVEOJ-QGZVFWFLSA-N 1 1 339.439 3.596 20 5 EHBDMO CCC[C@H]([NH2+]C1CCN(CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255747 1022325912 /nfs/dbraw/zinc/32/59/12/1022325912.db2.gz QRIDFRMGAQRENN-IBGZPJMESA-N 1 1 331.460 3.900 20 5 EHBDMO CC(=O)c1cc(NCCCC[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000341567992 1022346367 /nfs/dbraw/zinc/34/63/67/1022346367.db2.gz UNPQRKXFBCNXTN-AWEZNQCLSA-N 1 1 333.432 3.864 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000550079245 1022362680 /nfs/dbraw/zinc/36/26/80/1022362680.db2.gz KSBMYMARPMGBNT-PBHICJAKSA-N 1 1 345.443 3.742 20 5 EHBDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602672658 1033049129 /nfs/dbraw/zinc/04/91/29/1033049129.db2.gz ZTGIEJXEMAOPMQ-HNNXBMFYSA-N 1 1 346.349 3.598 20 5 EHBDMO CC(C)[C@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498573 1022727465 /nfs/dbraw/zinc/72/74/65/1022727465.db2.gz YFWBLTLOKRLXGT-OCCSQVGLSA-N 1 1 330.388 3.684 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC(OC(C)(C)C)C1 ZINC000602695602 1033076319 /nfs/dbraw/zinc/07/63/19/1033076319.db2.gz BDFNNTUWORYIDB-UHFFFAOYSA-N 1 1 333.388 3.514 20 5 EHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000602685391 1033086363 /nfs/dbraw/zinc/08/63/63/1033086363.db2.gz NWZHCOYIIBFXBL-IAQYHMDHSA-N 1 1 346.349 3.861 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)o1 ZINC000510677327 1022873494 /nfs/dbraw/zinc/87/34/94/1022873494.db2.gz BVADQUVWMHZBIY-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)o1 ZINC000510677327 1022873511 /nfs/dbraw/zinc/87/35/11/1022873511.db2.gz BVADQUVWMHZBIY-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1c(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686554 1022887305 /nfs/dbraw/zinc/88/73/05/1022887305.db2.gz QCWRQZGESOCVRQ-FQEVSTJZSA-N 1 1 340.423 3.775 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C)(C(C)C)CC1 ZINC000426746194 1023012534 /nfs/dbraw/zinc/01/25/34/1023012534.db2.gz XMQYBQXBPHJMFH-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@@H]21 ZINC000248425518 1024082812 /nfs/dbraw/zinc/08/28/12/1024082812.db2.gz NZSRKSJTHQZOJM-DAXOMENPSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@H]21 ZINC000248425522 1024089872 /nfs/dbraw/zinc/08/98/72/1024089872.db2.gz NZSRKSJTHQZOJM-UHOFOFEASA-N 1 1 342.399 3.655 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000071809503 1024441049 /nfs/dbraw/zinc/44/10/49/1024441049.db2.gz WBZKUHYBJCNKNS-QGZVFWFLSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c(C(F)F)c1 ZINC000895567681 1024623825 /nfs/dbraw/zinc/62/38/25/1024623825.db2.gz GQVFMDOQZNHBDC-ZIAGYGMSSA-N 1 1 343.399 3.524 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncccc1[N+](=O)[O-] ZINC000071954895 1024900696 /nfs/dbraw/zinc/90/06/96/1024900696.db2.gz MCKZAEKEUAMFJQ-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000185450557 1025094288 /nfs/dbraw/zinc/09/42/88/1025094288.db2.gz LPAFYJJYHHSVAS-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO C[C@@H](CO)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000515332138 1025174323 /nfs/dbraw/zinc/17/43/23/1025174323.db2.gz RMUFPAPFPVZNOB-AWEZNQCLSA-N 1 1 344.411 3.838 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000051475903 1025472496 /nfs/dbraw/zinc/47/24/96/1025472496.db2.gz CMOLTTPGWGBLAN-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318940 1025581771 /nfs/dbraw/zinc/58/17/71/1025581771.db2.gz PXQAMXQWYDQGOR-MNOVXSKESA-N 1 1 346.353 3.541 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000185678388 1025586935 /nfs/dbraw/zinc/58/69/35/1025586935.db2.gz XRULGWYPFCLTJP-KRWDZBQOSA-N 1 1 330.384 3.980 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000451740299 1025796508 /nfs/dbraw/zinc/79/65/08/1025796508.db2.gz ZWGJAMMQEIBOSY-OAHLLOKOSA-N 1 1 334.807 3.672 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CCC3(CCCCC3)O1)C2 ZINC000522050883 1025917382 /nfs/dbraw/zinc/91/73/82/1025917382.db2.gz AUCVFHQGTYITTA-INIZCTEOSA-N 1 1 330.428 3.835 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CCC3(CCCCC3)O1)C2 ZINC000522050883 1025917395 /nfs/dbraw/zinc/91/73/95/1025917395.db2.gz AUCVFHQGTYITTA-INIZCTEOSA-N 1 1 330.428 3.835 20 5 EHBDMO Cc1cnc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553128 1026105619 /nfs/dbraw/zinc/10/56/19/1026105619.db2.gz XKWYEGNAIJXXGW-GOEBONIOSA-N 1 1 326.400 3.634 20 5 EHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302061812 1026472256 /nfs/dbraw/zinc/47/22/56/1026472256.db2.gz UCGFKJRVXKVLCK-CHWSQXEVSA-N 1 1 348.403 3.568 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000531405955 1026886574 /nfs/dbraw/zinc/88/65/74/1026886574.db2.gz OEPLDILRPDAXEX-LJQANCHMSA-N 1 1 328.412 3.614 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc(C)[nH+]c2N2CCCC2)n1 ZINC000611617718 1027159894 /nfs/dbraw/zinc/15/98/94/1027159894.db2.gz ZMWZXNAWJOKBJE-UHFFFAOYSA-N 1 1 341.415 3.522 20 5 EHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135648477 1027512280 /nfs/dbraw/zinc/51/22/80/1027512280.db2.gz MYINEPUKMZAVND-GFCCVEGCSA-N 1 1 327.222 3.835 20 5 EHBDMO C[NH+](C)[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000783592551 1027539593 /nfs/dbraw/zinc/53/95/93/1027539593.db2.gz IMKJYSHHKSHSJV-INIZCTEOSA-N 1 1 347.846 3.511 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@]1(CO)CCCc2ccccc21 ZINC000440481071 1028071223 /nfs/dbraw/zinc/07/12/23/1028071223.db2.gz MBIHHQQWPOBPGC-SFHVURJKSA-N 1 1 346.814 3.562 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCC[C@@H]1C ZINC000444679070 1028147402 /nfs/dbraw/zinc/14/74/02/1028147402.db2.gz SYBJJNCKUPWGIM-SUMWQHHRSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000444711497 1028191944 /nfs/dbraw/zinc/19/19/44/1028191944.db2.gz XEORQNISSQPWRG-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000444711497 1028191952 /nfs/dbraw/zinc/19/19/52/1028191952.db2.gz XEORQNISSQPWRG-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000444764105 1028248677 /nfs/dbraw/zinc/24/86/77/1028248677.db2.gz AYHXGEMYDBVGJE-CQSZACIVSA-N 1 1 330.388 3.513 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC000472272889 1028390394 /nfs/dbraw/zinc/39/03/94/1028390394.db2.gz FHWPYOGXYCIWAA-UHFFFAOYSA-N 1 1 326.352 3.852 20 5 EHBDMO Cn1cc(C[N@H+](Cc2ccccc2F)C2CCCCC2)c([N+](=O)[O-])n1 ZINC001168265245 1028415063 /nfs/dbraw/zinc/41/50/63/1028415063.db2.gz PUFYMHUSLBMIPV-UHFFFAOYSA-N 1 1 346.406 3.802 20 5 EHBDMO Cn1cc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)c([N+](=O)[O-])n1 ZINC001168265245 1028415069 /nfs/dbraw/zinc/41/50/69/1028415069.db2.gz PUFYMHUSLBMIPV-UHFFFAOYSA-N 1 1 346.406 3.802 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000532737525 1028775409 /nfs/dbraw/zinc/77/54/09/1028775409.db2.gz ZGYPVPAJNHYASL-GOSISDBHSA-N 1 1 342.370 3.971 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(OCC(F)F)cc1)CC2 ZINC000583091864 1028797624 /nfs/dbraw/zinc/79/76/24/1028797624.db2.gz VJZGHPAIQZMLJW-UHFFFAOYSA-N 1 1 348.349 3.797 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(OCC(F)F)cc1)CC2 ZINC000583091864 1028797637 /nfs/dbraw/zinc/79/76/37/1028797637.db2.gz VJZGHPAIQZMLJW-UHFFFAOYSA-N 1 1 348.349 3.797 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000504906030 1029049862 /nfs/dbraw/zinc/04/98/62/1029049862.db2.gz RQQSDTYTUNCIDO-QAPCUYQASA-N 1 1 349.475 3.765 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000533252069 1029528901 /nfs/dbraw/zinc/52/89/01/1029528901.db2.gz CNUGFZAQCAGASR-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000533252069 1029528908 /nfs/dbraw/zinc/52/89/08/1029528908.db2.gz CNUGFZAQCAGASR-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988780 1029575533 /nfs/dbraw/zinc/57/55/33/1029575533.db2.gz JSICUHZRMWEXML-RNCFNFMXSA-N 1 1 329.322 3.508 20 5 EHBDMO COc1cc(C[NH2+][C@H]2CCCc3c(O)cccc32)c([N+](=O)[O-])cc1F ZINC000192354829 1029645349 /nfs/dbraw/zinc/64/53/49/1029645349.db2.gz IRGAPQNAJYEVBD-HNNXBMFYSA-N 1 1 346.358 3.615 20 5 EHBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195849 1029739717 /nfs/dbraw/zinc/73/97/17/1029739717.db2.gz SQTLWCSNZPSIRZ-KBPBESRZSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195849 1029739725 /nfs/dbraw/zinc/73/97/25/1029739725.db2.gz SQTLWCSNZPSIRZ-KBPBESRZSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195849 1029739730 /nfs/dbraw/zinc/73/97/30/1029739730.db2.gz SQTLWCSNZPSIRZ-KBPBESRZSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195849 1029739736 /nfs/dbraw/zinc/73/97/36/1029739736.db2.gz SQTLWCSNZPSIRZ-KBPBESRZSA-N 1 1 345.468 3.896 20 5 EHBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000531867876 1029941861 /nfs/dbraw/zinc/94/18/61/1029941861.db2.gz KBHBWSGKDKQNPI-OAHLLOKOSA-N 1 1 334.416 3.539 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525781751 1030115301 /nfs/dbraw/zinc/11/53/01/1030115301.db2.gz VRBSGJMLFPIAOL-SFHVURJKSA-N 1 1 334.416 3.864 20 5 EHBDMO CC1(C)C[C@@H]([N@H+]2CCC[C@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381843 1030162992 /nfs/dbraw/zinc/16/29/92/1030162992.db2.gz RIGNCQNQXOEKMD-MJGOQNOKSA-N 1 1 330.428 3.820 20 5 EHBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447404482 1030172265 /nfs/dbraw/zinc/17/22/65/1030172265.db2.gz JWJYQVYWYUZFHV-CQSZACIVSA-N 1 1 338.411 3.843 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000159528051 1030255172 /nfs/dbraw/zinc/25/51/72/1030255172.db2.gz JKIJQJDKYDPRQV-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO CC[C@]1(C(C)C)C[C@H]1[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453439734 1030256604 /nfs/dbraw/zinc/25/66/04/1030256604.db2.gz MILYNYARJRFALQ-ZIFCJYIRSA-N 1 1 342.443 3.832 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@H+]1C1CC1 ZINC000583666502 1030394916 /nfs/dbraw/zinc/39/49/16/1030394916.db2.gz BXUPSIHINWMCBK-GXTWGEPZSA-N 1 1 333.432 3.809 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447836901 1030527385 /nfs/dbraw/zinc/52/73/85/1030527385.db2.gz YOVHCEZXVBRMQT-GOEBONIOSA-N 1 1 336.432 3.507 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000249213486 1030831057 /nfs/dbraw/zinc/83/10/57/1030831057.db2.gz DFJGXVDATKCAFT-MFKMUULPSA-N 1 1 338.458 3.608 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000483101038 1030952367 /nfs/dbraw/zinc/95/23/67/1030952367.db2.gz OWRUPAWTHTURGU-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CC3CC3)CC3CCC3)n2)cc1 ZINC000483266223 1031078226 /nfs/dbraw/zinc/07/82/26/1031078226.db2.gz VGRDJUNRDIBJQB-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000032801164 1031374721 /nfs/dbraw/zinc/37/47/21/1031374721.db2.gz YHGWVTSDARVQOK-NWDGAFQWSA-N 1 1 347.802 3.926 20 5 EHBDMO c1ccc2c(c1)nc(CSCC[NH+]1CCOCC1)c1ccccc21 ZINC000551726331 1031588765 /nfs/dbraw/zinc/58/87/65/1031588765.db2.gz CJLXOCVFAKCLBE-UHFFFAOYSA-N 1 1 338.476 3.953 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475740201 1031737418 /nfs/dbraw/zinc/73/74/18/1031737418.db2.gz AXWZDOUMUIVVDQ-QGZVFWFLSA-N 1 1 348.830 3.938 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1)CC1CC1 ZINC000537823974 1031943127 /nfs/dbraw/zinc/94/31/27/1031943127.db2.gz WVWWTLZSMXVAKN-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000598680113 1033379179 /nfs/dbraw/zinc/37/91/79/1033379179.db2.gz UJSBDZZCBDBLNL-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000441386256 1033477293 /nfs/dbraw/zinc/47/72/93/1033477293.db2.gz UJSBQYMMADZMEE-IBGZPJMESA-N 1 1 346.427 3.805 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC000598962697 1033596559 /nfs/dbraw/zinc/59/65/59/1033596559.db2.gz HFBNGEKIGJXCGI-UHFFFAOYSA-N 1 1 346.330 3.974 20 5 EHBDMO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CCC2)c1 ZINC000594996479 1033623623 /nfs/dbraw/zinc/62/36/23/1033623623.db2.gz CGRNKXOPINFUAU-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000599045944 1033675158 /nfs/dbraw/zinc/67/51/58/1033675158.db2.gz FDOCCCXLLYKHMW-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@]3(CCCc4ccccc43)C2)c1[N+](=O)[O-] ZINC000595339399 1033732766 /nfs/dbraw/zinc/73/27/66/1033732766.db2.gz OBOYBBUZYKGAOE-IBGZPJMESA-N 1 1 341.411 3.761 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CCC[N@H+]3CCCC[C@H]23)ccc2cnccc21 ZINC000599097332 1033733125 /nfs/dbraw/zinc/73/31/25/1033733125.db2.gz BTIBFRCCZYXRKE-DOTOQJQBSA-N 1 1 326.400 3.572 20 5 EHBDMO C[N@@H+](CCc1nsc2ccccc21)CCc1cccc([N+](=O)[O-])c1 ZINC000595478178 1033825041 /nfs/dbraw/zinc/82/50/41/1033825041.db2.gz YPNYTYWYCFTWDY-UHFFFAOYSA-N 1 1 341.436 3.922 20 5 EHBDMO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000174282461 1033878835 /nfs/dbraw/zinc/87/88/35/1033878835.db2.gz RYFIPTSNMVECOC-SFHVURJKSA-N 1 1 332.375 3.598 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1OC ZINC000575217989 1033895124 /nfs/dbraw/zinc/89/51/24/1033895124.db2.gz LSTUKYHYZARKNX-UHFFFAOYSA-N 1 1 344.411 3.595 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(C4CCC4)CC3)n2)c1 ZINC000595660494 1033940097 /nfs/dbraw/zinc/94/00/97/1033940097.db2.gz SLCQPIYMUKTXJR-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000593119132 1033970394 /nfs/dbraw/zinc/97/03/94/1033970394.db2.gz UVZWEWWHKCXCFJ-GFCCVEGCSA-N 1 1 336.260 3.845 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000593119132 1033970409 /nfs/dbraw/zinc/97/04/09/1033970409.db2.gz UVZWEWWHKCXCFJ-GFCCVEGCSA-N 1 1 336.260 3.845 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000603867930 1033993836 /nfs/dbraw/zinc/99/38/36/1033993836.db2.gz DGLVQZGLSXWRLT-SFHVURJKSA-N 1 1 330.359 3.950 20 5 EHBDMO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093694 1034078396 /nfs/dbraw/zinc/07/83/96/1034078396.db2.gz DPIRGJCUGCTNFT-RDJZCZTQSA-N 1 1 331.460 3.676 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1F ZINC000599674991 1034080249 /nfs/dbraw/zinc/08/02/49/1034080249.db2.gz FXPLRERLSRGUKH-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692814 1034097109 /nfs/dbraw/zinc/09/71/09/1034097109.db2.gz XXSUTATXMWCVRX-PYLYLYNFSA-N 1 1 332.400 3.640 20 5 EHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1[N+](=O)[O-] ZINC000179315151 1034107197 /nfs/dbraw/zinc/10/71/97/1034107197.db2.gz DTAUBMIXCSVLFU-RMKNXTFCSA-N 1 1 327.340 3.648 20 5 EHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1[N+](=O)[O-] ZINC000179315151 1034107210 /nfs/dbraw/zinc/10/72/10/1034107210.db2.gz DTAUBMIXCSVLFU-RMKNXTFCSA-N 1 1 327.340 3.648 20 5 EHBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000596481057 1034254221 /nfs/dbraw/zinc/25/42/21/1034254221.db2.gz WPFBSDGTZOGFCI-OAHLLOKOSA-N 1 1 331.416 3.616 20 5 EHBDMO CCOc1cc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596570736 1034292992 /nfs/dbraw/zinc/29/29/92/1034292992.db2.gz NEFSGXSKHWQAEY-OAHLLOKOSA-N 1 1 333.432 3.527 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000612174606 1034379834 /nfs/dbraw/zinc/37/98/34/1034379834.db2.gz PAXKWOZKTIINHY-QGZVFWFLSA-N 1 1 330.359 3.696 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000597224728 1034625018 /nfs/dbraw/zinc/62/50/18/1034625018.db2.gz IUBLXGBDIFWFKS-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000053087904 1034673274 /nfs/dbraw/zinc/67/32/74/1034673274.db2.gz PGTRFSCXYIJCHT-ZDUSSCGKSA-N 1 1 345.374 3.756 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000053087904 1034673284 /nfs/dbraw/zinc/67/32/84/1034673284.db2.gz PGTRFSCXYIJCHT-ZDUSSCGKSA-N 1 1 345.374 3.756 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000177148068 1034697236 /nfs/dbraw/zinc/69/72/36/1034697236.db2.gz ABBLYWBAWVSBJK-GOSISDBHSA-N 1 1 344.386 3.568 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000612578518 1035074016 /nfs/dbraw/zinc/07/40/16/1035074016.db2.gz LTUATOKQWCTLDV-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000612578518 1035074024 /nfs/dbraw/zinc/07/40/24/1035074024.db2.gz LTUATOKQWCTLDV-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO COc1cc(C[N@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000463468904 1035538021 /nfs/dbraw/zinc/53/80/21/1035538021.db2.gz HZMRPFWNIJYEHA-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000463468904 1035538033 /nfs/dbraw/zinc/53/80/33/1035538033.db2.gz HZMRPFWNIJYEHA-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000581840494 1035638871 /nfs/dbraw/zinc/63/88/71/1035638871.db2.gz LLFOHMKKAQVCIM-INIZCTEOSA-N 1 1 330.432 3.834 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534837242 1035684342 /nfs/dbraw/zinc/68/43/42/1035684342.db2.gz KEYOGYYFQKTUPF-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000588072501 1035700523 /nfs/dbraw/zinc/70/05/23/1035700523.db2.gz RXUHBDIRTIXGRB-GOSISDBHSA-N 1 1 343.452 3.759 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000613383391 1035722913 /nfs/dbraw/zinc/72/29/13/1035722913.db2.gz KRTLJPVIDFXXCS-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204723 1035823084 /nfs/dbraw/zinc/82/30/84/1035823084.db2.gz ASUXXYDDVNSMKR-DNVCBOLYSA-N 1 1 341.411 3.842 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(OC(F)F)c1)C2 ZINC000535244637 1036231032 /nfs/dbraw/zinc/23/10/32/1036231032.db2.gz ACZSWXHNZZGQSY-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(OC(F)F)c1)C2 ZINC000535244637 1036231052 /nfs/dbraw/zinc/23/10/52/1036231052.db2.gz ACZSWXHNZZGQSY-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO Cc1ccc(SCC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1C ZINC000541620081 1036526057 /nfs/dbraw/zinc/52/60/57/1036526057.db2.gz BNDQVXDHRWYYRW-UHFFFAOYSA-N 1 1 343.452 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCc4n[nH]cc4C3)o2)cc1 ZINC000597257597 1036899682 /nfs/dbraw/zinc/89/96/82/1036899682.db2.gz HBJIGPOQFVIALS-UHFFFAOYSA-N 1 1 338.367 3.526 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000311034427 1036946039 /nfs/dbraw/zinc/94/60/39/1036946039.db2.gz QUDOHZYEGGSBQN-CQSZACIVSA-N 1 1 347.365 3.807 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@@H](CC)N2CCCC2)cc1[N+](=O)[O-] ZINC000152851885 1036999488 /nfs/dbraw/zinc/99/94/88/1036999488.db2.gz BNFYZLXCVRCXAT-GOEBONIOSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519671 1037097239 /nfs/dbraw/zinc/09/72/39/1037097239.db2.gz DCCJNQQFGNSJIF-BETUJISGSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@@H]1CCC[C@H](C)N1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519671 1037097258 /nfs/dbraw/zinc/09/72/58/1037097258.db2.gz DCCJNQQFGNSJIF-BETUJISGSA-N 1 1 325.840 3.601 20 5 EHBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000472607884 1037254850 /nfs/dbraw/zinc/25/48/50/1037254850.db2.gz DTGKJZNQAPAHBH-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO Cc1c(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cnn1C ZINC000181026906 1037398698 /nfs/dbraw/zinc/39/86/98/1037398698.db2.gz VHMZEZOHVWKKTQ-LJQANCHMSA-N 1 1 336.395 3.516 20 5 EHBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790589 1037531033 /nfs/dbraw/zinc/53/10/33/1037531033.db2.gz PFZNVOGXPLJXBL-LBTNJELSSA-N 1 1 344.411 3.836 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@@H]2CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000493714457 1037575288 /nfs/dbraw/zinc/57/52/88/1037575288.db2.gz YUZRIMURXWZZDK-GDBMZVCRSA-N 1 1 336.432 3.631 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)CCC[C@H]1C ZINC000532571286 1037672242 /nfs/dbraw/zinc/67/22/42/1037672242.db2.gz LWZWJXVAISYVKV-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CCC2)cs1 ZINC000592139214 1037856499 /nfs/dbraw/zinc/85/64/99/1037856499.db2.gz OLCVWMITWCDCMN-KRWDZBQOSA-N 1 1 346.452 3.820 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc3n(n2)CCCC3)cc1[N+](=O)[O-] ZINC000592387716 1037955014 /nfs/dbraw/zinc/95/50/14/1037955014.db2.gz IRAZPHKINDWVAK-UONOGXRCSA-N 1 1 328.416 3.848 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCO1 ZINC000511540507 1038362117 /nfs/dbraw/zinc/36/21/17/1038362117.db2.gz HZQZSCOMOVGRDH-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)C1CC[NH+](C(C)C)CC1 ZINC000470172459 1038426220 /nfs/dbraw/zinc/42/62/20/1038426220.db2.gz XABKJRCBHAUGGU-VBKFSLOCSA-N 1 1 331.460 3.803 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C1CCN(C(C)C)CC1 ZINC000470172459 1038426227 /nfs/dbraw/zinc/42/62/27/1038426227.db2.gz XABKJRCBHAUGGU-VBKFSLOCSA-N 1 1 331.460 3.803 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C1CCN(C(C)C)CC1 ZINC000470172459 1038426234 /nfs/dbraw/zinc/42/62/34/1038426234.db2.gz XABKJRCBHAUGGU-VBKFSLOCSA-N 1 1 331.460 3.803 20 5 EHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCCC(=O)OC(C)(C)C ZINC000538739941 1038503795 /nfs/dbraw/zinc/50/37/95/1038503795.db2.gz VWEJRKVYZNAICE-JXMROGBWSA-N 1 1 334.416 3.662 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000485695338 1039438921 /nfs/dbraw/zinc/43/89/21/1039438921.db2.gz LUPHKAIFEBSUIY-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H](C3CC3)C2)s1 ZINC000485695338 1039438926 /nfs/dbraw/zinc/43/89/26/1039438926.db2.gz LUPHKAIFEBSUIY-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000842167935 1039519536 /nfs/dbraw/zinc/51/95/36/1039519536.db2.gz YLWFPSLMXZTGCG-WRWGMCAJSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000842167935 1039519553 /nfs/dbraw/zinc/51/95/53/1039519553.db2.gz YLWFPSLMXZTGCG-WRWGMCAJSA-N 1 1 339.823 3.552 20 5 EHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349277 1039700059 /nfs/dbraw/zinc/70/00/59/1039700059.db2.gz KOAYLJNKVCKFEV-CXAGYDPISA-N 1 1 328.416 3.930 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340923 1039704542 /nfs/dbraw/zinc/70/45/42/1039704542.db2.gz AXNCEQHAGFIKLE-GUYCJALGSA-N 1 1 342.395 3.916 20 5 EHBDMO COc1cccc2c1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000489435712 1039974372 /nfs/dbraw/zinc/97/43/72/1039974372.db2.gz XKYQLTLEDHRXOG-UHFFFAOYSA-N 1 1 326.396 3.513 20 5 EHBDMO CC(=O)c1cc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331059 1039978642 /nfs/dbraw/zinc/97/86/42/1039978642.db2.gz RZPZBRPFCIUQGS-HZSPNIEDSA-N 1 1 333.432 3.576 20 5 EHBDMO CC[N@@H+](C)CCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000236870412 1040077849 /nfs/dbraw/zinc/07/78/49/1040077849.db2.gz KIJDVNJAGQDDPV-UHFFFAOYSA-N 1 1 347.390 3.568 20 5 EHBDMO CCN(C)CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000236870412 1040077861 /nfs/dbraw/zinc/07/78/61/1040077861.db2.gz KIJDVNJAGQDDPV-UHFFFAOYSA-N 1 1 347.390 3.568 20 5 EHBDMO CC(C)CC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000053363724 1040242853 /nfs/dbraw/zinc/24/28/53/1040242853.db2.gz LMIYYZOFAIEHBZ-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO COc1ccc(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000490027796 1040295870 /nfs/dbraw/zinc/29/58/70/1040295870.db2.gz RQMYZFFNFZFIKE-UHFFFAOYSA-N 1 1 326.396 3.811 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490034538 1040302430 /nfs/dbraw/zinc/30/24/30/1040302430.db2.gz AJAUVHUTJVDMAT-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453294046 1040639799 /nfs/dbraw/zinc/63/97/99/1040639799.db2.gz WBHJMPLYWWQCEY-SJLPKXTDSA-N 1 1 330.384 3.608 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cccc4n[nH]cc43)C2)cc1 ZINC000600167739 1040752925 /nfs/dbraw/zinc/75/29/25/1040752925.db2.gz CEMXOFUBOHXIDC-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000150062319 1041107540 /nfs/dbraw/zinc/10/75/40/1041107540.db2.gz JWLLRKCIHRMHHF-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO CC(=O)c1cc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344415 1041215269 /nfs/dbraw/zinc/21/52/69/1041215269.db2.gz GSORBMUCFBLZHM-VBQJREDUSA-N 1 1 345.443 3.639 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481674262 1041235390 /nfs/dbraw/zinc/23/53/90/1041235390.db2.gz IWKIIOCQZISGRG-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481674262 1041235407 /nfs/dbraw/zinc/23/54/07/1041235407.db2.gz IWKIIOCQZISGRG-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854375 1041236963 /nfs/dbraw/zinc/23/69/63/1041236963.db2.gz QGJTZXQMKBQXIR-OAHLLOKOSA-N 1 1 341.411 3.577 20 5 EHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000511668799 1041456927 /nfs/dbraw/zinc/45/69/27/1041456927.db2.gz VSILLLZNSGRWBA-ZGBFETHSSA-N 1 1 338.407 3.854 20 5 EHBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000181758753 1041950749 /nfs/dbraw/zinc/95/07/49/1041950749.db2.gz XCGLPVFZGYRVSM-LBPRGKRZSA-N 1 1 339.351 3.630 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000112658926 1042416693 /nfs/dbraw/zinc/41/66/93/1042416693.db2.gz HXZYOALUNSERSP-LJQANCHMSA-N 1 1 328.412 3.614 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000112659799 1042419225 /nfs/dbraw/zinc/41/92/25/1042419225.db2.gz PGAAIYTWYOHQAP-LJQANCHMSA-N 1 1 328.412 3.614 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000063587621 1042706955 /nfs/dbraw/zinc/70/69/55/1042706955.db2.gz MPJBPNWFVWZQRR-KXBFYZLASA-N 1 1 326.396 3.599 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nccc(C(F)F)n1 ZINC000342265920 1042845118 /nfs/dbraw/zinc/84/51/18/1042845118.db2.gz LPVIARSYPDQPDJ-YRNVUSSQSA-N 1 1 334.326 3.516 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432327146 1042908089 /nfs/dbraw/zinc/90/80/89/1042908089.db2.gz FNHZWIWNBDOPJJ-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO CO[C@@H](C)c1nc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])cs1 ZINC000344716510 1044345536 /nfs/dbraw/zinc/34/55/36/1044345536.db2.gz SBIDBBPHNJHEMY-HWPRWLFBSA-N 1 1 333.413 3.562 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000072770471 1126877627 /nfs/dbraw/zinc/87/76/27/1126877627.db2.gz BWYPBOUOZIRMAH-TUAOUCFPSA-N 1 1 348.428 3.532 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000072770471 1126877633 /nfs/dbraw/zinc/87/76/33/1126877633.db2.gz BWYPBOUOZIRMAH-TUAOUCFPSA-N 1 1 348.428 3.532 20 5 EHBDMO COc1cc(NC[C@H](C)[N@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301340985 1127738302 /nfs/dbraw/zinc/73/83/02/1127738302.db2.gz FQLRPFOXRQGIQL-LBPRGKRZSA-N 1 1 347.440 3.524 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438415 1127744084 /nfs/dbraw/zinc/74/40/84/1127744084.db2.gz HRVTZKZLNKTKDS-CHWSQXEVSA-N 1 1 337.420 3.501 20 5 EHBDMO C[N@@H+](CCCNc1ncnc2sc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000326697589 1128433023 /nfs/dbraw/zinc/43/30/23/1128433023.db2.gz TWCAOGYZDZXBHD-UHFFFAOYSA-N 1 1 349.460 3.666 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000553679281 1128494093 /nfs/dbraw/zinc/49/40/93/1128494093.db2.gz ZFLZVMPLQROSIK-FQEVSTJZSA-N 1 1 337.423 3.697 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548854 /nfs/dbraw/zinc/54/88/54/1128548854.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 1 1 345.487 3.990 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673403 1128901377 /nfs/dbraw/zinc/90/13/77/1128901377.db2.gz RJWAONUPVYSHLT-RHSMWYFYSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@@H](NCc1csc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245300 1121131899 /nfs/dbraw/zinc/13/18/99/1121131899.db2.gz XDIIOAJLVWRAAS-PBHICJAKSA-N 1 1 345.468 3.657 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000311001843 1128975406 /nfs/dbraw/zinc/97/54/06/1128975406.db2.gz INDGZJRTCYIUPE-QZTJIDSGSA-N 1 1 337.423 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000311034425 1128977151 /nfs/dbraw/zinc/97/71/51/1128977151.db2.gz QUDOHZYEGGSBQN-AWEZNQCLSA-N 1 1 347.365 3.807 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@H]21 ZINC000301716087 1128981215 /nfs/dbraw/zinc/98/12/15/1128981215.db2.gz NDFLOTNZLVAZKD-SMDDNHRTSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000542977380 1128982068 /nfs/dbraw/zinc/98/20/68/1128982068.db2.gz FSJCNUHSBLNQES-YEWWUXTCSA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032791932 1122104068 /nfs/dbraw/zinc/10/40/68/1122104068.db2.gz WWFFJNWMEIPLFF-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301163739 1122218990 /nfs/dbraw/zinc/21/89/90/1122218990.db2.gz CEDFAIJMMKEYQD-MRXNPFEDSA-N 1 1 343.402 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000301184216 1122298989 /nfs/dbraw/zinc/29/89/89/1122298989.db2.gz IYYSHDYKRGIEFF-KRWDZBQOSA-N 1 1 325.412 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775455 1129060465 /nfs/dbraw/zinc/06/04/65/1129060465.db2.gz LCIRCOFLJCIHFP-BLLLJJGKSA-N 1 1 335.835 3.701 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000301776542 1129061673 /nfs/dbraw/zinc/06/16/73/1129061673.db2.gz HSGWRHCXMWUAFW-UHFFFAOYSA-N 1 1 335.354 3.937 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000069222462 1122758924 /nfs/dbraw/zinc/75/89/24/1122758924.db2.gz PXMNDNRHRXEEPC-GFCCVEGCSA-N 1 1 347.802 3.846 20 5 EHBDMO C[C@@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131945 1123165404 /nfs/dbraw/zinc/16/54/04/1123165404.db2.gz BTHPXNWILXEPAA-AEFFLSMTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131945 1123165406 /nfs/dbraw/zinc/16/54/06/1123165406.db2.gz BTHPXNWILXEPAA-AEFFLSMTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H]1c2ccc(F)cc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610003929 1123711341 /nfs/dbraw/zinc/71/13/41/1123711341.db2.gz QRBIWJAZCPIHBV-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610003929 1123711344 /nfs/dbraw/zinc/71/13/44/1123711344.db2.gz QRBIWJAZCPIHBV-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000615837608 1123885197 /nfs/dbraw/zinc/88/51/97/1123885197.db2.gz LAPDJOXDGHTNGX-JQVXPOPVSA-N 1 1 326.343 3.702 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837156 1129173494 /nfs/dbraw/zinc/17/34/94/1129173494.db2.gz MKASNDFHOUXTGE-ZFWWWQNUSA-N 1 1 332.791 3.501 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000078704603 1129185069 /nfs/dbraw/zinc/18/50/69/1129185069.db2.gz WRRBBFCFKMLGID-FUHWJXTLSA-N 1 1 331.460 3.681 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000067472094 1129277131 /nfs/dbraw/zinc/27/71/31/1129277131.db2.gz UNIDWUMMLPSRED-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938961 1129393362 /nfs/dbraw/zinc/39/33/62/1129393362.db2.gz XQZDCIBXUHPQOP-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1nc(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000716229537 1131372215 /nfs/dbraw/zinc/37/22/15/1131372215.db2.gz NMPVILUDZPTSDS-YOEHRIQHSA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CO)c1cccc(Cl)c1F ZINC000466379723 1129410272 /nfs/dbraw/zinc/41/02/72/1129410272.db2.gz FRJRANMYEBUJFB-OAHLLOKOSA-N 1 1 338.766 3.519 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301972131 1129465807 /nfs/dbraw/zinc/46/58/07/1129465807.db2.gz HHWGDOSVLYSOAV-OAHLLOKOSA-N 1 1 342.443 3.923 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301975766 1129465865 /nfs/dbraw/zinc/46/58/65/1129465865.db2.gz CZDZOVGKMUDGAQ-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000301989612 1129485973 /nfs/dbraw/zinc/48/59/73/1129485973.db2.gz ONAIKAYHNDNOCD-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154292177 1129547091 /nfs/dbraw/zinc/54/70/91/1129547091.db2.gz GKURMTOZUMTBHJ-UHFFFAOYSA-N 1 1 328.416 3.780 20 5 EHBDMO CC(C)(C)c1n[nH]cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154292177 1129547094 /nfs/dbraw/zinc/54/70/94/1129547094.db2.gz GKURMTOZUMTBHJ-UHFFFAOYSA-N 1 1 328.416 3.780 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000328113001 1129548292 /nfs/dbraw/zinc/54/82/92/1129548292.db2.gz UYTPKRJJDIVYOW-LZLYRXPVSA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1c[nH]nc1-c1cccnc1)C1CC1 ZINC000154317920 1129549278 /nfs/dbraw/zinc/54/92/78/1129549278.db2.gz QFKGQOZKSKMBTK-UHFFFAOYSA-N 1 1 349.394 3.545 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1cccnc1)C1CC1 ZINC000154317920 1129549281 /nfs/dbraw/zinc/54/92/81/1129549281.db2.gz QFKGQOZKSKMBTK-UHFFFAOYSA-N 1 1 349.394 3.545 20 5 EHBDMO C[C@H](O)CC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000093481655 1129590515 /nfs/dbraw/zinc/59/05/15/1129590515.db2.gz WQZOHBGGYQFGQC-ZDUSSCGKSA-N 1 1 348.374 3.729 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684040 1129599861 /nfs/dbraw/zinc/59/98/61/1129599861.db2.gz ZIKOPFBZNSIWJH-IBGZPJMESA-N 1 1 340.423 3.942 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235130 1129672554 /nfs/dbraw/zinc/67/25/54/1129672554.db2.gz QCRDQFUORISOLM-OLZOCXBDSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429033017 1129714464 /nfs/dbraw/zinc/71/44/64/1129714464.db2.gz YZWPIRXXCCQZSJ-JNNRSPCRSA-N 1 1 331.460 3.626 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)cc1 ZINC000059406598 1129986381 /nfs/dbraw/zinc/98/63/81/1129986381.db2.gz AKWHETXMDVEIGM-IBGZPJMESA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)cc1 ZINC000059406598 1129986384 /nfs/dbraw/zinc/98/63/84/1129986384.db2.gz AKWHETXMDVEIGM-IBGZPJMESA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cccc(C(F)F)c3)C2)nc1 ZINC000348061575 1131145949 /nfs/dbraw/zinc/14/59/49/1131145949.db2.gz TYYXWDPXRVDKHY-AWEZNQCLSA-N 1 1 348.353 3.614 20 5 EHBDMO CC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(=O)OC(C)(C)C ZINC001172898413 1131883147 /nfs/dbraw/zinc/88/31/47/1131883147.db2.gz AMKLGMXQWXAYPU-WBVHZDCISA-N 1 1 348.443 3.552 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381104 1131914393 /nfs/dbraw/zinc/91/43/93/1131914393.db2.gz VZVFOFQIPWOCED-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO C[N@@H+](CCOc1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911054 1131917583 /nfs/dbraw/zinc/91/75/83/1131917583.db2.gz QUTATJCOBUZRAS-GOSISDBHSA-N 1 1 340.423 3.853 20 5 EHBDMO CC[N@@H+](Cc1ccccn1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912539 1131918229 /nfs/dbraw/zinc/91/82/29/1131918229.db2.gz BKWVBLVMJIHTSB-SFHVURJKSA-N 1 1 325.412 3.759 20 5 EHBDMO Cc1nc2c(s1)C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172912924 1131918525 /nfs/dbraw/zinc/91/85/25/1131918525.db2.gz MRXJKXPPHRDUFT-AWEZNQCLSA-N 1 1 329.425 3.623 20 5 EHBDMO Cc1nc2c(s1)C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172912924 1131918527 /nfs/dbraw/zinc/91/85/27/1131918527.db2.gz MRXJKXPPHRDUFT-AWEZNQCLSA-N 1 1 329.425 3.623 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001173181904 1131994217 /nfs/dbraw/zinc/99/42/17/1131994217.db2.gz QGBRFVHCPJKKPB-YVEFUNNKSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001173181904 1131994228 /nfs/dbraw/zinc/99/42/28/1131994228.db2.gz QGBRFVHCPJKKPB-YVEFUNNKSA-N 1 1 342.386 3.888 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001173224814 1132005008 /nfs/dbraw/zinc/00/50/08/1132005008.db2.gz PDZWTEQGXUFXNM-HNNXBMFYSA-N 1 1 331.460 3.509 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173229400 1132007815 /nfs/dbraw/zinc/00/78/15/1132007815.db2.gz UEOARKIPPZGBHD-AWEZNQCLSA-N 1 1 326.396 3.593 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001173235997 1132010940 /nfs/dbraw/zinc/01/09/40/1132010940.db2.gz DJHVRJQVJVSTOQ-GQIGUUNPSA-N 1 1 340.423 3.988 20 5 EHBDMO C[N@@H+]1CCCC[C@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745081885 1132195615 /nfs/dbraw/zinc/19/56/15/1132195615.db2.gz LLUISQBMGZNVIH-FQEVSTJZSA-N 1 1 334.419 3.916 20 5 EHBDMO C[N@H+]1CCCC[C@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745081885 1132195618 /nfs/dbraw/zinc/19/56/18/1132195618.db2.gz LLUISQBMGZNVIH-FQEVSTJZSA-N 1 1 334.419 3.916 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746070666 1132365562 /nfs/dbraw/zinc/36/55/62/1132365562.db2.gz UVNMYQONPWHGFK-UHFFFAOYSA-N 1 1 330.413 3.528 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738240913 1132551771 /nfs/dbraw/zinc/55/17/71/1132551771.db2.gz DTURCMOOENIOMF-SFHVURJKSA-N 1 1 336.395 3.911 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC001175759554 1132759627 /nfs/dbraw/zinc/75/96/27/1132759627.db2.gz XITDGFOHENTEOR-JTQLQIEISA-N 1 1 327.222 3.978 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000766932705 1132916166 /nfs/dbraw/zinc/91/61/66/1132916166.db2.gz RXKYHUBKFZGONE-KRWDZBQOSA-N 1 1 334.441 3.644 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000773705259 1133094826 /nfs/dbraw/zinc/09/48/26/1133094826.db2.gz UQUJVVMDMQUHKX-ZIAGYGMSSA-N 1 1 338.835 3.887 20 5 EHBDMO NC(=O)[C@H]1CC[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000768138673 1133101323 /nfs/dbraw/zinc/10/13/23/1133101323.db2.gz QAXZFORQVFKEQN-ZDUSSCGKSA-N 1 1 338.838 3.954 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC001179950537 1133305007 /nfs/dbraw/zinc/30/50/07/1133305007.db2.gz DXJNCYMNZRBBBL-IBGZPJMESA-N 1 1 328.412 3.767 20 5 EHBDMO COc1cncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878491 1133545401 /nfs/dbraw/zinc/54/54/01/1133545401.db2.gz BCJVVKRWLAEECG-MRXNPFEDSA-N 1 1 341.411 3.686 20 5 EHBDMO C[C@H](OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879806 1133923696 /nfs/dbraw/zinc/92/36/96/1133923696.db2.gz DVQCHOSYMBRABG-GUYCJALGSA-N 1 1 332.400 3.606 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001185080639 1134033439 /nfs/dbraw/zinc/03/34/39/1134033439.db2.gz AUTXDVJUZGGVHW-UHFFFAOYSA-N 1 1 345.365 3.924 20 5 EHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907255 1134116090 /nfs/dbraw/zinc/11/60/90/1134116090.db2.gz GHVBJHIXGZQUFS-DYVFJYSZSA-N 1 1 341.367 3.881 20 5 EHBDMO C[N@@H+](CCSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])Cc1ccccc1 ZINC000788567401 1134146355 /nfs/dbraw/zinc/14/63/55/1134146355.db2.gz AOEQJWSDHBGEAH-UHFFFAOYSA-N 1 1 347.396 3.727 20 5 EHBDMO COc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c(Cl)cc1[N+](=O)[O-] ZINC001186023041 1134161731 /nfs/dbraw/zinc/16/17/31/1134161731.db2.gz PTDSEQNXGBPEBT-OAHLLOKOSA-N 1 1 347.802 3.855 20 5 EHBDMO COc1cc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c(Cl)cc1[N+](=O)[O-] ZINC001186023041 1134161733 /nfs/dbraw/zinc/16/17/33/1134161733.db2.gz PTDSEQNXGBPEBT-OAHLLOKOSA-N 1 1 347.802 3.855 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170327229 1134749504 /nfs/dbraw/zinc/74/95/04/1134749504.db2.gz GAWUIBVZNFDMTF-OAHLLOKOSA-N 1 1 328.412 3.709 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340095 1134758124 /nfs/dbraw/zinc/75/81/24/1134758124.db2.gz DKJSTUQVEMFDHN-YPMHNXCESA-N 1 1 346.349 3.809 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170344998 1134758552 /nfs/dbraw/zinc/75/85/52/1134758552.db2.gz GDUBNJHWYYWTGM-GFCCVEGCSA-N 1 1 330.359 3.689 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2Cc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170344998 1134758556 /nfs/dbraw/zinc/75/85/56/1134758556.db2.gz GDUBNJHWYYWTGM-GFCCVEGCSA-N 1 1 330.359 3.689 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001190846194 1134759006 /nfs/dbraw/zinc/75/90/06/1134759006.db2.gz JLCWVZBAZGVQQF-GOSISDBHSA-N 1 1 340.423 3.928 20 5 EHBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202047 1134814686 /nfs/dbraw/zinc/81/46/86/1134814686.db2.gz DVWWPENSWUUDDL-ZBFHGGJFSA-N 1 1 326.824 3.884 20 5 EHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443598 1134867573 /nfs/dbraw/zinc/86/75/73/1134867573.db2.gz CQSRDUZQAXIRIM-BEFAXECRSA-N 1 1 326.396 3.852 20 5 EHBDMO COC(=O)c1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1Cl ZINC001192672501 1135043818 /nfs/dbraw/zinc/04/38/18/1135043818.db2.gz HYPIMXFZOVKSQE-LLVKDONJSA-N 1 1 348.786 3.886 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC001193020978 1135090611 /nfs/dbraw/zinc/09/06/11/1135090611.db2.gz FULUQMABZCZIJX-ZDUSSCGKSA-N 1 1 331.416 3.600 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC001193020978 1135090615 /nfs/dbraw/zinc/09/06/15/1135090615.db2.gz FULUQMABZCZIJX-ZDUSSCGKSA-N 1 1 331.416 3.600 20 5 EHBDMO CCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCN1CCCCCC1 ZINC001194772904 1135321105 /nfs/dbraw/zinc/32/11/05/1135321105.db2.gz UGJHYKGWSQSKIM-UHFFFAOYSA-N 1 1 349.475 3.562 20 5 EHBDMO CCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCN1CCCCCC1 ZINC001194772904 1135321107 /nfs/dbraw/zinc/32/11/07/1135321107.db2.gz UGJHYKGWSQSKIM-UHFFFAOYSA-N 1 1 349.475 3.562 20 5 EHBDMO Cc1ccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)c(C)c1 ZINC001196339772 1135548707 /nfs/dbraw/zinc/54/87/07/1135548707.db2.gz WLYMGKZSYFHXMQ-UHFFFAOYSA-N 1 1 339.439 3.842 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613093 1135589235 /nfs/dbraw/zinc/58/92/35/1135589235.db2.gz HTUWVHRXYYYZRL-VQTKUKTRSA-N 1 1 332.400 3.560 20 5 EHBDMO Cc1cccc(C)c1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001198194771 1135786835 /nfs/dbraw/zinc/78/68/35/1135786835.db2.gz JNLSHGOXTDCVKW-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000811454435 1136088834 /nfs/dbraw/zinc/08/88/34/1136088834.db2.gz KVDPKXFRVAURAC-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000811454435 1136088838 /nfs/dbraw/zinc/08/88/38/1136088838.db2.gz KVDPKXFRVAURAC-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000776234253 1136091650 /nfs/dbraw/zinc/09/16/50/1136091650.db2.gz OYTCYADHHAAEEC-VIHMKRCTSA-N 1 1 349.394 3.540 20 5 EHBDMO CCCn1cncc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001202271778 1136116970 /nfs/dbraw/zinc/11/69/70/1136116970.db2.gz YHFXORKFDOJHRM-UHFFFAOYSA-N 1 1 342.321 3.510 20 5 EHBDMO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000851791487 1136407555 /nfs/dbraw/zinc/40/75/55/1136407555.db2.gz BZBMFAYHEFXLBV-SFHVURJKSA-N 1 1 332.375 3.598 20 5 EHBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584566 1136442433 /nfs/dbraw/zinc/44/24/33/1136442433.db2.gz MYFGNYYSFWLFEQ-VQTJNVASSA-N 1 1 340.423 3.682 20 5 EHBDMO CC(C)C[N@@H+](CCc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579925 1136444812 /nfs/dbraw/zinc/44/48/12/1136444812.db2.gz PQVCIFLWYALVNW-HXUWFJFHSA-N 1 1 342.439 3.829 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000776591065 1136451133 /nfs/dbraw/zinc/45/11/33/1136451133.db2.gz GIIUWOLGLOPWRV-ZNZDAUKMSA-N 1 1 344.386 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cc1 ZINC000852427123 1136455188 /nfs/dbraw/zinc/45/51/88/1136455188.db2.gz STCNJWMFCBFGOL-AEFFLSMTSA-N 1 1 342.395 3.839 20 5 EHBDMO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCC[C@H](C)C1 ZINC000111193292 1136520522 /nfs/dbraw/zinc/52/05/22/1136520522.db2.gz PYRIPQLZTJNOGG-RYUDHWBXSA-N 1 1 334.445 3.737 20 5 EHBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815617764 1136619292 /nfs/dbraw/zinc/61/92/92/1136619292.db2.gz VAKIUSLJICFBDO-MLGOLLRUSA-N 1 1 343.431 3.683 20 5 EHBDMO CC[N@H+](c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000819398575 1136936074 /nfs/dbraw/zinc/93/60/74/1136936074.db2.gz OGANWGQVKRCZPG-LJQANCHMSA-N 1 1 343.427 3.975 20 5 EHBDMO CCCC[N@H+](C)c1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819436851 1136939579 /nfs/dbraw/zinc/93/95/79/1136939579.db2.gz GLKUGEHMYOXHLU-IBGZPJMESA-N 1 1 343.427 3.977 20 5 EHBDMO CCCC[N@@H+](C)c1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819436851 1136939581 /nfs/dbraw/zinc/93/95/81/1136939581.db2.gz GLKUGEHMYOXHLU-IBGZPJMESA-N 1 1 343.427 3.977 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1F ZINC000823659935 1137108519 /nfs/dbraw/zinc/10/85/19/1137108519.db2.gz AFCHYEZJBOCGSD-KRWDZBQOSA-N 1 1 334.391 3.515 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000824820728 1137153902 /nfs/dbraw/zinc/15/39/02/1137153902.db2.gz LKGIUSCUFRFUHW-AWEZNQCLSA-N 1 1 347.396 3.944 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000824820728 1137153904 /nfs/dbraw/zinc/15/39/04/1137153904.db2.gz LKGIUSCUFRFUHW-AWEZNQCLSA-N 1 1 347.396 3.944 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1Br ZINC000844469022 1137226840 /nfs/dbraw/zinc/22/68/40/1137226840.db2.gz TYGQHJBLEGMOOF-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1Br ZINC000844469022 1137226841 /nfs/dbraw/zinc/22/68/41/1137226841.db2.gz TYGQHJBLEGMOOF-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCCC[C@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC001171752310 1137508417 /nfs/dbraw/zinc/50/84/17/1137508417.db2.gz RPNQPBZMXFDXFL-INIZCTEOSA-N 1 1 334.416 3.637 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000872019142 1137564946 /nfs/dbraw/zinc/56/49/46/1137564946.db2.gz TZPMUGNVTGSGPD-VXGBXAGGSA-N 1 1 346.358 3.917 20 5 EHBDMO C[C@H]([NH2+]Cc1cccc2c1CCOC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872093717 1137570852 /nfs/dbraw/zinc/57/08/52/1137570852.db2.gz WHDYQNCUCVHOOP-LBPRGKRZSA-N 1 1 330.359 3.657 20 5 EHBDMO Cc1c(CNCc2cccc(C[NH+]3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000873007955 1137587883 /nfs/dbraw/zinc/58/78/83/1137587883.db2.gz BASROSBUHNGMOH-UHFFFAOYSA-N 1 1 339.439 3.789 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000877541898 1137680483 /nfs/dbraw/zinc/68/04/83/1137680483.db2.gz JGURWMNOPAXJTD-CQSZACIVSA-N 1 1 334.807 3.509 20 5 EHBDMO C[C@]1(C(F)(F)F)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000877813194 1137691073 /nfs/dbraw/zinc/69/10/73/1137691073.db2.gz XRSHEYKJBLCYMR-ZDUSSCGKSA-N 1 1 329.278 3.510 20 5 EHBDMO C[C@]1(C(F)(F)F)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000877813194 1137691074 /nfs/dbraw/zinc/69/10/74/1137691074.db2.gz XRSHEYKJBLCYMR-ZDUSSCGKSA-N 1 1 329.278 3.510 20 5 EHBDMO C[C@@H]1SCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000118417383 1137933706 /nfs/dbraw/zinc/93/37/06/1137933706.db2.gz XCGZTMJVADXCBW-STQMWFEESA-N 1 1 347.440 3.618 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000332323344 1137939882 /nfs/dbraw/zinc/93/98/82/1137939882.db2.gz NYZKVZSQMMVONP-LSDHHAIUSA-N 1 1 328.416 3.577 20 5 EHBDMO C[N@H+](Cc1csc2ccccc12)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940665 1138044300 /nfs/dbraw/zinc/04/43/00/1138044300.db2.gz DUHZAHACEOHTIE-KRWDZBQOSA-N 1 1 342.420 3.975 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000886612505 1138102071 /nfs/dbraw/zinc/10/20/71/1138102071.db2.gz MRNMDZFSQADIMZ-WFASDCNBSA-N 1 1 344.333 3.768 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1[N+](=O)[O-] ZINC000886684052 1138114597 /nfs/dbraw/zinc/11/45/97/1138114597.db2.gz DBOBFZPHJQBKSD-NSHDSACASA-N 1 1 331.372 3.710 20 5 EHBDMO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089902796 1138207398 /nfs/dbraw/zinc/20/73/98/1138207398.db2.gz LWRAYLOORGJUGR-NEPJUHHUSA-N 1 1 333.413 3.576 20 5 EHBDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089902796 1138207400 /nfs/dbraw/zinc/20/74/00/1138207400.db2.gz LWRAYLOORGJUGR-NEPJUHHUSA-N 1 1 333.413 3.576 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3C[C@@H]4CCC[C@@H]4C3)o2)c1 ZINC000153288459 1139130441 /nfs/dbraw/zinc/13/04/41/1139130441.db2.gz QSONWKMQLUSOQA-GASCZTMLSA-N 1 1 327.384 3.524 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000179479064 1139759659 /nfs/dbraw/zinc/75/96/59/1139759659.db2.gz CWWQBZLBWFHOBN-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000179479064 1139759665 /nfs/dbraw/zinc/75/96/65/1139759665.db2.gz CWWQBZLBWFHOBN-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186841743 1140224900 /nfs/dbraw/zinc/22/49/00/1140224900.db2.gz VCGIJHWYDLYQTO-CQSZACIVSA-N 1 1 336.457 3.562 20 5 EHBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000192190780 1140509319 /nfs/dbraw/zinc/50/93/19/1140509319.db2.gz RDCANXHLQMLPHH-ZDUSSCGKSA-N 1 1 347.440 3.620 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000267586522 1140806672 /nfs/dbraw/zinc/80/66/72/1140806672.db2.gz HRQDUPWZYCCSHQ-UHFFFAOYSA-N 1 1 331.397 3.862 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625583 1141128610 /nfs/dbraw/zinc/12/86/10/1141128610.db2.gz CJVFZWRAJVFQOA-IUODEOHRSA-N 1 1 349.456 3.649 20 5 EHBDMO Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271628924 1141408847 /nfs/dbraw/zinc/40/88/47/1141408847.db2.gz OOUPHUPCUYDZFZ-GJZGRUSLSA-N 1 1 341.411 3.889 20 5 EHBDMO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000271650816 1141412508 /nfs/dbraw/zinc/41/25/08/1141412508.db2.gz VBIJGUSTKBHLAS-STQMWFEESA-N 1 1 345.374 3.720 20 5 EHBDMO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C2CC2)cc1 ZINC000430230841 1015141027 /nfs/dbraw/zinc/14/10/27/1015141027.db2.gz ZOLOAWYNQOVVRI-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C2CC2)cc1 ZINC000430230841 1015141033 /nfs/dbraw/zinc/14/10/33/1015141033.db2.gz ZOLOAWYNQOVVRI-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000162168763 1120197866 /nfs/dbraw/zinc/19/78/66/1120197866.db2.gz SWRSYTSQMWEUAW-UHFFFAOYSA-N 1 1 325.162 3.549 20 5 EHBDMO CC1=C[C@H](C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430273575 1015691034 /nfs/dbraw/zinc/69/10/34/1015691034.db2.gz BBBOWWIAFRGCBM-ZDUSSCGKSA-N 1 1 327.384 3.690 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001167122480 1016177036 /nfs/dbraw/zinc/17/70/36/1016177036.db2.gz IPOXKASFUYCFFY-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177575783 1016386198 /nfs/dbraw/zinc/38/61/98/1016386198.db2.gz HONQGCBRCMILFQ-YUELXQCFSA-N 1 1 342.399 3.828 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157753 1032336952 /nfs/dbraw/zinc/33/69/52/1032336952.db2.gz ZBYHMKAHFXCVDO-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157753 1032336964 /nfs/dbraw/zinc/33/69/64/1032336964.db2.gz ZBYHMKAHFXCVDO-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO CCOC[C@H]1CCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459701747 1032425064 /nfs/dbraw/zinc/42/50/64/1032425064.db2.gz FETYLSQXKHNBES-QGZVFWFLSA-N 1 1 345.399 3.641 20 5 EHBDMO CCOC[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459701747 1032425068 /nfs/dbraw/zinc/42/50/68/1032425068.db2.gz FETYLSQXKHNBES-QGZVFWFLSA-N 1 1 345.399 3.641 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459792959 1032477259 /nfs/dbraw/zinc/47/72/59/1032477259.db2.gz KJYBPYFXGWNXQW-MDASCCDHSA-N 1 1 332.444 3.837 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000449455721 1032572399 /nfs/dbraw/zinc/57/23/99/1032572399.db2.gz AYGAGOZIRAVEET-LMMKCTJWSA-N 1 1 332.444 3.844 20 5 EHBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000597666468 1032599576 /nfs/dbraw/zinc/59/95/76/1032599576.db2.gz ICBNKAHGCPHSSU-GFCCVEGCSA-N 1 1 330.388 3.560 20 5 EHBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000597666484 1032600409 /nfs/dbraw/zinc/60/04/09/1032600409.db2.gz ICBNKAHGCPHSSU-LBPRGKRZSA-N 1 1 330.388 3.560 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000449494203 1032658268 /nfs/dbraw/zinc/65/82/68/1032658268.db2.gz GFXIFHWQHFFRBN-SUMWQHHRSA-N 1 1 330.384 3.712 20 5 EHBDMO C[C@H]1CCC[N@H+]1Cc1ccc(-c2cc(CO)cc([N+](=O)[O-])c2)cc1 ZINC000592987200 1032658500 /nfs/dbraw/zinc/65/85/00/1032658500.db2.gz WVGJLIYLYFYLQI-AWEZNQCLSA-N 1 1 326.396 3.738 20 5 EHBDMO CCc1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495958 1032665355 /nfs/dbraw/zinc/66/53/55/1032665355.db2.gz FQCKMSDVWBLHTP-CQSZACIVSA-N 1 1 331.441 3.993 20 5 EHBDMO C[C@H]([NH3+])[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656696 1017107716 /nfs/dbraw/zinc/10/77/16/1017107716.db2.gz IZXJBBZCULKIES-UONOGXRCSA-N 1 1 345.468 3.883 20 5 EHBDMO CCCn1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505387 1032688670 /nfs/dbraw/zinc/68/86/70/1032688670.db2.gz XGDAWPCRAJUYET-QGZVFWFLSA-N 1 1 328.416 3.581 20 5 EHBDMO CC1(C)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000127128314 1017446917 /nfs/dbraw/zinc/44/69/17/1017446917.db2.gz XOEIJDWEZGHSFY-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO O=C(C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000177393350 1017651812 /nfs/dbraw/zinc/65/18/12/1017651812.db2.gz GFBXIYVOIASWIN-AWEZNQCLSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000177393350 1017651820 /nfs/dbraw/zinc/65/18/20/1017651820.db2.gz GFBXIYVOIASWIN-AWEZNQCLSA-N 1 1 330.409 3.894 20 5 EHBDMO C[N@@H+](CCCOc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083168525 1017747150 /nfs/dbraw/zinc/74/71/50/1017747150.db2.gz DWTIWOHLWFMKEZ-UHFFFAOYSA-N 1 1 341.367 3.637 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C(F)F)c(F)c1 ZINC000892939762 1017797398 /nfs/dbraw/zinc/79/73/98/1017797398.db2.gz VOBMGUOILSPQOS-UHFFFAOYSA-N 1 1 340.301 3.970 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC001167325507 1018070575 /nfs/dbraw/zinc/07/05/75/1018070575.db2.gz CGGSZXVYORIEAA-LBPRGKRZSA-N 1 1 348.834 3.979 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000052306325 1018919750 /nfs/dbraw/zinc/91/97/50/1018919750.db2.gz VOOIRORVQAHICM-UHFFFAOYSA-N 1 1 328.343 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000052306325 1018919759 /nfs/dbraw/zinc/91/97/59/1018919759.db2.gz VOOIRORVQAHICM-UHFFFAOYSA-N 1 1 328.343 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000322473397 1019119716 /nfs/dbraw/zinc/11/97/16/1019119716.db2.gz PFBGZDFNODWRKA-SRCQZFHVSA-N 1 1 338.835 3.764 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000119072918 1019260570 /nfs/dbraw/zinc/26/05/70/1019260570.db2.gz KHSQIBOMEQAMDX-UHFFFAOYSA-N 1 1 342.395 3.607 20 5 EHBDMO CC(C)[N@H+](CC(=O)N[C@@H]1CCCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513411060 1019616273 /nfs/dbraw/zinc/61/62/73/1019616273.db2.gz JDNKUODSXUYMEZ-MAUKXSAKSA-N 1 1 347.459 3.500 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N[C@@H]1CCCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513411060 1019616277 /nfs/dbraw/zinc/61/62/77/1019616277.db2.gz JDNKUODSXUYMEZ-MAUKXSAKSA-N 1 1 347.459 3.500 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+]2C2CC2)cc1OC(F)F ZINC000433817117 1019655979 /nfs/dbraw/zinc/65/59/79/1019655979.db2.gz CIQGSHXPFIKJKU-ZDUSSCGKSA-N 1 1 341.358 3.625 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](C)O ZINC000513668449 1019919936 /nfs/dbraw/zinc/91/99/36/1019919936.db2.gz YUJNXLDWFCVOPX-CYBMUJFWSA-N 1 1 334.441 3.915 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513696559 1020429000 /nfs/dbraw/zinc/42/90/00/1020429000.db2.gz ALMFUQFPGILGSV-GOSISDBHSA-N 1 1 342.443 3.978 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CC[N@H+](C4CCCC4)C3)c2c1 ZINC000413129975 1020729261 /nfs/dbraw/zinc/72/92/61/1020729261.db2.gz QCVDMNXULMWJCX-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(C2CCC2)s1 ZINC000348676755 1021272605 /nfs/dbraw/zinc/27/26/05/1021272605.db2.gz SRWGYQZFCAWLOZ-UHFFFAOYSA-N 1 1 331.441 3.993 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCOCc1ccccc1 ZINC000439486420 1021476509 /nfs/dbraw/zinc/47/65/09/1021476509.db2.gz LYGXYHGNHLRFDV-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000120885877 1021480825 /nfs/dbraw/zinc/48/08/25/1021480825.db2.gz WWPJEWGVDOSQGA-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO Cc1ccc(F)c(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000337419358 1021527961 /nfs/dbraw/zinc/52/79/61/1021527961.db2.gz OZPKSUOSUUYMRE-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO COc1cccc2c1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000426505042 1021744878 /nfs/dbraw/zinc/74/48/78/1021744878.db2.gz RWTYQTUCTZVUEK-UHFFFAOYSA-N 1 1 326.396 3.513 20 5 EHBDMO CCCCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(C)C ZINC000172895871 1033004323 /nfs/dbraw/zinc/00/43/23/1033004323.db2.gz PZNBFNTTYNIMHY-UHFFFAOYSA-N 1 1 331.420 3.711 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccn2Cc1c[nH+]cn1Cc1ccccc1 ZINC000437619940 1022006821 /nfs/dbraw/zinc/00/68/21/1022006821.db2.gz YCPMCKFGEWSZCE-UHFFFAOYSA-N 1 1 332.363 3.843 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441240831 1022076657 /nfs/dbraw/zinc/07/66/57/1022076657.db2.gz CLZSYKUHLIPYGY-KRWDZBQOSA-N 1 1 342.395 3.819 20 5 EHBDMO COc1c(O)ccc(CNc2ccc(C3CCC3)c[nH+]2)c1[N+](=O)[O-] ZINC000894645627 1022661157 /nfs/dbraw/zinc/66/11/57/1022661157.db2.gz PBTUIOGXKZGPIT-UHFFFAOYSA-N 1 1 329.356 3.584 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000506328572 1022937776 /nfs/dbraw/zinc/93/77/76/1022937776.db2.gz VKJWAQPABMHFGQ-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000506328572 1022937782 /nfs/dbraw/zinc/93/77/82/1022937782.db2.gz VKJWAQPABMHFGQ-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@H](C(C)C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000518268018 1023178629 /nfs/dbraw/zinc/17/86/29/1023178629.db2.gz CIIZNVRQVZJMJB-LJQANCHMSA-N 1 1 333.476 3.749 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000518374216 1023262567 /nfs/dbraw/zinc/26/25/67/1023262567.db2.gz TXNBCMSYFVRLIO-ZDUSSCGKSA-N 1 1 346.818 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000602732948 1033124612 /nfs/dbraw/zinc/12/46/12/1033124612.db2.gz WBPUBNXSAQSSSC-FUHWJXTLSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000602732948 1033124617 /nfs/dbraw/zinc/12/46/17/1033124617.db2.gz WBPUBNXSAQSSSC-FUHWJXTLSA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000602758775 1033130139 /nfs/dbraw/zinc/13/01/39/1033130139.db2.gz NQUTWOXSYPWKHH-GFCCVEGCSA-N 1 1 328.372 3.539 20 5 EHBDMO CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000610773962 1023495015 /nfs/dbraw/zinc/49/50/15/1023495015.db2.gz YWZYYXNQFOUNCE-INIZCTEOSA-N 1 1 342.395 3.647 20 5 EHBDMO Cc1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000535825208 1023799663 /nfs/dbraw/zinc/79/96/63/1023799663.db2.gz PIMDEYZPBQMVAU-IBGZPJMESA-N 1 1 340.423 3.737 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000247728900 1023906035 /nfs/dbraw/zinc/90/60/35/1023906035.db2.gz UADYPSSSQNFBNO-WDEREUQCSA-N 1 1 327.812 3.553 20 5 EHBDMO CC(C)[N@H+](Cc1cccs1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611254963 1024311128 /nfs/dbraw/zinc/31/11/28/1024311128.db2.gz IEFOQYRYSVIGAN-UHFFFAOYSA-N 1 1 348.424 3.838 20 5 EHBDMO CC(C)[N@@H+](Cc1cccs1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611254963 1024311145 /nfs/dbraw/zinc/31/11/45/1024311145.db2.gz IEFOQYRYSVIGAN-UHFFFAOYSA-N 1 1 348.424 3.838 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505631831 1024702286 /nfs/dbraw/zinc/70/22/86/1024702286.db2.gz DWNSIQTXPLORTO-UKRRQHHQSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505631831 1024702298 /nfs/dbraw/zinc/70/22/98/1024702298.db2.gz DWNSIQTXPLORTO-UKRRQHHQSA-N 1 1 330.384 3.854 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000071943355 1024815220 /nfs/dbraw/zinc/81/52/20/1024815220.db2.gz VTAWKQWRRBAWQG-UHFFFAOYSA-N 1 1 348.447 3.571 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H]2C[C@H](O)C2(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427871700 1024853932 /nfs/dbraw/zinc/85/39/32/1024853932.db2.gz WQRPYQCHQZEPGM-FGTMMUONSA-N 1 1 344.411 3.589 20 5 EHBDMO C[C@H]([NH3+])[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372448 1024855836 /nfs/dbraw/zinc/85/58/36/1024855836.db2.gz RHEHSJHGXYMHCN-NWDGAFQWSA-N 1 1 349.818 3.677 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425373055 1024901449 /nfs/dbraw/zinc/90/14/49/1024901449.db2.gz PGLCYOMVBYFQCY-SFHVURJKSA-N 1 1 330.428 3.684 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310352392 1025131203 /nfs/dbraw/zinc/13/12/03/1025131203.db2.gz HFQOPBUEDMJJFX-QGZVFWFLSA-N 1 1 325.412 3.837 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510212 1025305420 /nfs/dbraw/zinc/30/54/20/1025305420.db2.gz HLSZEEKUGVNTGR-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO C[C@H]1CSCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000934303745 1025347722 /nfs/dbraw/zinc/34/77/22/1025347722.db2.gz KWTQFRAHZMRUMH-LBPRGKRZSA-N 1 1 333.413 3.577 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1c[nH]c2ccccc12 ZINC000442889457 1025573642 /nfs/dbraw/zinc/57/36/42/1025573642.db2.gz KJRAQHRTRNAYEJ-UHFFFAOYSA-N 1 1 339.395 3.977 20 5 EHBDMO Cc1ccccc1[C@@H]([C@@H](C)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000443008631 1025659247 /nfs/dbraw/zinc/65/92/47/1025659247.db2.gz GZNMZXXGYBGRAL-DNVCBOLYSA-N 1 1 327.428 3.684 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)C)CC1 ZINC000530361269 1025704329 /nfs/dbraw/zinc/70/43/29/1025704329.db2.gz HUAKKOFUKKIPMF-ZDUSSCGKSA-N 1 1 333.432 3.680 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(C)(C)C)CC1 ZINC000530361268 1025705049 /nfs/dbraw/zinc/70/50/49/1025705049.db2.gz HUAKKOFUKKIPMF-CYBMUJFWSA-N 1 1 333.432 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCCCn3cccn3)C2)cc1 ZINC000451550143 1026101279 /nfs/dbraw/zinc/10/12/79/1026101279.db2.gz RHBUAXUIUJXKOE-SFHVURJKSA-N 1 1 342.443 3.841 20 5 EHBDMO Cc1cnc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553130 1026105188 /nfs/dbraw/zinc/10/51/88/1026105188.db2.gz XKWYEGNAIJXXGW-ZBFHGGJFSA-N 1 1 326.400 3.634 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000338999666 1026333385 /nfs/dbraw/zinc/33/33/85/1026333385.db2.gz ISLHUAMZGWXMMO-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451971600 1026428592 /nfs/dbraw/zinc/42/85/92/1026428592.db2.gz LZGFGMNIYCKPGO-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C2CC2)O1 ZINC000475296338 1026448729 /nfs/dbraw/zinc/44/87/29/1026448729.db2.gz UJFKVNNUMBAHNJ-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C2CC2)O1 ZINC000475296338 1026448737 /nfs/dbraw/zinc/44/87/37/1026448737.db2.gz UJFKVNNUMBAHNJ-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000472247764 1027072831 /nfs/dbraw/zinc/07/28/31/1027072831.db2.gz SVVPBZSVMSVMJH-GOSISDBHSA-N 1 1 348.422 3.520 20 5 EHBDMO O=c1[nH]c2ccccc2cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183807886 1027109659 /nfs/dbraw/zinc/10/96/59/1027109659.db2.gz QLBJCPSXIWTVFL-UHFFFAOYSA-N 1 1 343.770 3.792 20 5 EHBDMO COc1cc(C[N@@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000186612809 1027660169 /nfs/dbraw/zinc/66/01/69/1027660169.db2.gz QWBHYVIYQMDIJC-UHFFFAOYSA-N 1 1 342.342 3.581 20 5 EHBDMO COc1cc(C[N@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000186612809 1027660181 /nfs/dbraw/zinc/66/01/81/1027660181.db2.gz QWBHYVIYQMDIJC-UHFFFAOYSA-N 1 1 342.342 3.581 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC(C)(C)CC1 ZINC000533438725 1027846999 /nfs/dbraw/zinc/84/69/99/1027846999.db2.gz NAEUZNILCFWRRJ-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000366725328 1027849068 /nfs/dbraw/zinc/84/90/68/1027849068.db2.gz WMYDHSMIEBZJGX-AUUYWEPGSA-N 1 1 336.395 3.769 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000300421470 1027967275 /nfs/dbraw/zinc/96/72/75/1027967275.db2.gz FAUQPZUEACTAGG-MNOVXSKESA-N 1 1 342.237 3.560 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCC[C@@H]1C ZINC000444676939 1028144912 /nfs/dbraw/zinc/14/49/12/1028144912.db2.gz OUDUGSSSDXMYDO-SUMWQHHRSA-N 1 1 334.416 3.862 20 5 EHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680971 1028152159 /nfs/dbraw/zinc/15/21/59/1028152159.db2.gz XWJDRIGGGIGOOL-PBHICJAKSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000444708502 1028185917 /nfs/dbraw/zinc/18/59/17/1028185917.db2.gz RCOAMHTUMLHUIJ-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000444708502 1028185922 /nfs/dbraw/zinc/18/59/22/1028185922.db2.gz RCOAMHTUMLHUIJ-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375320 1028196913 /nfs/dbraw/zinc/19/69/13/1028196913.db2.gz GVHMPKIVRJBYOK-WDEREUQCSA-N 1 1 332.356 3.695 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444749766 1028234954 /nfs/dbraw/zinc/23/49/54/1028234954.db2.gz VAGVNQZBXZOLCB-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444749766 1028234973 /nfs/dbraw/zinc/23/49/73/1028234973.db2.gz VAGVNQZBXZOLCB-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)c1ccccc1 ZINC000063482847 1028583961 /nfs/dbraw/zinc/58/39/61/1028583961.db2.gz GARMWXDKGGPYHJ-OAHLLOKOSA-N 1 1 341.411 3.925 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)c1ccccc1Cl ZINC000008173492 1028706056 /nfs/dbraw/zinc/70/60/56/1028706056.db2.gz BITFAONHKSXJDI-LBPRGKRZSA-N 1 1 347.802 3.846 20 5 EHBDMO Cc1cc(-c2noc([C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299255 1030048421 /nfs/dbraw/zinc/04/84/21/1030048421.db2.gz WZUKBQZBRLIXAJ-XQQFMLRXSA-N 1 1 330.388 3.887 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245515285 1030109180 /nfs/dbraw/zinc/10/91/80/1030109180.db2.gz DJQBSAGIKSFGQZ-MPGHIAIKSA-N 1 1 328.416 3.744 20 5 EHBDMO CC1(C)C[C@@H]([N@H+]2CCC[C@@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381841 1030163104 /nfs/dbraw/zinc/16/31/04/1030163104.db2.gz RIGNCQNQXOEKMD-IEBWSBKVSA-N 1 1 330.428 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(OC(F)F)cc1)CC2 ZINC000532038816 1030303479 /nfs/dbraw/zinc/30/34/79/1030303479.db2.gz JLKUGPADRVVUKC-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(OC(F)F)cc1)CC2 ZINC000532038816 1030303497 /nfs/dbraw/zinc/30/34/97/1030303497.db2.gz JLKUGPADRVVUKC-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO Cc1ccsc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042473766 1030626129 /nfs/dbraw/zinc/62/61/29/1030626129.db2.gz JVQCVARDIKZGLN-CYBMUJFWSA-N 1 1 347.440 3.732 20 5 EHBDMO Cc1ccsc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042473766 1030626135 /nfs/dbraw/zinc/62/61/35/1030626135.db2.gz JVQCVARDIKZGLN-CYBMUJFWSA-N 1 1 347.440 3.732 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683453 1030638467 /nfs/dbraw/zinc/63/84/67/1030638467.db2.gz YHPIYHGQCKDBTM-HNNXBMFYSA-N 1 1 338.411 3.924 20 5 EHBDMO COc1cc(F)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000583816991 1030829573 /nfs/dbraw/zinc/82/95/73/1030829573.db2.gz SAWMDPPDCIMJDQ-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000585756374 1030916899 /nfs/dbraw/zinc/91/68/99/1030916899.db2.gz GZTONAHSDYSATH-OXJNMPFZSA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000475741219 1031719949 /nfs/dbraw/zinc/71/99/49/1031719949.db2.gz WHJUIDMUBJQCLR-VNHYZAJKSA-N 1 1 333.432 3.598 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)Cc1ccccc1 ZINC000007340046 1031975115 /nfs/dbraw/zinc/97/51/15/1031975115.db2.gz YEUSUVBNAMTLDM-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)Cc1ccccc1 ZINC000007340046 1031975128 /nfs/dbraw/zinc/97/51/28/1031975128.db2.gz YEUSUVBNAMTLDM-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C1CC1)C1CCCCC1 ZINC000063497913 1033406408 /nfs/dbraw/zinc/40/64/08/1033406408.db2.gz UOYCJRSSJYTBNG-UHFFFAOYSA-N 1 1 331.416 3.639 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001168285610 1033418949 /nfs/dbraw/zinc/41/89/49/1033418949.db2.gz VRXSUGXGFJGJMF-CYBMUJFWSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001168285610 1033418957 /nfs/dbraw/zinc/41/89/57/1033418957.db2.gz VRXSUGXGFJGJMF-CYBMUJFWSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccccc3Cl)CC2)c1 ZINC000061019316 1033441182 /nfs/dbraw/zinc/44/11/82/1033441182.db2.gz MOOHGNJDYDLJNR-UHFFFAOYSA-N 1 1 331.803 3.570 20 5 EHBDMO CCC(=O)c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594597638 1033444291 /nfs/dbraw/zinc/44/42/91/1033444291.db2.gz DGOHZZQYLWFVPN-GOEBONIOSA-N 1 1 331.416 3.616 20 5 EHBDMO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000595019109 1033612681 /nfs/dbraw/zinc/61/26/81/1033612681.db2.gz IGZMWIKDWWATEF-CXAGYDPISA-N 1 1 330.384 3.642 20 5 EHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000078558903 1033707060 /nfs/dbraw/zinc/70/70/60/1033707060.db2.gz JHFUCTWHSGMBTK-QGZVFWFLSA-N 1 1 340.358 3.863 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000595300274 1033726636 /nfs/dbraw/zinc/72/66/36/1033726636.db2.gz OUFXDZLLHPIKAZ-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000595300274 1033726650 /nfs/dbraw/zinc/72/66/50/1033726650.db2.gz OUFXDZLLHPIKAZ-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(Oc2ccc(F)cc2)CC1 ZINC000595317524 1033738719 /nfs/dbraw/zinc/73/87/19/1033738719.db2.gz AEZCGIDKCYBHFK-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1 ZINC000592996947 1033778067 /nfs/dbraw/zinc/77/80/67/1033778067.db2.gz DYFMLSXXESUECS-GFCCVEGCSA-N 1 1 346.358 3.714 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)c1 ZINC000592996947 1033778083 /nfs/dbraw/zinc/77/80/83/1033778083.db2.gz DYFMLSXXESUECS-GFCCVEGCSA-N 1 1 346.358 3.714 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3ccc(F)cc3C)CC2)c1[N+](=O)[O-] ZINC000595501614 1033831227 /nfs/dbraw/zinc/83/12/27/1033831227.db2.gz WVIWJPDXTASEHU-UHFFFAOYSA-N 1 1 333.363 3.718 20 5 EHBDMO CCOC(=O)CC(C)(C)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001168307607 1033836731 /nfs/dbraw/zinc/83/67/31/1033836731.db2.gz CZHAXZWQXDNEAM-UHFFFAOYSA-N 1 1 348.443 3.929 20 5 EHBDMO COc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000603838750 1033950758 /nfs/dbraw/zinc/95/07/58/1033950758.db2.gz GSXMYCWWGBNKIR-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603837514 1033962943 /nfs/dbraw/zinc/96/29/43/1033962943.db2.gz PHFFMGJDQHARGS-AWEZNQCLSA-N 1 1 330.384 3.675 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595787490 1033999197 /nfs/dbraw/zinc/99/91/97/1033999197.db2.gz JGGVRTRRNPPURH-SJCJKPOMSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595787490 1033999208 /nfs/dbraw/zinc/99/92/08/1033999208.db2.gz JGGVRTRRNPPURH-SJCJKPOMSA-N 1 1 340.370 3.654 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450286724 1034024195 /nfs/dbraw/zinc/02/41/95/1034024195.db2.gz IUFLTFUQNVZLCX-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO C[N@@H+](CCSc1c(Cl)cncc1[N+](=O)[O-])Cc1ccccc1 ZINC000596215126 1034122254 /nfs/dbraw/zinc/12/22/54/1034122254.db2.gz QEQSVOPKGDJUAX-UHFFFAOYSA-N 1 1 337.832 3.867 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141112 1034145246 /nfs/dbraw/zinc/14/52/46/1034145246.db2.gz BKZIGRNOIQSMRG-IJVDHGTGSA-N 1 1 344.333 3.651 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141112 1034145267 /nfs/dbraw/zinc/14/52/67/1034145267.db2.gz BKZIGRNOIQSMRG-IJVDHGTGSA-N 1 1 344.333 3.651 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000596296321 1034147627 /nfs/dbraw/zinc/14/76/27/1034147627.db2.gz HAVCDQYUSYMCRZ-TZMCWYRMSA-N 1 1 325.359 3.961 20 5 EHBDMO CC1(C)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000596591120 1034306654 /nfs/dbraw/zinc/30/66/54/1034306654.db2.gz GRSPEXQDPKVTJR-SFHVURJKSA-N 1 1 341.411 3.842 20 5 EHBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000596591120 1034306675 /nfs/dbraw/zinc/30/66/75/1034306675.db2.gz GRSPEXQDPKVTJR-SFHVURJKSA-N 1 1 341.411 3.842 20 5 EHBDMO C[C@H]1CCC[N@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CO)c1 ZINC000596634287 1034338917 /nfs/dbraw/zinc/33/89/17/1034338917.db2.gz IIXYFJAZHUAKRP-AWEZNQCLSA-N 1 1 326.396 3.738 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CCC(C)C)C1CC1 ZINC000604435089 1034377799 /nfs/dbraw/zinc/37/77/99/1034377799.db2.gz MAZUIPOYUAYUOK-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cccc([N+](=O)[O-])c2n1 ZINC000376235098 1035488032 /nfs/dbraw/zinc/48/80/32/1035488032.db2.gz NZLRSQXBMJGPBN-YIONKMFJSA-N 1 1 340.427 3.513 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCOc2ccccc2F)ccc1[N+](=O)[O-] ZINC000492484045 1035857433 /nfs/dbraw/zinc/85/74/33/1035857433.db2.gz LULVURAZWZBGTI-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492770134 1036269044 /nfs/dbraw/zinc/26/90/44/1036269044.db2.gz LSFDJAKAHRNAMD-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200173 1036305530 /nfs/dbraw/zinc/30/55/30/1036305530.db2.gz VQUVAWFZZFZSGV-MWRSBEEJSA-N 1 1 330.428 3.747 20 5 EHBDMO CCC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000464676753 1036652167 /nfs/dbraw/zinc/65/21/67/1036652167.db2.gz JFXGEYJVTZAOPJ-AWEZNQCLSA-N 1 1 340.395 3.524 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](C(C)C)C1 ZINC000464768906 1036759201 /nfs/dbraw/zinc/75/92/01/1036759201.db2.gz CKODGWTZWSKJFR-KRWDZBQOSA-N 1 1 338.473 3.955 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C(C)C)C1 ZINC000464768906 1036759215 /nfs/dbraw/zinc/75/92/15/1036759215.db2.gz CKODGWTZWSKJFR-KRWDZBQOSA-N 1 1 338.473 3.955 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000191290388 1036886554 /nfs/dbraw/zinc/88/65/54/1036886554.db2.gz UFBXARJLCPAHDZ-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO CC(C)[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907086 1036935923 /nfs/dbraw/zinc/93/59/23/1036935923.db2.gz JFRSKFFJFMCMPG-INIZCTEOSA-N 1 1 347.440 3.823 20 5 EHBDMO CC(C)[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907086 1036935939 /nfs/dbraw/zinc/93/59/39/1036935939.db2.gz JFRSKFFJFMCMPG-INIZCTEOSA-N 1 1 347.440 3.823 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651847 1036940176 /nfs/dbraw/zinc/94/01/76/1036940176.db2.gz JXVZIURJJKLCLL-NFAWXSAZSA-N 1 1 333.432 3.598 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000173895157 1037070187 /nfs/dbraw/zinc/07/01/87/1037070187.db2.gz CBFNYVDKCTXXDZ-IGCXYCKISA-N 1 1 332.400 3.614 20 5 EHBDMO Cn1c[nH+]c2cc(N[C@@H](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000539740318 1037140684 /nfs/dbraw/zinc/14/06/84/1037140684.db2.gz GIXHSUMSJBVYNI-INIZCTEOSA-N 1 1 336.395 3.915 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C ZINC000493282109 1037215049 /nfs/dbraw/zinc/21/50/49/1037215049.db2.gz SDXYCQBBINWWBQ-CHWSQXEVSA-N 1 1 325.840 3.553 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1)CC(C)C ZINC000540204427 1037681082 /nfs/dbraw/zinc/68/10/82/1037681082.db2.gz CNSSOFGYNVPVMX-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc2[nH]ccc21 ZINC000494051146 1037795986 /nfs/dbraw/zinc/79/59/86/1037795986.db2.gz TXLXIGLHDDNNPP-UHFFFAOYSA-N 1 1 336.351 3.849 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000463198568 1037864133 /nfs/dbraw/zinc/86/41/33/1037864133.db2.gz NKMMWJVLBOQQFG-JZXOWHBKSA-N 1 1 348.443 3.509 20 5 EHBDMO O=C(CC[N@H+]1CCCC[C@@H]1C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000592199119 1037945187 /nfs/dbraw/zinc/94/51/87/1037945187.db2.gz XABHQHLEECZCAS-MRXNPFEDSA-N 1 1 331.416 3.578 20 5 EHBDMO Cn1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(-c2ccccc2)n1 ZINC000540481020 1037990592 /nfs/dbraw/zinc/99/05/92/1037990592.db2.gz IRIYMPROMQADAE-UHFFFAOYSA-N 1 1 348.406 3.554 20 5 EHBDMO Cn1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(-c2ccccc2)n1 ZINC000540481020 1037990609 /nfs/dbraw/zinc/99/06/09/1037990609.db2.gz IRIYMPROMQADAE-UHFFFAOYSA-N 1 1 348.406 3.554 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc2ccc(Cl)cn12 ZINC000549408251 1038324794 /nfs/dbraw/zinc/32/47/94/1038324794.db2.gz LVJHXGXMNLDHRB-UHFFFAOYSA-N 1 1 344.802 3.570 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](CO)C(C)(C)C ZINC000538761416 1038527349 /nfs/dbraw/zinc/52/73/49/1038527349.db2.gz CKRRLLBQEGUPER-KRWDZBQOSA-N 1 1 332.400 3.694 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCC[C@@H]1O ZINC000538812486 1038548379 /nfs/dbraw/zinc/54/83/79/1038548379.db2.gz RSVXKRXWDSVLFW-GUYCJALGSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788568 1038610727 /nfs/dbraw/zinc/61/07/27/1038610727.db2.gz XRQODSBVBBMGEA-VXGBXAGGSA-N 1 1 343.349 3.961 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ncccc2[N+](=O)[O-])CC1)CC(C)C ZINC000539105460 1038689450 /nfs/dbraw/zinc/68/94/50/1038689450.db2.gz BSOYLFIBEUOVKN-UHFFFAOYSA-N 1 1 334.464 3.574 20 5 EHBDMO C[N@H+](Cc1ccccc1)[C@@H](CNCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870453 1038811907 /nfs/dbraw/zinc/81/19/07/1038811907.db2.gz AGNUAAQMNGELGX-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870453 1038811932 /nfs/dbraw/zinc/81/19/32/1038811932.db2.gz AGNUAAQMNGELGX-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000552137792 1038998378 /nfs/dbraw/zinc/99/83/78/1038998378.db2.gz NAHXLJCRUSDESP-OUQXZNHLSA-N 1 1 332.444 3.729 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485473039 1039136530 /nfs/dbraw/zinc/13/65/30/1039136530.db2.gz HMALGUOIWVHCKB-WMLDXEAASA-N 1 1 326.396 3.981 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H](CCO)c1ccco1)CCCC2 ZINC000417345687 1039708422 /nfs/dbraw/zinc/70/84/22/1039708422.db2.gz SEZWJDNCEDSATM-IRXDYDNUSA-N 1 1 330.384 3.669 20 5 EHBDMO COc1cc(CSCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000433022855 1040481949 /nfs/dbraw/zinc/48/19/49/1040481949.db2.gz MFVSOISVMNRDNW-UHFFFAOYSA-N 1 1 346.452 3.969 20 5 EHBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593282 1040621195 /nfs/dbraw/zinc/62/11/95/1040621195.db2.gz VJJPCHYUCBINMU-KZULUSFZSA-N 1 1 330.359 3.558 20 5 EHBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593282 1040621210 /nfs/dbraw/zinc/62/12/10/1040621210.db2.gz VJJPCHYUCBINMU-KZULUSFZSA-N 1 1 330.359 3.558 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000490799453 1040749021 /nfs/dbraw/zinc/74/90/21/1040749021.db2.gz DRFZPCZXNGZRMS-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022889 1040869047 /nfs/dbraw/zinc/86/90/47/1040869047.db2.gz QDAMCVZUECETNM-XLIONFOSSA-N 1 1 337.423 3.511 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022889 1040869058 /nfs/dbraw/zinc/86/90/58/1040869058.db2.gz QDAMCVZUECETNM-XLIONFOSSA-N 1 1 337.423 3.511 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854509 1041246017 /nfs/dbraw/zinc/24/60/17/1041246017.db2.gz HVAQPCMSVJZZHV-CABCVRRESA-N 1 1 341.411 3.657 20 5 EHBDMO CC[N@@H+](Cc1ccoc1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092935765 1041569713 /nfs/dbraw/zinc/56/97/13/1041569713.db2.gz ZLKWXHHLZVXQIQ-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO CCN(CC)[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000236898791 1042600556 /nfs/dbraw/zinc/60/05/56/1042600556.db2.gz YTKPJLHYFGVAHY-MRXNPFEDSA-N 1 1 333.457 3.829 20 5 EHBDMO Cc1cccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1[N+](=O)[O-] ZINC000278910507 1042918962 /nfs/dbraw/zinc/91/89/62/1042918962.db2.gz RWELPQJIXXUYDW-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cc1F ZINC000931913358 1043738074 /nfs/dbraw/zinc/73/80/74/1043738074.db2.gz MEPDQSSSXSBSSC-LBPRGKRZSA-N 1 1 336.260 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)cc1F ZINC000931913358 1043738084 /nfs/dbraw/zinc/73/80/84/1043738084.db2.gz MEPDQSSSXSBSSC-LBPRGKRZSA-N 1 1 336.260 3.600 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000279673961 1044394580 /nfs/dbraw/zinc/39/45/80/1044394580.db2.gz NQQZHBAYXHDIHD-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039957 1127568656 /nfs/dbraw/zinc/56/86/56/1127568656.db2.gz USRGYCZPIAHOLJ-UKRRQHHQSA-N 1 1 348.472 3.816 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000301280860 1127729307 /nfs/dbraw/zinc/72/93/07/1127729307.db2.gz ODWABDAHJNTDDM-GFCCVEGCSA-N 1 1 326.828 3.567 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477795 1131242514 /nfs/dbraw/zinc/24/25/14/1131242514.db2.gz UMDLYFQDCXRZKI-RHSMWYFYSA-N 1 1 336.395 3.780 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000338682932 1128520719 /nfs/dbraw/zinc/52/07/19/1128520719.db2.gz VVKPCVAHJRCXTF-UHFFFAOYSA-N 1 1 342.321 3.929 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000715646808 1128654094 /nfs/dbraw/zinc/65/40/94/1128654094.db2.gz GJCLYGOBKBGZMW-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c(Cl)c1 ZINC000715646808 1128654097 /nfs/dbraw/zinc/65/40/97/1128654097.db2.gz GJCLYGOBKBGZMW-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO Cc1cc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000301650589 1128845346 /nfs/dbraw/zinc/84/53/46/1128845346.db2.gz GHWWXSUNMNQIAG-MRXNPFEDSA-N 1 1 346.475 3.779 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000311001848 1128975648 /nfs/dbraw/zinc/97/56/48/1128975648.db2.gz INDGZJRTCYIUPE-ZWKOTPCHSA-N 1 1 337.423 3.553 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000193836370 1121720970 /nfs/dbraw/zinc/72/09/70/1121720970.db2.gz VRZWAADHATUFCH-UHFFFAOYSA-N 1 1 344.411 3.595 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c(F)c1 ZINC000390707005 1129017558 /nfs/dbraw/zinc/01/75/58/1129017558.db2.gz RQSNQXTXBUBVME-INIZCTEOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000301104694 1121919985 /nfs/dbraw/zinc/91/99/85/1121919985.db2.gz VMIAJXLYRFLMSP-OLZOCXBDSA-N 1 1 329.322 3.652 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301121530 1122040870 /nfs/dbraw/zinc/04/08/70/1122040870.db2.gz QXGQXLVYXKBFRA-AWEZNQCLSA-N 1 1 331.441 3.980 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151631 1122080913 /nfs/dbraw/zinc/08/09/13/1122080913.db2.gz KHXGGXPAFCGQDC-KBPBESRZSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151631 1122080920 /nfs/dbraw/zinc/08/09/20/1122080920.db2.gz KHXGGXPAFCGQDC-KBPBESRZSA-N 1 1 339.395 3.541 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000917212512 1122557569 /nfs/dbraw/zinc/55/75/69/1122557569.db2.gz ZKIPUWJSYVTSMO-UHFFFAOYSA-N 1 1 339.439 3.658 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000130682555 1122612554 /nfs/dbraw/zinc/61/25/54/1122612554.db2.gz NMSHYWOAYPRXLA-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000130682555 1122612559 /nfs/dbraw/zinc/61/25/59/1122612559.db2.gz NMSHYWOAYPRXLA-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3CF)o2)c([N+](=O)[O-])c1 ZINC000556950615 1123230513 /nfs/dbraw/zinc/23/05/13/1123230513.db2.gz GZMKIMHQQSZLOZ-GFCCVEGCSA-N 1 1 334.347 3.797 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3CF)o2)c([N+](=O)[O-])c1 ZINC000556950615 1123230517 /nfs/dbraw/zinc/23/05/17/1123230517.db2.gz GZMKIMHQQSZLOZ-GFCCVEGCSA-N 1 1 334.347 3.797 20 5 EHBDMO C[C@@H]([N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406105 1123364570 /nfs/dbraw/zinc/36/45/70/1123364570.db2.gz JHNZYJSYRPUWBC-SNVBAGLBSA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800495 1123664189 /nfs/dbraw/zinc/66/41/89/1123664189.db2.gz JYPGPRHONUBLLT-SFHVURJKSA-N 1 1 328.437 3.927 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916174 1123691693 /nfs/dbraw/zinc/69/16/93/1123691693.db2.gz DAXPKVNPBPKQIV-INIZCTEOSA-N 1 1 344.386 3.807 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000301820949 1129140427 /nfs/dbraw/zinc/14/04/27/1129140427.db2.gz JRTZWJMBDCHHID-KOLCDFICSA-N 1 1 329.322 3.651 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000615834447 1123883971 /nfs/dbraw/zinc/88/39/71/1123883971.db2.gz VBABGCYVUULLML-BXBOZWQASA-N 1 1 326.400 3.532 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)cn1 ZINC000615838861 1123884940 /nfs/dbraw/zinc/88/49/40/1123884940.db2.gz QMNKXSYRXFXZAC-ZROIWOOFSA-N 1 1 327.384 3.534 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000615837607 1123884976 /nfs/dbraw/zinc/88/49/76/1123884976.db2.gz LAPDJOXDGHTNGX-INDWDQIESA-N 1 1 326.343 3.702 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccccc2)CC(C)(C)O)cccc1[N+](=O)[O-] ZINC000180234284 1123967074 /nfs/dbraw/zinc/96/70/74/1123967074.db2.gz RUYZYVYPFBHLJP-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO CC[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000735310733 1131334251 /nfs/dbraw/zinc/33/42/51/1131334251.db2.gz CYDXCMGEZDCJEO-LBPRGKRZSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000735310733 1131334258 /nfs/dbraw/zinc/33/42/58/1131334258.db2.gz CYDXCMGEZDCJEO-LBPRGKRZSA-N 1 1 339.823 3.699 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000619698900 1125384177 /nfs/dbraw/zinc/38/41/77/1125384177.db2.gz MZNXTKBWGGOBOL-GFCCVEGCSA-N 1 1 332.429 3.573 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@H+]1C1CC1 ZINC000301846024 1129185221 /nfs/dbraw/zinc/18/52/21/1129185221.db2.gz ALBPLEWMCWDQED-DZGCQCFKSA-N 1 1 338.411 3.694 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891195 1129289577 /nfs/dbraw/zinc/28/95/77/1129289577.db2.gz UNHCMNHRBYCPRR-PBHICJAKSA-N 1 1 346.818 3.809 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000116276248 1129348993 /nfs/dbraw/zinc/34/89/93/1129348993.db2.gz DLYLVDMAYDLYKL-MRXNPFEDSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000116276248 1129348997 /nfs/dbraw/zinc/34/89/97/1129348997.db2.gz DLYLVDMAYDLYKL-MRXNPFEDSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCCCO)C2CC2)o1 ZINC000093383154 1129586623 /nfs/dbraw/zinc/58/66/23/1129586623.db2.gz UABRDGNHXQESST-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093559009 1129594399 /nfs/dbraw/zinc/59/43/99/1129594399.db2.gz OBAUSMZEIHRUAX-SNVBAGLBSA-N 1 1 334.388 3.770 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000154921365 1129598831 /nfs/dbraw/zinc/59/88/31/1129598831.db2.gz PTZUOGNQJZOXBJ-OAHLLOKOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000154921365 1129598835 /nfs/dbraw/zinc/59/88/35/1129598835.db2.gz PTZUOGNQJZOXBJ-OAHLLOKOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)s1 ZINC000093820299 1129604900 /nfs/dbraw/zinc/60/49/00/1129604900.db2.gz VVBIOZISVNKEJQ-SFHVURJKSA-N 1 1 344.436 3.936 20 5 EHBDMO COc1cc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000390668992 1129628666 /nfs/dbraw/zinc/62/86/66/1129628666.db2.gz XNNOQZMXLADPOI-ZDUSSCGKSA-N 1 1 347.390 3.675 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330623887 1129641782 /nfs/dbraw/zinc/64/17/82/1129641782.db2.gz QIIWWNGJSKPQJN-AWEZNQCLSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330623887 1129641784 /nfs/dbraw/zinc/64/17/84/1129641784.db2.gz QIIWWNGJSKPQJN-AWEZNQCLSA-N 1 1 339.823 3.697 20 5 EHBDMO COc1ccc(C[NH2+][C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000125036849 1129655294 /nfs/dbraw/zinc/65/52/94/1129655294.db2.gz XSZVOSXGWQXCBT-HXUWFJFHSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1cccc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000302509009 1129779967 /nfs/dbraw/zinc/77/99/67/1129779967.db2.gz RSBQUCOMBQVDPW-CQSZACIVSA-N 1 1 331.441 3.848 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]3C3CCCC3)n2)c1 ZINC000055927422 1129790672 /nfs/dbraw/zinc/79/06/72/1129790672.db2.gz OVLWPJLRCGIEKS-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC[C@@H]1C ZINC001307590581 1130099456 /nfs/dbraw/zinc/09/94/56/1130099456.db2.gz WDZVJQAAZWTGDU-QWRGUYRKSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892966 1130858630 /nfs/dbraw/zinc/85/86/30/1130858630.db2.gz LTSYSDOPIUKWIP-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892966 1130858638 /nfs/dbraw/zinc/85/86/38/1130858638.db2.gz LTSYSDOPIUKWIP-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCc1ccc(Cl)cc1 ZINC000733313492 1131022342 /nfs/dbraw/zinc/02/23/42/1131022342.db2.gz UOOGGKAVNGYSME-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059334 1131462311 /nfs/dbraw/zinc/46/23/11/1131462311.db2.gz XKSQBTZGXBOLFE-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057455 1131462340 /nfs/dbraw/zinc/46/23/40/1131462340.db2.gz RJVNCKDXBOWOOH-PBHICJAKSA-N 1 1 343.431 3.711 20 5 EHBDMO COC(C)(C)[C@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916387 1131904296 /nfs/dbraw/zinc/90/42/96/1131904296.db2.gz RLUIHQJUOXOBOH-SJLPKXTDSA-N 1 1 332.444 3.732 20 5 EHBDMO CC(C)N1CC[C@@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909652 1131916817 /nfs/dbraw/zinc/91/68/17/1131916817.db2.gz UTFRZSUOMSHIGI-MOXGXCLJSA-N 1 1 345.487 3.551 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911614 1131917531 /nfs/dbraw/zinc/91/75/31/1131917531.db2.gz CZWUHGHGSLBFPT-GOSISDBHSA-N 1 1 325.412 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](c3ccncc3)C1)CC2 ZINC001172911309 1131917954 /nfs/dbraw/zinc/91/79/54/1131917954.db2.gz SECGJTKBRZQOTF-RTBURBONSA-N 1 1 337.423 3.727 20 5 EHBDMO CC[N@@H+](C(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013715 1131935149 /nfs/dbraw/zinc/93/51/49/1131935149.db2.gz CZGZQBURXPWUQO-UHFFFAOYSA-N 1 1 327.375 3.572 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226550 1132006296 /nfs/dbraw/zinc/00/62/96/1132006296.db2.gz KJSGJZPSVPNKMY-HKUYNNGSSA-N 1 1 345.487 3.866 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](CCN(C)C)Cc1ccccc1 ZINC001173226173 1132006971 /nfs/dbraw/zinc/00/69/71/1132006971.db2.gz LDXOOCLNIHAOTD-QGZVFWFLSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(CC[NH+](C)C)Cc1ccccc1 ZINC001173226173 1132006977 /nfs/dbraw/zinc/00/69/77/1132006977.db2.gz LDXOOCLNIHAOTD-QGZVFWFLSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226560 1132007129 /nfs/dbraw/zinc/00/71/29/1132007129.db2.gz KJSGJZPSVPNKMY-PKOBYXMFSA-N 1 1 345.487 3.866 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@H]1C1CCCCC1 ZINC001173231069 1132009576 /nfs/dbraw/zinc/00/95/76/1132009576.db2.gz JGKGABKPWVFJSP-KXBFYZLASA-N 1 1 332.444 3.807 20 5 EHBDMO C[C@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000746076756 1132360470 /nfs/dbraw/zinc/36/04/70/1132360470.db2.gz PNMGMYFHMMPBDV-GRYCIOLGSA-N 1 1 340.807 3.553 20 5 EHBDMO COc1ccccc1OCC[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509394497 1132487252 /nfs/dbraw/zinc/48/72/52/1132487252.db2.gz XZWVTWRHAXYBKN-CLFYSBASSA-N 1 1 342.395 3.627 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041696 1132638676 /nfs/dbraw/zinc/63/86/76/1132638676.db2.gz CBNJSOPBCHCETQ-AEFFLSMTSA-N 1 1 334.485 3.830 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1 ZINC000773667095 1133062198 /nfs/dbraw/zinc/06/21/98/1133062198.db2.gz SKLPJNSNFMZVFV-UHFFFAOYSA-N 1 1 343.814 3.975 20 5 EHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000770145697 1133393521 /nfs/dbraw/zinc/39/35/21/1133393521.db2.gz ODGUUAUEUGVFBE-GFCCVEGCSA-N 1 1 334.807 3.674 20 5 EHBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126794 1133810423 /nfs/dbraw/zinc/81/04/23/1133810423.db2.gz UHWRNXWMLPYYCO-CVAIRZPRSA-N 1 1 340.423 3.815 20 5 EHBDMO Cc1cc(N2CC[NH+](Cc3cccc(C)c3)CC2)c([N+](=O)[O-])s1 ZINC001184572288 1133959734 /nfs/dbraw/zinc/95/97/34/1133959734.db2.gz NWYFJUSYMNVNNQ-UHFFFAOYSA-N 1 1 331.441 3.595 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1CCCC[C@H]1C ZINC001184856779 1133999564 /nfs/dbraw/zinc/99/95/64/1133999564.db2.gz LQXLJTGQOXGAQO-MNOVXSKESA-N 1 1 346.353 3.683 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001185339678 1134074536 /nfs/dbraw/zinc/07/45/36/1134074536.db2.gz SQSSKCRABSEJSV-GFCCVEGCSA-N 1 1 331.338 3.900 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479729 1134130127 /nfs/dbraw/zinc/13/01/27/1134130127.db2.gz AAOQNCBNVAVBAF-WBVHZDCISA-N 1 1 349.450 3.820 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788798232 1134170458 /nfs/dbraw/zinc/17/04/58/1134170458.db2.gz OQFZCJWRNNJARE-QMMMGPOBSA-N 1 1 341.745 3.959 20 5 EHBDMO C[C@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804149 1134171025 /nfs/dbraw/zinc/17/10/25/1134171025.db2.gz VBTXNANVUQWXDV-WMLDXEAASA-N 1 1 346.475 3.625 20 5 EHBDMO C[C@H]([NH2+]C[C@H]1CCCN1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804149 1134171029 /nfs/dbraw/zinc/17/10/29/1134171029.db2.gz VBTXNANVUQWXDV-WMLDXEAASA-N 1 1 346.475 3.625 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)cc1 ZINC000775061518 1134273793 /nfs/dbraw/zinc/27/37/93/1134273793.db2.gz WQWWSMKJFDFJSZ-HNNXBMFYSA-N 1 1 341.367 3.801 20 5 EHBDMO CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000792355345 1134680774 /nfs/dbraw/zinc/68/07/74/1134680774.db2.gz RIZRZAOKKHZSNG-UONOGXRCSA-N 1 1 346.349 3.539 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329562 1134749389 /nfs/dbraw/zinc/74/93/89/1134749389.db2.gz RMAHSEWKPYDGIL-PXAZEXFGSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329562 1134749392 /nfs/dbraw/zinc/74/93/92/1134749392.db2.gz RMAHSEWKPYDGIL-PXAZEXFGSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170329559 1134749492 /nfs/dbraw/zinc/74/94/92/1134749492.db2.gz RJAHVCMLLZLVEU-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170335115 1134752389 /nfs/dbraw/zinc/75/23/89/1134752389.db2.gz KVWXKVKYILGQGQ-FPMFFAJLSA-N 1 1 340.370 3.512 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170336495 1134752657 /nfs/dbraw/zinc/75/26/57/1134752657.db2.gz XVYRRFBXXGNDET-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3cc(F)ccc3C2)c([N+](=O)[O-])c1 ZINC001170352309 1134753965 /nfs/dbraw/zinc/75/39/65/1134753965.db2.gz LTNWDSCRFBZQNA-ZDUSSCGKSA-N 1 1 344.386 3.732 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344939 1134758774 /nfs/dbraw/zinc/75/87/74/1134758774.db2.gz FSOCCLMTBDCXFX-AAEUAGOBSA-N 1 1 328.359 3.512 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345843 1134759591 /nfs/dbraw/zinc/75/95/91/1134759591.db2.gz MXANIWHQPWSNIJ-KSSFIOAISA-N 1 1 341.411 3.767 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170347631 1134759804 /nfs/dbraw/zinc/75/98/04/1134759804.db2.gz SOEYYEWWNAGYMY-OAHLLOKOSA-N 1 1 344.411 3.545 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792875691 1134809907 /nfs/dbraw/zinc/80/99/07/1134809907.db2.gz IWUUPTGSQHFHRG-LBPRGKRZSA-N 1 1 345.355 3.753 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)ccc1[N+](=O)[O-] ZINC000792907659 1134819212 /nfs/dbraw/zinc/81/92/12/1134819212.db2.gz UIKSKDGXICYNIS-KGLIPLIRSA-N 1 1 345.226 3.619 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)ccc1[N+](=O)[O-] ZINC000792907659 1134819222 /nfs/dbraw/zinc/81/92/22/1134819222.db2.gz UIKSKDGXICYNIS-KGLIPLIRSA-N 1 1 345.226 3.619 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000747207771 1135164430 /nfs/dbraw/zinc/16/44/30/1135164430.db2.gz NTSRSLJIJMDENS-ZDUSSCGKSA-N 1 1 339.411 3.667 20 5 EHBDMO C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287110 1135407241 /nfs/dbraw/zinc/40/72/41/1135407241.db2.gz APXAMQVWRIXMFT-HOCLYGCPSA-N 1 1 348.443 3.580 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC001170571898 1135788313 /nfs/dbraw/zinc/78/83/13/1135788313.db2.gz JWAJGJDYQMXHQU-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000810011198 1135913702 /nfs/dbraw/zinc/91/37/02/1135913702.db2.gz GGOFQZRIKBOYLA-OAHLLOKOSA-N 1 1 345.226 3.904 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000810011198 1135913706 /nfs/dbraw/zinc/91/37/06/1135913706.db2.gz GGOFQZRIKBOYLA-OAHLLOKOSA-N 1 1 345.226 3.904 20 5 EHBDMO CCOC1CC([N@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000810019056 1135914851 /nfs/dbraw/zinc/91/48/51/1135914851.db2.gz XITIKWNKPBASBZ-UHFFFAOYSA-N 1 1 333.215 3.901 20 5 EHBDMO CCOC1CC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000810019056 1135914852 /nfs/dbraw/zinc/91/48/52/1135914852.db2.gz XITIKWNKPBASBZ-UHFFFAOYSA-N 1 1 333.215 3.901 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851552 1136261341 /nfs/dbraw/zinc/26/13/41/1136261341.db2.gz SMMDYKIBYGWRCN-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO C[C@@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000813174476 1136298191 /nfs/dbraw/zinc/29/81/91/1136298191.db2.gz UIUIFUSVDCQGLD-KDOFPFPSSA-N 1 1 346.427 3.539 20 5 EHBDMO C[C@@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000813174476 1136298193 /nfs/dbraw/zinc/29/81/93/1136298193.db2.gz UIUIFUSVDCQGLD-KDOFPFPSSA-N 1 1 346.427 3.539 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccsc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000852310940 1136447228 /nfs/dbraw/zinc/44/72/28/1136447228.db2.gz BNWJBOBNIGQLQI-MRXNPFEDSA-N 1 1 334.441 3.990 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587822 1136447249 /nfs/dbraw/zinc/44/72/49/1136447249.db2.gz OVMJBAXDFKHCDC-IFXJQAMLSA-N 1 1 326.396 3.854 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+](Cc2ccccc2F)CC2CC2)c1 ZINC000852563281 1136466607 /nfs/dbraw/zinc/46/66/07/1136466607.db2.gz BEEPYDBKLBOSJR-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040796 1136934404 /nfs/dbraw/zinc/93/44/04/1136934404.db2.gz QGEJQCXSUFLQPN-NVXWUHKLSA-N 1 1 341.411 3.821 20 5 EHBDMO CC[N@H+](c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000819398572 1136935960 /nfs/dbraw/zinc/93/59/60/1136935960.db2.gz OGANWGQVKRCZPG-IBGZPJMESA-N 1 1 343.427 3.975 20 5 EHBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738641 1137075875 /nfs/dbraw/zinc/07/58/75/1137075875.db2.gz CGGKGMVJLWTJDV-HOCLYGCPSA-N 1 1 340.379 3.532 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339025018 1137099003 /nfs/dbraw/zinc/09/90/03/1137099003.db2.gz YZSJCXOPLOYQKO-LBPRGKRZSA-N 1 1 334.363 3.941 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483470 1137146654 /nfs/dbraw/zinc/14/66/54/1137146654.db2.gz UPRYHHFOWAQTDM-QKWWCAPFSA-N 1 1 338.407 3.592 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1 ZINC000824696056 1137148708 /nfs/dbraw/zinc/14/87/08/1137148708.db2.gz GWWMZPCYPOIPOE-OIISXLGYSA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000825214889 1137169024 /nfs/dbraw/zinc/16/90/24/1137169024.db2.gz ABTKUSHICKWATE-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000844255942 1137208232 /nfs/dbraw/zinc/20/82/32/1137208232.db2.gz RESOZOCLSASLNR-AWEZNQCLSA-N 1 1 339.395 3.543 20 5 EHBDMO Cc1c(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC000888569325 1137540494 /nfs/dbraw/zinc/54/04/94/1137540494.db2.gz KPCKSPOHQDHMNE-UHFFFAOYSA-N 1 1 340.383 3.541 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023197 1137565384 /nfs/dbraw/zinc/56/53/84/1137565384.db2.gz CZRCRVJCVPEKQF-UONOGXRCSA-N 1 1 337.489 3.699 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CO)c1ccccc1 ZINC000872036074 1137566834 /nfs/dbraw/zinc/56/68/34/1137566834.db2.gz RTEHIFNLJKUHJX-MLGOLLRUSA-N 1 1 332.425 3.701 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(N(C)C)n1 ZINC000872050545 1137567987 /nfs/dbraw/zinc/56/79/87/1137567987.db2.gz BTTCBVGHKOMABU-LBPRGKRZSA-N 1 1 346.456 3.629 20 5 EHBDMO C[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086664 1137570660 /nfs/dbraw/zinc/57/06/60/1137570660.db2.gz BNHWWAMYWLCMDV-HIFRSBDPSA-N 1 1 335.423 3.507 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872262104 1137576813 /nfs/dbraw/zinc/57/68/13/1137576813.db2.gz PNIOXVMNJKSEOZ-MRXNPFEDSA-N 1 1 334.416 3.527 20 5 EHBDMO Cc1c(C[NH2+]Cc2cccc(OC(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000873099164 1137590182 /nfs/dbraw/zinc/59/01/82/1137590182.db2.gz DWKMQBCEYZWZQN-UHFFFAOYSA-N 1 1 329.400 3.765 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000877541896 1137680425 /nfs/dbraw/zinc/68/04/25/1137680425.db2.gz JGURWMNOPAXJTD-AWEZNQCLSA-N 1 1 334.807 3.509 20 5 EHBDMO CC(C)CC[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877976069 1137697904 /nfs/dbraw/zinc/69/79/04/1137697904.db2.gz SBEXAOLHXSBEKY-UHFFFAOYSA-N 1 1 338.795 3.776 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020299 1137699788 /nfs/dbraw/zinc/69/97/88/1137699788.db2.gz NDCPKSFNIAWJOI-CYBMUJFWSA-N 1 1 330.388 3.655 20 5 EHBDMO CCC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000878843943 1137729810 /nfs/dbraw/zinc/72/98/10/1137729810.db2.gz NJGJERVIKKBUKV-UHFFFAOYSA-N 1 1 338.795 3.919 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000880075642 1137767418 /nfs/dbraw/zinc/76/74/18/1137767418.db2.gz DSIIPYNTHOUHII-LBPRGKRZSA-N 1 1 332.404 3.759 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034163 1137929392 /nfs/dbraw/zinc/92/93/92/1137929392.db2.gz ZVOFYHWMPOOBNR-WTWWFLFCSA-N 1 1 332.444 3.917 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCOC1 ZINC000119740462 1137944225 /nfs/dbraw/zinc/94/42/25/1137944225.db2.gz RSLBQMHZIVOLNM-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCOC1 ZINC000119753468 1137944329 /nfs/dbraw/zinc/94/43/29/1137944329.db2.gz GFEYTGFMVBCBDA-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1C(F)(F)F ZINC000886111937 1138048099 /nfs/dbraw/zinc/04/80/99/1138048099.db2.gz LOFDKUYCMISJGG-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@H]1CCc2cccnc21 ZINC000886651859 1138107538 /nfs/dbraw/zinc/10/75/38/1138107538.db2.gz UCOMFDCGJVPEAA-ZDUSSCGKSA-N 1 1 348.200 3.529 20 5 EHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091097771 1138216056 /nfs/dbraw/zinc/21/60/56/1138216056.db2.gz JIJYNMQIDYHUPF-AWEZNQCLSA-N 1 1 335.429 3.823 20 5 EHBDMO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000091413231 1138219329 /nfs/dbraw/zinc/21/93/29/1138219329.db2.gz SUQSJWCHIWQBAE-GTNSWQLSSA-N 1 1 336.338 3.911 20 5 EHBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336980789 1138440964 /nfs/dbraw/zinc/44/09/64/1138440964.db2.gz FEGGKQSZIGRLIE-CYBMUJFWSA-N 1 1 345.374 3.756 20 5 EHBDMO CC[C@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000174499449 1139424545 /nfs/dbraw/zinc/42/45/45/1139424545.db2.gz BHLFNSKVIWVUFG-INIZCTEOSA-N 1 1 335.429 3.783 20 5 EHBDMO CCCC(=O)NC[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736942 1139989248 /nfs/dbraw/zinc/98/92/48/1139989248.db2.gz ZFPVKUUNPBDOFW-HOTGVXAUSA-N 1 1 347.459 3.593 20 5 EHBDMO Cc1c(CN[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722980 1140166216 /nfs/dbraw/zinc/16/62/16/1140166216.db2.gz DVMCVPBQPOBQTI-RDJZCZTQSA-N 1 1 331.460 3.646 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000271225745 1141328899 /nfs/dbraw/zinc/32/88/99/1141328899.db2.gz AMLZDCNJGAVITK-NVXWUHKLSA-N 1 1 330.384 3.584 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)Cc1cc(C)[nH]n1 ZINC000271482969 1141378262 /nfs/dbraw/zinc/37/82/62/1141378262.db2.gz JFHSMLHENLXTFT-OCCSQVGLSA-N 1 1 348.472 3.718 20 5 EHBDMO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271653303 1141413937 /nfs/dbraw/zinc/41/39/37/1141413937.db2.gz VSGIGBZFIWJUKT-KBPBESRZSA-N 1 1 327.384 3.581 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000274278573 1141492687 /nfs/dbraw/zinc/49/26/87/1141492687.db2.gz COSWJHORBPCIKW-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@@H](CO)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CCC1 ZINC000339144510 1141509606 /nfs/dbraw/zinc/50/96/06/1141509606.db2.gz HFIFWBONYLYJSG-NSHDSACASA-N 1 1 346.349 3.597 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1ccccc1 ZINC000348666658 1141564005 /nfs/dbraw/zinc/56/40/05/1141564005.db2.gz BNRHRCHISGURJL-UHFFFAOYSA-N 1 1 336.395 3.659 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218739 1015074168 /nfs/dbraw/zinc/07/41/68/1015074168.db2.gz KXHVCLKCXYLBML-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223788 1015099404 /nfs/dbraw/zinc/09/94/04/1015099404.db2.gz VTTHHIFAUUVUNQ-CQSZACIVSA-N 1 1 342.395 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000127056348 1015209894 /nfs/dbraw/zinc/20/98/94/1015209894.db2.gz YYBMOSIRVNHLHH-UHFFFAOYSA-N 1 1 340.379 3.531 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536707462 1032182838 /nfs/dbraw/zinc/18/28/38/1032182838.db2.gz FLDPWDBXKLWBGS-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536707462 1032182846 /nfs/dbraw/zinc/18/28/46/1032182846.db2.gz FLDPWDBXKLWBGS-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COCc1cnc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449503986 1032686206 /nfs/dbraw/zinc/68/62/06/1032686206.db2.gz VIEHCKSZGVMYFI-AWEZNQCLSA-N 1 1 347.440 3.577 20 5 EHBDMO COCc1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449503986 1032686219 /nfs/dbraw/zinc/68/62/19/1032686219.db2.gz VIEHCKSZGVMYFI-AWEZNQCLSA-N 1 1 347.440 3.577 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cccn1C ZINC000177638709 1017924054 /nfs/dbraw/zinc/92/40/54/1017924054.db2.gz IGZMJVOWAPWTFH-KRWDZBQOSA-N 1 1 329.400 3.669 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccn1C ZINC000177638709 1017924066 /nfs/dbraw/zinc/92/40/66/1017924066.db2.gz IGZMJVOWAPWTFH-KRWDZBQOSA-N 1 1 329.400 3.669 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066796074 1018174736 /nfs/dbraw/zinc/17/47/36/1018174736.db2.gz FTCDEIKYYZJRFQ-KRWDZBQOSA-N 1 1 328.416 3.635 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368002 1018535898 /nfs/dbraw/zinc/53/58/98/1018535898.db2.gz AQKGNPWQJAHLQC-HIFRSBDPSA-N 1 1 326.400 3.634 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000560814815 1018589102 /nfs/dbraw/zinc/58/91/02/1018589102.db2.gz CCWXVMTVKTZRDL-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000182317381 1018968338 /nfs/dbraw/zinc/96/83/38/1018968338.db2.gz KTDCVQSZJOVAEQ-ZDUSSCGKSA-N 1 1 338.367 3.804 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433425 1019090901 /nfs/dbraw/zinc/09/09/01/1019090901.db2.gz JJJRSIYDRNRWIZ-AEFFLSMTSA-N 1 1 339.439 3.862 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556404 1032821263 /nfs/dbraw/zinc/82/12/63/1032821263.db2.gz NVGITNDEMYXRMG-GDBMZVCRSA-N 1 1 343.402 3.914 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](Oc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001225505381 1019454091 /nfs/dbraw/zinc/45/40/91/1019454091.db2.gz KSYIMZUPVAVYDS-LBPRGKRZSA-N 1 1 343.221 3.609 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](C)O ZINC000513668450 1019919648 /nfs/dbraw/zinc/91/96/48/1019919648.db2.gz YUJNXLDWFCVOPX-ZDUSSCGKSA-N 1 1 334.441 3.915 20 5 EHBDMO Cc1ncc([C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000602439161 1032890070 /nfs/dbraw/zinc/89/00/70/1032890070.db2.gz IGXXBXGPQQPUGD-AWEZNQCLSA-N 1 1 328.416 3.973 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610476501 1020415146 /nfs/dbraw/zinc/41/51/46/1020415146.db2.gz WIKVCDAYICLDAS-UAGQMJEPSA-N 1 1 336.407 3.759 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000177954065 1020586238 /nfs/dbraw/zinc/58/62/38/1020586238.db2.gz KIWLGJJSRYGTLZ-LLVKDONJSA-N 1 1 328.397 3.897 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CC3CC3)CC3CCC3)o2)cc1 ZINC000280750141 1020633214 /nfs/dbraw/zinc/63/32/14/1020633214.db2.gz NGNUEOZCBPDBSD-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(C)CC1CC[NH+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000760397356 1032930387 /nfs/dbraw/zinc/93/03/87/1032930387.db2.gz AZYKGZPROLMHRZ-UHFFFAOYSA-N 1 1 343.431 3.569 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261149 1021286535 /nfs/dbraw/zinc/28/65/35/1021286535.db2.gz QKVDIVRMHFPURT-LJQANCHMSA-N 1 1 328.412 3.758 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000120885719 1021480959 /nfs/dbraw/zinc/48/09/59/1021480959.db2.gz WWPJEWGVDOSQGA-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000519675035 1021602255 /nfs/dbraw/zinc/60/22/55/1021602255.db2.gz YYKITUYSZRJLDA-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510460227 1021668059 /nfs/dbraw/zinc/66/80/59/1021668059.db2.gz WIEMZZUXFZYIKD-NRXRCSFJSA-N 1 1 343.471 3.945 20 5 EHBDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519847229 1021723887 /nfs/dbraw/zinc/72/38/87/1021723887.db2.gz KMIYZZZEVSHFLP-INIZCTEOSA-N 1 1 332.400 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)cc1C(F)(F)F ZINC000319812613 1021885703 /nfs/dbraw/zinc/88/57/03/1021885703.db2.gz PLIOLKAPZLNPNY-JTQLQIEISA-N 1 1 329.322 3.510 20 5 EHBDMO CC[NH+]1CCC(CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000326384949 1022084815 /nfs/dbraw/zinc/08/48/15/1022084815.db2.gz ZKCLHAKMNFKWMG-UHFFFAOYSA-N 1 1 328.416 3.595 20 5 EHBDMO COc1c(O)ccc(C[N@H+](Cc2cccs2)C(C)C)c1[N+](=O)[O-] ZINC000891627132 1022151023 /nfs/dbraw/zinc/15/10/23/1022151023.db2.gz SQVBSKAUNGEQQI-UHFFFAOYSA-N 1 1 336.413 3.781 20 5 EHBDMO COc1c(O)ccc(C[N@@H+](Cc2cccs2)C(C)C)c1[N+](=O)[O-] ZINC000891627132 1022151029 /nfs/dbraw/zinc/15/10/29/1022151029.db2.gz SQVBSKAUNGEQQI-UHFFFAOYSA-N 1 1 336.413 3.781 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[C@@H]1CCCC[N@H+]1C ZINC000441346944 1022183063 /nfs/dbraw/zinc/18/30/63/1022183063.db2.gz BRNRPOWJYGURFH-KRWDZBQOSA-N 1 1 349.475 3.688 20 5 EHBDMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989789 1022591082 /nfs/dbraw/zinc/59/10/82/1022591082.db2.gz UPMAWLYMMKCBOQ-GXTWGEPZSA-N 1 1 332.425 3.526 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000510782230 1023156476 /nfs/dbraw/zinc/15/64/76/1023156476.db2.gz VOQJWOJJYDINSC-ZDUSSCGKSA-N 1 1 340.370 3.678 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000510782230 1023156485 /nfs/dbraw/zinc/15/64/85/1023156485.db2.gz VOQJWOJJYDINSC-ZDUSSCGKSA-N 1 1 340.370 3.678 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[C@@H]1C ZINC000510793489 1023169732 /nfs/dbraw/zinc/16/97/32/1023169732.db2.gz YKZXDIKRJRZSLY-ZBEGNZNMSA-N 1 1 328.359 3.510 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[C@@H]1C ZINC000510793489 1023169739 /nfs/dbraw/zinc/16/97/39/1023169739.db2.gz YKZXDIKRJRZSLY-ZBEGNZNMSA-N 1 1 328.359 3.510 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000131 1023211997 /nfs/dbraw/zinc/21/19/97/1023211997.db2.gz WDUWNJURNCTRCJ-NMLACTOBSA-N 1 1 346.471 3.789 20 5 EHBDMO C[C@H](CNc1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000341743221 1023238582 /nfs/dbraw/zinc/23/85/82/1023238582.db2.gz OOZPTKLROAZQMZ-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@H](CNc1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000341743221 1023238593 /nfs/dbraw/zinc/23/85/93/1023238593.db2.gz OOZPTKLROAZQMZ-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000610720141 1023352017 /nfs/dbraw/zinc/35/20/17/1023352017.db2.gz WWGQFDNZVLIQDW-IBGZPJMESA-N 1 1 338.407 3.875 20 5 EHBDMO CCOc1cc(C[NH2+]C(C)(C)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000276980944 1023555190 /nfs/dbraw/zinc/55/51/90/1023555190.db2.gz YHCMFLWCMRBHCM-UHFFFAOYSA-N 1 1 335.429 3.783 20 5 EHBDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895227699 1024013242 /nfs/dbraw/zinc/01/32/42/1024013242.db2.gz QDLSIPHFEBAKQU-CQSZACIVSA-N 1 1 348.786 3.870 20 5 EHBDMO C[C@H](CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000475021391 1024023278 /nfs/dbraw/zinc/02/32/78/1024023278.db2.gz BSSARDGNFJLFJH-MRXNPFEDSA-N 1 1 340.423 3.948 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000141505673 1024104834 /nfs/dbraw/zinc/10/48/34/1024104834.db2.gz AKCUIXDACWJACH-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574770776 1024292778 /nfs/dbraw/zinc/29/27/78/1024292778.db2.gz MFGROXVITNKHMT-INIZCTEOSA-N 1 1 327.384 3.556 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H](C)CO ZINC000430098101 1024362060 /nfs/dbraw/zinc/36/20/60/1024362060.db2.gz RWQOWPAJMNUDKQ-LLVKDONJSA-N 1 1 338.791 3.711 20 5 EHBDMO CCOc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000380731440 1024461285 /nfs/dbraw/zinc/46/12/85/1024461285.db2.gz INBDJGVYWVZIIW-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000248568824 1024560073 /nfs/dbraw/zinc/56/00/73/1024560073.db2.gz CFDGOWWVLFTIAE-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000248568824 1024560081 /nfs/dbraw/zinc/56/00/81/1024560081.db2.gz CFDGOWWVLFTIAE-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614187 1024658889 /nfs/dbraw/zinc/65/88/89/1024658889.db2.gz QORSMNVXIGWMGJ-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614187 1024658895 /nfs/dbraw/zinc/65/88/95/1024658895.db2.gz QORSMNVXIGWMGJ-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000025358675 1024703731 /nfs/dbraw/zinc/70/37/31/1024703731.db2.gz AJSALENWOUKFEH-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cncs1 ZINC000897931391 1033230810 /nfs/dbraw/zinc/23/08/10/1033230810.db2.gz YMTMTVQRQAXNPL-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000520785198 1024792030 /nfs/dbraw/zinc/79/20/30/1024792030.db2.gz BJMXUPVBGVEIJB-QGZVFWFLSA-N 1 1 344.386 3.820 20 5 EHBDMO Cc1c(C[NH+]2CCC(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051379371 1025034593 /nfs/dbraw/zinc/03/45/93/1025034593.db2.gz IAWNWYCVGZGEOW-UHFFFAOYSA-N 1 1 338.407 3.998 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000895987846 1025044226 /nfs/dbraw/zinc/04/42/26/1025044226.db2.gz JFOFSSQZMPUSGX-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036466 1025183435 /nfs/dbraw/zinc/18/34/35/1025183435.db2.gz KXFXPUSGZAADQS-QAPCUYQASA-N 1 1 328.416 3.573 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)o1 ZINC000551826586 1025476208 /nfs/dbraw/zinc/47/62/08/1025476208.db2.gz NTAARYCJMYRPON-HKUYNNGSSA-N 1 1 342.395 3.998 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896180 1025649939 /nfs/dbraw/zinc/64/99/39/1025649939.db2.gz BEHOEPNUEIXAFU-MRXNPFEDSA-N 1 1 340.427 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@H](C4CCOCC4)C3)c2c1 ZINC000896590885 1025691202 /nfs/dbraw/zinc/69/12/02/1025691202.db2.gz FICGHAKWEAVLKH-HNNXBMFYSA-N 1 1 341.411 3.786 20 5 EHBDMO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000521847964 1025718316 /nfs/dbraw/zinc/71/83/16/1025718316.db2.gz CHPUTPHEIWYELX-HOCLYGCPSA-N 1 1 340.427 3.514 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1SC ZINC000511096149 1025726296 /nfs/dbraw/zinc/72/62/96/1025726296.db2.gz NQXGWHYCBHJHRS-UHFFFAOYSA-N 1 1 346.452 4.000 20 5 EHBDMO Cc1[nH+]c2cc(Nc3nc4ccccc4cc3[N+](=O)[O-])ccc2n1C ZINC000530437112 1025836825 /nfs/dbraw/zinc/83/68/25/1025836825.db2.gz QYQPZFBXPUCKMX-UHFFFAOYSA-N 1 1 333.351 3.504 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@H]2CCSC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000530524380 1025981344 /nfs/dbraw/zinc/98/13/44/1025981344.db2.gz FKTNPMLQNMRWRB-GUYCJALGSA-N 1 1 332.425 3.935 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000475140877 1026235326 /nfs/dbraw/zinc/23/53/26/1026235326.db2.gz UASADMPOSBIHFW-SFHVURJKSA-N 1 1 328.412 3.593 20 5 EHBDMO COCC[C@@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124145 1026257666 /nfs/dbraw/zinc/25/76/66/1026257666.db2.gz KPOXRQNHZLVJDH-SFHVURJKSA-N 1 1 328.412 3.847 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000523005623 1026276264 /nfs/dbraw/zinc/27/62/64/1026276264.db2.gz DNRGMWFHSYSYMC-MRXNPFEDSA-N 1 1 344.386 3.677 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCCC[C@H]1C ZINC000530855959 1026354836 /nfs/dbraw/zinc/35/48/36/1026354836.db2.gz XNTOVWNKPHESMM-KGLIPLIRSA-N 1 1 328.416 3.818 20 5 EHBDMO COc1cccc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354944 1026509462 /nfs/dbraw/zinc/50/94/62/1026509462.db2.gz SYEYGSMTLNSUBY-GDBMZVCRSA-N 1 1 341.411 3.851 20 5 EHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)C2)cc1OC ZINC001167602806 1027009326 /nfs/dbraw/zinc/00/93/26/1027009326.db2.gz QFMDWKXLGQLWAC-KBPBESRZSA-N 1 1 336.432 3.870 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])nc2)[C@@H]1c1cccs1 ZINC000078338383 1027686939 /nfs/dbraw/zinc/68/69/39/1027686939.db2.gz GYEKCLVOWOOUOJ-BLLLJJGKSA-N 1 1 332.429 3.546 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)c1 ZINC000347330983 1027709934 /nfs/dbraw/zinc/70/99/34/1027709934.db2.gz HXZWHAHNRKNKHR-CVEARBPZSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)c1 ZINC000347330983 1027709952 /nfs/dbraw/zinc/70/99/52/1027709952.db2.gz HXZWHAHNRKNKHR-CVEARBPZSA-N 1 1 344.436 3.596 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435388 1027874575 /nfs/dbraw/zinc/87/45/75/1027874575.db2.gz WJKGYXCQRINMJF-CABCVRRESA-N 1 1 333.432 3.742 20 5 EHBDMO [NH3+][C@H]1C[C@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036615 1028144358 /nfs/dbraw/zinc/14/43/58/1028144358.db2.gz ATJNWJJHZIOVDD-HOTGVXAUSA-N 1 1 331.803 3.525 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]23CCOC3)s1 ZINC000421393516 1028369834 /nfs/dbraw/zinc/36/98/34/1028369834.db2.gz DZJXNUKYUKJEPB-KRWDZBQOSA-N 1 1 330.409 3.688 20 5 EHBDMO COc1cccc2cc(C[NH2+]Cc3cc([N+](=O)[O-])ccc3OC)oc21 ZINC000729681601 1028411942 /nfs/dbraw/zinc/41/19/42/1028411942.db2.gz FFDLBMYZCOXVTP-UHFFFAOYSA-N 1 1 342.351 3.648 20 5 EHBDMO C[C@H](N[C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398887 1028412021 /nfs/dbraw/zinc/41/20/21/1028412021.db2.gz PDHVOOPINYJCKS-KCQAQPDRSA-N 1 1 345.468 3.972 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739812 1029048473 /nfs/dbraw/zinc/04/84/73/1029048473.db2.gz JHNRTGOLNAWXPN-NEPJUHHUSA-N 1 1 336.823 3.606 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532918391 1029070382 /nfs/dbraw/zinc/07/03/82/1029070382.db2.gz TVWJNQJALFDRQG-XCRHUMRWSA-N 1 1 345.443 3.742 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000504926268 1029072051 /nfs/dbraw/zinc/07/20/51/1029072051.db2.gz HEYVYOIKRBTDGY-OWCLPIDISA-N 1 1 349.500 3.682 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000504926268 1029072068 /nfs/dbraw/zinc/07/20/68/1029072068.db2.gz HEYVYOIKRBTDGY-OWCLPIDISA-N 1 1 349.500 3.682 20 5 EHBDMO O=[N+]([O-])c1ccc(CCN2CCC[N@@H+](CC3CCCCC3)CC2)cc1 ZINC000524425147 1029156957 /nfs/dbraw/zinc/15/69/57/1029156957.db2.gz TVTMUGJVMRSZML-UHFFFAOYSA-N 1 1 345.487 3.725 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445850966 1029185929 /nfs/dbraw/zinc/18/59/29/1029185929.db2.gz XQDMPDSNEJVYQN-HNNXBMFYSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC(C)(C)C1 ZINC000446079147 1029393026 /nfs/dbraw/zinc/39/30/26/1029393026.db2.gz OHQYYDXGGKKTEV-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO CCOc1cc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536022777 1029820283 /nfs/dbraw/zinc/82/02/83/1029820283.db2.gz JLYMZWOPOWYNAF-MRXNPFEDSA-N 1 1 327.384 3.592 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000441173636 1029866878 /nfs/dbraw/zinc/86/68/78/1029866878.db2.gz CNLLEDBNAKUUBN-RXQFDZFGSA-N 1 1 340.427 3.749 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2ccccc2F)c([N+](=O)[O-])c1 ZINC000441234416 1030087388 /nfs/dbraw/zinc/08/73/88/1030087388.db2.gz NTPIAGPVRRGXNB-ZDUSSCGKSA-N 1 1 348.374 3.814 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2CC[C@@H](C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453405606 1030214737 /nfs/dbraw/zinc/21/47/37/1030214737.db2.gz JLWGSEAGZBVLNA-XVGQJIODSA-N 1 1 344.411 3.997 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000429719381 1030373879 /nfs/dbraw/zinc/37/38/79/1030373879.db2.gz KQUYFUPJZCUQAV-KRWDZBQOSA-N 1 1 328.368 3.646 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000429719381 1030373895 /nfs/dbraw/zinc/37/38/95/1030373895.db2.gz KQUYFUPJZCUQAV-KRWDZBQOSA-N 1 1 328.368 3.646 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128667729 1030400314 /nfs/dbraw/zinc/40/03/14/1030400314.db2.gz UQXHYZLPGKUNHX-INIZCTEOSA-N 1 1 337.395 3.573 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ncccc2F)CC1 ZINC000278378091 1030486454 /nfs/dbraw/zinc/48/64/54/1030486454.db2.gz UCQRYCFTWNQFDF-ZDUSSCGKSA-N 1 1 345.374 3.733 20 5 EHBDMO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000482533358 1030512676 /nfs/dbraw/zinc/51/26/76/1030512676.db2.gz OVFXXUVDEYOHTR-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)COCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000482533358 1030512687 /nfs/dbraw/zinc/51/26/87/1030512687.db2.gz OVFXXUVDEYOHTR-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccc1)C[C@@H](C)O ZINC000527304337 1030768495 /nfs/dbraw/zinc/76/84/95/1030768495.db2.gz AQYOAMXUWBKYFF-ZFOVBUMHSA-N 1 1 340.423 3.881 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361711 1030983524 /nfs/dbraw/zinc/98/35/24/1030983524.db2.gz YCOTULQTZAPZBW-GDBMZVCRSA-N 1 1 344.411 3.980 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251362 1031064701 /nfs/dbraw/zinc/06/47/01/1031064701.db2.gz CZBJTNZDQRDWAD-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1ccc(-c2noc([C@@H]3CC[N@@H+]3C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000923819914 1031264402 /nfs/dbraw/zinc/26/44/02/1031264402.db2.gz GTDLPLMMULIAST-AWEZNQCLSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1ccc(-c2noc([C@@H]3CC[N@H+]3C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000923819914 1031264413 /nfs/dbraw/zinc/26/44/13/1031264413.db2.gz GTDLPLMMULIAST-AWEZNQCLSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000536183626 1031352053 /nfs/dbraw/zinc/35/20/53/1031352053.db2.gz SQSBDIFZYDRUFS-ZBFHGGJFSA-N 1 1 326.400 3.546 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000536183624 1031352150 /nfs/dbraw/zinc/35/21/50/1031352150.db2.gz SQSBDIFZYDRUFS-GOEBONIOSA-N 1 1 326.400 3.546 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cccc(F)c1 ZINC000026223904 1031385823 /nfs/dbraw/zinc/38/58/23/1031385823.db2.gz HGDFNQZXLJLJQS-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)o2)c1 ZINC000551586964 1031475121 /nfs/dbraw/zinc/47/51/21/1031475121.db2.gz SOZGVPJBAWIZNS-PKOBYXMFSA-N 1 1 342.395 3.998 20 5 EHBDMO CC(C)(C)OC(=O)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000343601580 1031594072 /nfs/dbraw/zinc/59/40/72/1031594072.db2.gz GZDWDZWKUIHESX-UHFFFAOYSA-N 1 1 334.416 3.681 20 5 EHBDMO CC(=O)c1ccc(NCCCC[N@@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000076795344 1033332313 /nfs/dbraw/zinc/33/23/13/1033332313.db2.gz FNCRYHGHMMUQMJ-CQSZACIVSA-N 1 1 333.432 3.864 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(OC)ccc2F)cc1[N+](=O)[O-] ZINC000598680019 1033379830 /nfs/dbraw/zinc/37/98/30/1033379830.db2.gz QMWMZBJCEDBJQV-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011623 1033606046 /nfs/dbraw/zinc/60/60/46/1033606046.db2.gz CKLHOEWQXWUBDC-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073935 1033716458 /nfs/dbraw/zinc/71/64/58/1033716458.db2.gz NDPCZMGQGRPLNZ-RHSMWYFYSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073935 1033716471 /nfs/dbraw/zinc/71/64/71/1033716471.db2.gz NDPCZMGQGRPLNZ-RHSMWYFYSA-N 1 1 347.459 3.661 20 5 EHBDMO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289706 1033729244 /nfs/dbraw/zinc/72/92/44/1033729244.db2.gz QFYYIEQTFHTUQU-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289706 1033729255 /nfs/dbraw/zinc/72/92/55/1033729255.db2.gz QFYYIEQTFHTUQU-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595289830 1033730161 /nfs/dbraw/zinc/73/01/61/1033730161.db2.gz UUYBICORKVKLOI-HNNXBMFYSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595289830 1033730175 /nfs/dbraw/zinc/73/01/75/1033730175.db2.gz UUYBICORKVKLOI-HNNXBMFYSA-N 1 1 331.372 3.627 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)ccc2cnccc21 ZINC000599097335 1033732212 /nfs/dbraw/zinc/73/22/12/1033732212.db2.gz BTIBFRCCZYXRKE-WBVHZDCISA-N 1 1 326.400 3.572 20 5 EHBDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000595409483 1033788469 /nfs/dbraw/zinc/78/84/69/1033788469.db2.gz RAKLNOPLPGEJAM-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1ccc(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)cn1 ZINC000595427971 1033798760 /nfs/dbraw/zinc/79/87/60/1033798760.db2.gz VNDKZVSLPWLYAE-UHFFFAOYSA-N 1 1 329.375 3.817 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595436473 1033803248 /nfs/dbraw/zinc/80/32/48/1033803248.db2.gz CPYSRLBXTKLQJA-CYBMUJFWSA-N 1 1 349.431 3.674 20 5 EHBDMO Cc1noc(C[N@@H+](CC(C)C)[C@@H]2CCCc3cccnc32)c1[N+](=O)[O-] ZINC000595442587 1033806129 /nfs/dbraw/zinc/80/61/29/1033806129.db2.gz VACCFDBHSNKQLD-OAHLLOKOSA-N 1 1 344.415 3.822 20 5 EHBDMO Cc1noc(C[N@H+](CC(C)C)[C@@H]2CCCc3cccnc32)c1[N+](=O)[O-] ZINC000595442587 1033806136 /nfs/dbraw/zinc/80/61/36/1033806136.db2.gz VACCFDBHSNKQLD-OAHLLOKOSA-N 1 1 344.415 3.822 20 5 EHBDMO COc1ccccc1[C@@H]1CC[C@H](C)C[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489417 1033812642 /nfs/dbraw/zinc/81/26/42/1033812642.db2.gz AOOSWTLCHFVISH-WFASDCNBSA-N 1 1 345.399 3.873 20 5 EHBDMO COc1ccccc1[C@@H]1CC[C@H](C)C[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489417 1033812663 /nfs/dbraw/zinc/81/26/63/1033812663.db2.gz AOOSWTLCHFVISH-WFASDCNBSA-N 1 1 345.399 3.873 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000595467666 1033821059 /nfs/dbraw/zinc/82/10/59/1033821059.db2.gz SPTZADJTEBLXAR-NUJGCVRESA-N 1 1 336.407 3.640 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520808 1033837919 /nfs/dbraw/zinc/83/79/19/1033837919.db2.gz FEWPTOIXMKXSEP-INIZCTEOSA-N 1 1 348.406 3.918 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CC2)CC1 ZINC000599672176 1034080950 /nfs/dbraw/zinc/08/09/50/1034080950.db2.gz BXCKGCQLPWALNM-ZDUSSCGKSA-N 1 1 342.399 3.972 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059436 1034086657 /nfs/dbraw/zinc/08/66/57/1034086657.db2.gz OEXFUMALCSBQDM-GOEBONIOSA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059436 1034086665 /nfs/dbraw/zinc/08/66/65/1034086665.db2.gz OEXFUMALCSBQDM-GOEBONIOSA-N 1 1 346.818 3.809 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692815 1034097662 /nfs/dbraw/zinc/09/76/62/1034097662.db2.gz XXSUTATXMWCVRX-SFAKSCPVSA-N 1 1 332.400 3.640 20 5 EHBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000604016214 1034142534 /nfs/dbraw/zinc/14/25/34/1034142534.db2.gz MWUYCXXCPORTOY-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000604016214 1034142545 /nfs/dbraw/zinc/14/25/45/1034142545.db2.gz MWUYCXXCPORTOY-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000604016186 1034143093 /nfs/dbraw/zinc/14/30/93/1034143093.db2.gz JDIZSWCSXOPZMA-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000604016186 1034143100 /nfs/dbraw/zinc/14/31/00/1034143100.db2.gz JDIZSWCSXOPZMA-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596570436 1034293743 /nfs/dbraw/zinc/29/37/43/1034293743.db2.gz KZESNYDUKJOFJP-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])nc2)[C@@H]1c1ccc(Cl)cc1 ZINC000450413162 1034299148 /nfs/dbraw/zinc/29/91/48/1034299148.db2.gz SNTUGSTUYGHHCY-HOCLYGCPSA-N 1 1 332.791 3.501 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C(C)C)C1CCCC1 ZINC000411367625 1034869289 /nfs/dbraw/zinc/86/92/89/1034869289.db2.gz SHIAIQMAMSBRCU-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO CCOc1cc(Cn2c[nH+]c3c2C[C@@H](C)[C@@H](C)C3)ccc1[N+](=O)[O-] ZINC000450997159 1035008302 /nfs/dbraw/zinc/00/83/02/1035008302.db2.gz HZGSGKQWHQYXGR-QWHCGFSZSA-N 1 1 329.400 3.609 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(F)cc1F ZINC000340898988 1035018092 /nfs/dbraw/zinc/01/80/92/1035018092.db2.gz LAAPDNVBAUHTPQ-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO COc1cncc(/C=C/CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000563061170 1035025337 /nfs/dbraw/zinc/02/53/37/1035025337.db2.gz ZKCWNQNTTDOJJZ-FNORWQNLSA-N 1 1 327.384 3.534 20 5 EHBDMO COc1cc(C[N@@H+](C(C)C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179937546 1035061064 /nfs/dbraw/zinc/06/10/64/1035061064.db2.gz TZUQMPQWTJVDOU-UHFFFAOYSA-N 1 1 344.358 3.620 20 5 EHBDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580129033 1035414634 /nfs/dbraw/zinc/41/46/34/1035414634.db2.gz INKSPUQPYNGCRV-INIZCTEOSA-N 1 1 332.400 3.694 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2cccc(OC)c2)ccc1[N+](=O)[O-] ZINC000492359266 1035697787 /nfs/dbraw/zinc/69/77/87/1035697787.db2.gz WCNMYRXPJXLXMV-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000613380792 1035707830 /nfs/dbraw/zinc/70/78/30/1035707830.db2.gz FPJAWHGFKMXZJR-INIZCTEOSA-N 1 1 346.358 3.785 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000613380792 1035707847 /nfs/dbraw/zinc/70/78/47/1035707847.db2.gz FPJAWHGFKMXZJR-INIZCTEOSA-N 1 1 346.358 3.785 20 5 EHBDMO Cc1cnccc1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582178741 1035722335 /nfs/dbraw/zinc/72/23/35/1035722335.db2.gz QPYHKUXFIZJWCI-GOSISDBHSA-N 1 1 325.412 3.720 20 5 EHBDMO COCCCC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595469500 1035790457 /nfs/dbraw/zinc/79/04/57/1035790457.db2.gz PBOCCHPIHPDCND-HNNXBMFYSA-N 1 1 333.388 3.539 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000443958080 1035951324 /nfs/dbraw/zinc/95/13/24/1035951324.db2.gz LNHWZFBNSZXQEK-ZIAGYGMSSA-N 1 1 348.447 3.596 20 5 EHBDMO C[N@@H+](CCOC(C)(C)C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000689902160 1036044903 /nfs/dbraw/zinc/04/49/03/1036044903.db2.gz APPVOCMPBFDPDN-UHFFFAOYSA-N 1 1 345.237 3.604 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492790616 1036297065 /nfs/dbraw/zinc/29/70/65/1036297065.db2.gz PWBFRBCHCJQKQF-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO CCn1c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000180418440 1036778012 /nfs/dbraw/zinc/77/80/12/1036778012.db2.gz SIHQTTXTYCCPNL-LBPRGKRZSA-N 1 1 342.374 3.954 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4c(s3)CCC4)C2)cc1 ZINC000590659582 1036995774 /nfs/dbraw/zinc/99/57/74/1036995774.db2.gz JUMNDNOVBOZRCR-AWEZNQCLSA-N 1 1 343.452 3.920 20 5 EHBDMO Cc1nn(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537209 1037022692 /nfs/dbraw/zinc/02/26/92/1037022692.db2.gz IDKLLCCPWLDPFB-BBRMVZONSA-N 1 1 328.416 3.552 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130238815 1037037192 /nfs/dbraw/zinc/03/71/92/1037037192.db2.gz PPBILQSUFGLROC-OAHLLOKOSA-N 1 1 330.388 3.655 20 5 EHBDMO C[NH+](C)C[C@H](Cc1ccccc1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522963 1037089965 /nfs/dbraw/zinc/08/99/65/1037089965.db2.gz OCYDFFYHBAYBCI-INIZCTEOSA-N 1 1 347.846 3.511 20 5 EHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c(OC)c1 ZINC000761521497 1037098342 /nfs/dbraw/zinc/09/83/42/1037098342.db2.gz IBSMNBTUQPSNQG-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@H]2/C=C/c2cccs2)n1 ZINC000542131640 1037108256 /nfs/dbraw/zinc/10/82/56/1037108256.db2.gz NKZDUSHJMZKCTR-KIUWMYQTSA-N 1 1 346.456 3.811 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000542185224 1037146650 /nfs/dbraw/zinc/14/66/50/1037146650.db2.gz OCGKOWQRNATKOL-QEJZJMRPSA-N 1 1 334.416 3.623 20 5 EHBDMO CO[C@@H](C)C[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000573018215 1037159519 /nfs/dbraw/zinc/15/95/19/1037159519.db2.gz DTOBMFDDQWCNMZ-ZDUSSCGKSA-N 1 1 348.374 3.993 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000130247094 1037189644 /nfs/dbraw/zinc/18/96/44/1037189644.db2.gz HSUGGOVKZYAFTP-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163409901 1037392576 /nfs/dbraw/zinc/39/25/76/1037392576.db2.gz KQUNWDLESFNLBJ-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000462862130 1037486167 /nfs/dbraw/zinc/48/61/67/1037486167.db2.gz LMAQECXBLITDOQ-WCQYABFASA-N 1 1 345.365 3.780 20 5 EHBDMO C[C@H](NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591581106 1037518502 /nfs/dbraw/zinc/51/85/02/1037518502.db2.gz KTFBRVDYZWRVPY-AVGNSLFASA-N 1 1 349.431 3.674 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCCC[C@@H]1C ZINC000462925657 1037554435 /nfs/dbraw/zinc/55/44/35/1037554435.db2.gz CMUKFZHEYVCLEP-NWDGAFQWSA-N 1 1 343.374 3.871 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@H]2CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000493714460 1037574507 /nfs/dbraw/zinc/57/45/07/1037574507.db2.gz YUZRIMURXWZZDK-ZBFHGGJFSA-N 1 1 336.432 3.631 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOc2c(C)cccc21 ZINC000188952959 1037575283 /nfs/dbraw/zinc/57/52/83/1037575283.db2.gz KQXUKYDSUTWVKF-KRWDZBQOSA-N 1 1 342.395 3.915 20 5 EHBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150541 1037622330 /nfs/dbraw/zinc/62/23/30/1037622330.db2.gz FURLWNZUSZQCEC-IAGOWNOFSA-N 1 1 333.476 3.922 20 5 EHBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150541 1037622338 /nfs/dbraw/zinc/62/23/38/1037622338.db2.gz FURLWNZUSZQCEC-IAGOWNOFSA-N 1 1 333.476 3.922 20 5 EHBDMO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000549928316 1037642783 /nfs/dbraw/zinc/64/27/83/1037642783.db2.gz OMMLZGYXXQPDQQ-CYBMUJFWSA-N 1 1 330.384 3.938 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000463080536 1037727487 /nfs/dbraw/zinc/72/74/87/1037727487.db2.gz ZNOAWBRTYTWJPJ-GFCCVEGCSA-N 1 1 343.374 3.507 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccccc2F)CCC1 ZINC000592144282 1037862474 /nfs/dbraw/zinc/86/24/74/1037862474.db2.gz HIFKQWWESRCMHN-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO CC(=O)c1cc(NCCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000341367004 1038024870 /nfs/dbraw/zinc/02/48/70/1038024870.db2.gz JVAVVNCMMVJVSO-UHFFFAOYSA-N 1 1 341.411 3.731 20 5 EHBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000592745936 1038119250 /nfs/dbraw/zinc/11/92/50/1038119250.db2.gz MKTZNGQIHJBFKI-ZDUSSCGKSA-N 1 1 330.388 3.560 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1 ZINC000478026121 1039147712 /nfs/dbraw/zinc/14/77/12/1039147712.db2.gz OCCUMLQQNPFEFH-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCn3c(cc4ccccc43)C2)cc1 ZINC000554305231 1039201342 /nfs/dbraw/zinc/20/13/42/1039201342.db2.gz HAMXWZJEMCKKRZ-UHFFFAOYSA-N 1 1 335.407 3.998 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440167 1039549481 /nfs/dbraw/zinc/54/94/81/1039549481.db2.gz AIJXJZIAWXBZLI-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccc3cn[nH]c3c1)CCC2 ZINC000342816031 1039551739 /nfs/dbraw/zinc/55/17/39/1039551739.db2.gz SLIYTDFDKDCMDZ-SFHVURJKSA-N 1 1 336.395 3.681 20 5 EHBDMO C[C@H](c1cccc(Nc2c(F)cccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000553034041 1039721164 /nfs/dbraw/zinc/72/11/64/1039721164.db2.gz RFCHJMNJEUTPSS-CYBMUJFWSA-N 1 1 345.374 3.871 20 5 EHBDMO C[C@H]([N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000027132905 1039937872 /nfs/dbraw/zinc/93/78/72/1039937872.db2.gz NEJSCMALINTLCJ-JTQLQIEISA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@@H]([N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000027132774 1039939315 /nfs/dbraw/zinc/93/93/15/1039939315.db2.gz YQPXAALNJPQEOL-SNVBAGLBSA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1cnc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000192954478 1040177986 /nfs/dbraw/zinc/17/79/86/1040177986.db2.gz QEIDECPBAWAJNH-CQSZACIVSA-N 1 1 346.818 3.577 20 5 EHBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000573741485 1040214216 /nfs/dbraw/zinc/21/42/16/1040214216.db2.gz IXNNUZQCZWBIEN-HZPDHXFCSA-N 1 1 330.384 3.715 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000489980366 1040284810 /nfs/dbraw/zinc/28/48/10/1040284810.db2.gz RESXXDJQWBXAJY-CQSZACIVSA-N 1 1 342.395 3.883 20 5 EHBDMO COc1cc(C[N@@H+](C)CC2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000512667968 1040465332 /nfs/dbraw/zinc/46/53/32/1040465332.db2.gz HVVIIIORUIMZEK-UHFFFAOYSA-N 1 1 344.358 3.827 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCN(c2ccccc2)C1 ZINC000490366272 1040515857 /nfs/dbraw/zinc/51/58/57/1040515857.db2.gz KMBOUHGWJJVUCQ-GOSISDBHSA-N 1 1 343.402 3.835 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600198326 1040820862 /nfs/dbraw/zinc/82/08/62/1040820862.db2.gz WMOWPLBDTPRTQR-HOCLYGCPSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078766 1040885616 /nfs/dbraw/zinc/88/56/16/1040885616.db2.gz QATRPIVWONYKFH-JKSUJKDBSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(COc3ccccc3)CC2)cs1 ZINC000055082478 1041109510 /nfs/dbraw/zinc/10/95/10/1041109510.db2.gz NVUSRFMQPASTFG-UHFFFAOYSA-N 1 1 332.425 3.947 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000302829742 1041294551 /nfs/dbraw/zinc/29/45/51/1041294551.db2.gz JZJQZONPDRCAIM-CQSZACIVSA-N 1 1 332.448 3.629 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000549576371 1042356041 /nfs/dbraw/zinc/35/60/41/1042356041.db2.gz MCQYETKJPYOVQI-OAHLLOKOSA-N 1 1 344.242 3.824 20 5 EHBDMO CC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(OC)cc1 ZINC000181820981 1042408677 /nfs/dbraw/zinc/40/86/77/1042408677.db2.gz FLGHBRKJBTXKGT-HNNXBMFYSA-N 1 1 341.367 3.986 20 5 EHBDMO Cc1c(C[NH2+]Cc2ccccc2Br)cccc1[N+](=O)[O-] ZINC000048820634 1042420005 /nfs/dbraw/zinc/42/00/05/1042420005.db2.gz MHUGMLKEBUMPLZ-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000344030523 1043124323 /nfs/dbraw/zinc/12/43/23/1043124323.db2.gz BUJRFLLTAWBUPM-UONOGXRCSA-N 1 1 342.399 3.994 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279259952 1043667393 /nfs/dbraw/zinc/66/73/93/1043667393.db2.gz MAQMXLSQKHEHSX-GFCCVEGCSA-N 1 1 333.413 3.577 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728900056 1043813850 /nfs/dbraw/zinc/81/38/50/1043813850.db2.gz BBYLZYDCFCLLQK-SFHVURJKSA-N 1 1 328.416 3.926 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160901 /nfs/dbraw/zinc/16/09/01/1044160901.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 1 1 331.460 3.681 20 5 EHBDMO COc1cccc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000185729259 1126994626 /nfs/dbraw/zinc/99/46/26/1126994626.db2.gz CBLGLXIFMSQYDV-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185876079 1127181435 /nfs/dbraw/zinc/18/14/35/1127181435.db2.gz PNRKMSQTMGYSIX-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2cccs2)CC1 ZINC000075620907 1128353363 /nfs/dbraw/zinc/35/33/63/1128353363.db2.gz NXTWKAUSDNSUTF-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO C[C@H](C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000553935455 1128590080 /nfs/dbraw/zinc/59/00/80/1128590080.db2.gz CMEBPWFANGUMAT-CVEARBPZSA-N 1 1 328.412 3.581 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CCCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479640 1120511615 /nfs/dbraw/zinc/51/16/15/1120511615.db2.gz VFNXGYFIOWOILK-IEBWSBKVSA-N 1 1 344.411 3.998 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@@H]2CCCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479639 1120513540 /nfs/dbraw/zinc/51/35/40/1120513540.db2.gz VFNXGYFIOWOILK-HKUYNNGSSA-N 1 1 344.411 3.998 20 5 EHBDMO Cc1nc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000301692002 1128958537 /nfs/dbraw/zinc/95/85/37/1128958537.db2.gz XYGKZANBBDIXJU-HNNXBMFYSA-N 1 1 346.475 3.779 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc3c2OCCO3)C2CC2)c1 ZINC000153224542 1121114068 /nfs/dbraw/zinc/11/40/68/1121114068.db2.gz WEMJBLYLOQJBTK-UHFFFAOYSA-N 1 1 340.379 3.531 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3c2OCCO3)C2CC2)c1 ZINC000153224542 1121114074 /nfs/dbraw/zinc/11/40/74/1121114074.db2.gz WEMJBLYLOQJBTK-UHFFFAOYSA-N 1 1 340.379 3.531 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663271 1121561264 /nfs/dbraw/zinc/56/12/64/1121561264.db2.gz PXQLMBNSJXFWRQ-ZBFHGGJFSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663271 1121561271 /nfs/dbraw/zinc/56/12/71/1121561271.db2.gz PXQLMBNSJXFWRQ-ZBFHGGJFSA-N 1 1 347.459 3.661 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@H]21 ZINC000301726915 1128998839 /nfs/dbraw/zinc/99/88/39/1128998839.db2.gz VMMSMZOUGUFLHJ-BXUZGUMPSA-N 1 1 343.349 3.534 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272528934 1121675879 /nfs/dbraw/zinc/67/58/79/1121675879.db2.gz MOICMSLEFYDDKU-QGZVFWFLSA-N 1 1 328.416 3.588 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301193507 1122459814 /nfs/dbraw/zinc/45/98/14/1122459814.db2.gz SRTZPHWGHWHIJE-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO C[C@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136451 1123167555 /nfs/dbraw/zinc/16/75/55/1123167555.db2.gz IWCAWLSRKOURNS-WMZOPIPTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136451 1123167557 /nfs/dbraw/zinc/16/75/57/1123167557.db2.gz IWCAWLSRKOURNS-WMZOPIPTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136451 1123167560 /nfs/dbraw/zinc/16/75/60/1123167560.db2.gz IWCAWLSRKOURNS-WMZOPIPTSA-N 1 1 339.439 3.768 20 5 EHBDMO CCC[N@@H+](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609771662 1123659925 /nfs/dbraw/zinc/65/99/25/1123659925.db2.gz VMCCMJNPYPJYHR-UHFFFAOYSA-N 1 1 343.383 3.667 20 5 EHBDMO CC(C)[N@@H+](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762367 1123662973 /nfs/dbraw/zinc/66/29/73/1123662973.db2.gz DVMHYGMAWIADFP-UHFFFAOYSA-N 1 1 343.383 3.666 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000610133755 1123738873 /nfs/dbraw/zinc/73/88/73/1123738873.db2.gz SUFGRGRJXAHMFI-DGCLKSJQSA-N 1 1 345.365 3.923 20 5 EHBDMO Cn1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000179694500 1123826584 /nfs/dbraw/zinc/82/65/84/1123826584.db2.gz LEFMDERHCWCLGI-UHFFFAOYSA-N 1 1 336.395 3.627 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000179694500 1123826592 /nfs/dbraw/zinc/82/65/92/1123826592.db2.gz LEFMDERHCWCLGI-UHFFFAOYSA-N 1 1 336.395 3.627 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836027 1123884312 /nfs/dbraw/zinc/88/43/12/1123884312.db2.gz HCDDJXOIXIMFDU-SCOADAFUSA-N 1 1 326.400 3.601 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000615837610 1123885319 /nfs/dbraw/zinc/88/53/19/1123885319.db2.gz LAPDJOXDGHTNGX-PINLSGDHSA-N 1 1 326.343 3.702 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)cn1 ZINC000615838859 1123885359 /nfs/dbraw/zinc/88/53/59/1123885359.db2.gz QMNKXSYRXFXZAC-NTEUORMPSA-N 1 1 327.384 3.534 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@H]21 ZINC000301901922 1129310588 /nfs/dbraw/zinc/31/05/88/1129310588.db2.gz NUTKGGYHIPRQAZ-GOEBONIOSA-N 1 1 347.459 3.693 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000069085001 1129421738 /nfs/dbraw/zinc/42/17/38/1129421738.db2.gz VHJFOHDSUAYDEK-MRXNPFEDSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000069085001 1129421740 /nfs/dbraw/zinc/42/17/40/1129421740.db2.gz VHJFOHDSUAYDEK-MRXNPFEDSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000069084998 1129421772 /nfs/dbraw/zinc/42/17/72/1129421772.db2.gz VHJFOHDSUAYDEK-INIZCTEOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000069084998 1129421774 /nfs/dbraw/zinc/42/17/74/1129421774.db2.gz VHJFOHDSUAYDEK-INIZCTEOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(Nc2ccc3c(c2)[nH+]c(C)n3C)c1 ZINC000301961886 1129457906 /nfs/dbraw/zinc/45/79/06/1129457906.db2.gz RATCKDYVZSLPDZ-UHFFFAOYSA-N 1 1 330.319 3.681 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000301996914 1129507105 /nfs/dbraw/zinc/50/71/05/1129507105.db2.gz HWJWMIYDVZQDFV-OAHLLOKOSA-N 1 1 331.441 3.615 20 5 EHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884139 1129547753 /nfs/dbraw/zinc/54/77/53/1129547753.db2.gz RAWDOSCMDNCLJR-SWLSCSKDSA-N 1 1 326.824 3.764 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154464339 1129560942 /nfs/dbraw/zinc/56/09/42/1129560942.db2.gz DGVNCGPBGWZBOE-UHFFFAOYSA-N 1 1 336.395 3.627 20 5 EHBDMO CC(C)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(F)cc1 ZINC000735872694 1131384441 /nfs/dbraw/zinc/38/44/41/1131384441.db2.gz QKEPYWBOEBLFCQ-LJQANCHMSA-N 1 1 346.402 3.926 20 5 EHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304729 1129660244 /nfs/dbraw/zinc/66/02/44/1129660244.db2.gz UJLAKCPTEFGDAT-HUUCEWRRSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(NC2CC[NH+](C(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302129840 1129768920 /nfs/dbraw/zinc/76/89/20/1129768920.db2.gz BQXSJYJTODDREI-UHFFFAOYSA-N 1 1 328.416 3.736 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302204129 1129772859 /nfs/dbraw/zinc/77/28/59/1129772859.db2.gz WFVSFYLXCDFDCK-OAHLLOKOSA-N 1 1 342.443 3.620 20 5 EHBDMO CCC[N@H+](C)C[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302204129 1129772863 /nfs/dbraw/zinc/77/28/63/1129772863.db2.gz WFVSFYLXCDFDCK-OAHLLOKOSA-N 1 1 342.443 3.620 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302204129 1129772866 /nfs/dbraw/zinc/77/28/66/1129772866.db2.gz WFVSFYLXCDFDCK-OAHLLOKOSA-N 1 1 342.443 3.620 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCSCc1ccccc1)CC2 ZINC000347801495 1129824573 /nfs/dbraw/zinc/82/45/73/1129824573.db2.gz UOPKFDUZFKAJQA-UHFFFAOYSA-N 1 1 343.452 3.671 20 5 EHBDMO CCCCNC(=O)[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245521615 1130230825 /nfs/dbraw/zinc/23/08/25/1130230825.db2.gz LAWUPBSGLNPYMT-HZPDHXFCSA-N 1 1 347.459 3.593 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1c1cccn1C ZINC000175125197 1130408795 /nfs/dbraw/zinc/40/87/95/1130408795.db2.gz QFIJOCJXGNEEKL-KRWDZBQOSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1c1cccn1C ZINC000175125197 1130408798 /nfs/dbraw/zinc/40/87/98/1130408798.db2.gz QFIJOCJXGNEEKL-KRWDZBQOSA-N 1 1 329.400 3.669 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731206959 1130778700 /nfs/dbraw/zinc/77/87/00/1130778700.db2.gz XHQWGCZLQHHGMI-UHFFFAOYSA-N 1 1 348.472 3.761 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3c(O)cccc3C1)CC2 ZINC001172908247 1131888195 /nfs/dbraw/zinc/88/81/95/1131888195.db2.gz LEXIJFRXLPLXAW-QGZVFWFLSA-N 1 1 338.407 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](COCC3CC3)C1)CC2 ZINC001172919273 1131904063 /nfs/dbraw/zinc/90/40/63/1131904063.db2.gz FLKBJKLQVMIMJE-APWZRJJASA-N 1 1 344.455 3.591 20 5 EHBDMO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922645 1131906427 /nfs/dbraw/zinc/90/64/27/1131906427.db2.gz ZWOMGAINXXJFRZ-XJKSGUPXSA-N 1 1 348.443 3.504 20 5 EHBDMO C[N@@H+](CCC1CC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015595 1131935426 /nfs/dbraw/zinc/93/54/26/1131935426.db2.gz SSFTXQIVHDWMTL-UHFFFAOYSA-N 1 1 339.386 3.574 20 5 EHBDMO CC[N@@H+](Cc1ccccn1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196590 1131996494 /nfs/dbraw/zinc/99/64/94/1131996494.db2.gz NXYQHKPFNQDJGI-CYBMUJFWSA-N 1 1 347.390 3.591 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001173219499 1132003243 /nfs/dbraw/zinc/00/32/43/1132003243.db2.gz COJWEAUVNCFSFX-LPHOPBHVSA-N 1 1 345.487 3.770 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001173219499 1132003251 /nfs/dbraw/zinc/00/32/51/1132003251.db2.gz COJWEAUVNCFSFX-LPHOPBHVSA-N 1 1 345.487 3.770 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221259 1132004348 /nfs/dbraw/zinc/00/43/48/1132004348.db2.gz GSEJDXUPRPRGAE-RISCZKNCSA-N 1 1 334.313 3.750 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001173225940 1132006645 /nfs/dbraw/zinc/00/66/45/1132006645.db2.gz GTJQWEGJIAHDJY-UZLBHIALSA-N 1 1 340.423 3.817 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035320 1132636620 /nfs/dbraw/zinc/63/66/20/1132636620.db2.gz KGZRHNQMIXRWNC-ABAIWWIYSA-N 1 1 328.334 3.509 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001169667939 1132814639 /nfs/dbraw/zinc/81/46/39/1132814639.db2.gz YFFZMRHXIDAXRE-PMACEKPBSA-N 1 1 340.423 3.989 20 5 EHBDMO Cc1ccc(C[N@@H+]2CCc3nc[nH]c3C23CCCCC3)cc1[N+](=O)[O-] ZINC001176115567 1132851040 /nfs/dbraw/zinc/85/10/40/1132851040.db2.gz XYLVXFWRLZMMQB-UHFFFAOYSA-N 1 1 340.427 3.844 20 5 EHBDMO Cc1ccc(C[N@H+]2CCc3nc[nH]c3C23CCCCC3)cc1[N+](=O)[O-] ZINC001176115567 1132851046 /nfs/dbraw/zinc/85/10/46/1132851046.db2.gz XYLVXFWRLZMMQB-UHFFFAOYSA-N 1 1 340.427 3.844 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294668 1133047129 /nfs/dbraw/zinc/04/71/29/1133047129.db2.gz ONJUDYXXJUPIEV-QUHJONEVSA-N 1 1 345.487 3.956 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294668 1133047136 /nfs/dbraw/zinc/04/71/36/1133047136.db2.gz ONJUDYXXJUPIEV-QUHJONEVSA-N 1 1 345.487 3.956 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294668 1133047142 /nfs/dbraw/zinc/04/71/42/1133047142.db2.gz ONJUDYXXJUPIEV-QUHJONEVSA-N 1 1 345.487 3.956 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OC(F)F)cc2F)cc1 ZINC001177416197 1133063398 /nfs/dbraw/zinc/06/33/98/1133063398.db2.gz LIVDNAZTKJFQLG-UHFFFAOYSA-N 1 1 326.274 3.625 20 5 EHBDMO COC(=O)c1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000768544266 1133158122 /nfs/dbraw/zinc/15/81/22/1133158122.db2.gz KNVONCQULOPGIM-UHFFFAOYSA-N 1 1 348.786 3.667 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000768544266 1133158125 /nfs/dbraw/zinc/15/81/25/1133158125.db2.gz KNVONCQULOPGIM-UHFFFAOYSA-N 1 1 348.786 3.667 20 5 EHBDMO CC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1OC ZINC000769767577 1133338458 /nfs/dbraw/zinc/33/84/58/1133338458.db2.gz XAZWJNIFZCITLX-CQSZACIVSA-N 1 1 340.383 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000772278754 1133672607 /nfs/dbraw/zinc/67/26/07/1133672607.db2.gz QRRHGUPQDGZRFM-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788477732 1134129718 /nfs/dbraw/zinc/12/97/18/1134129718.db2.gz FIBLCMZQRCWEAI-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO CC(C)Oc1nc(NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187064507 1134291371 /nfs/dbraw/zinc/29/13/71/1134291371.db2.gz WTYZBRMIEBYKDW-OAHLLOKOSA-N 1 1 348.447 3.596 20 5 EHBDMO CCn1ccc(C[N@H+](C)Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)c1 ZINC000790449677 1134419140 /nfs/dbraw/zinc/41/91/40/1134419140.db2.gz CDSQHMUITBYGNE-UHFFFAOYSA-N 1 1 347.806 3.509 20 5 EHBDMO CCn1ccc(C[N@@H+](C)Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)c1 ZINC000790449677 1134419143 /nfs/dbraw/zinc/41/91/43/1134419143.db2.gz CDSQHMUITBYGNE-UHFFFAOYSA-N 1 1 347.806 3.509 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccnn2-c2ccccc2)c1 ZINC000790471237 1134421042 /nfs/dbraw/zinc/42/10/42/1134421042.db2.gz HUSRCXWMNSWVOA-UHFFFAOYSA-N 1 1 342.786 3.724 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604446 1134581767 /nfs/dbraw/zinc/58/17/67/1134581767.db2.gz JPRXSFICEPHISE-PXNSSMCTSA-N 1 1 340.423 3.735 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820917 1134929353 /nfs/dbraw/zinc/92/93/53/1134929353.db2.gz JHQPJSPPOZZDQE-UHFFFAOYSA-N 1 1 329.787 3.933 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191820917 1134929358 /nfs/dbraw/zinc/92/93/58/1134929358.db2.gz JHQPJSPPOZZDQE-UHFFFAOYSA-N 1 1 329.787 3.933 20 5 EHBDMO Cn1cc([C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000775548689 1135059083 /nfs/dbraw/zinc/05/90/83/1135059083.db2.gz JBELTIFZZJTUNU-HNNXBMFYSA-N 1 1 336.823 3.859 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001193808055 1135187111 /nfs/dbraw/zinc/18/71/11/1135187111.db2.gz QKKIGXFNEZGWBH-CQSZACIVSA-N 1 1 333.432 3.682 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@]3(CCSC3)C2)cc1 ZINC001195093187 1135369007 /nfs/dbraw/zinc/36/90/07/1135369007.db2.gz IABQWOUUZVTZJY-KRWDZBQOSA-N 1 1 336.457 3.583 20 5 EHBDMO Cc1c(C[N@@H+]2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495923 1135434268 /nfs/dbraw/zinc/43/42/68/1135434268.db2.gz AZTAXIBMQFYEQG-XJKSGUPXSA-N 1 1 348.443 3.703 20 5 EHBDMO C[N@@H+]1CC[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006295 1135913071 /nfs/dbraw/zinc/91/30/71/1135913071.db2.gz IONOOZLGSUXEGB-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006295 1135913072 /nfs/dbraw/zinc/91/30/72/1135913072.db2.gz IONOOZLGSUXEGB-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO CC[C@@H](C)[N@@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811477082 1136096541 /nfs/dbraw/zinc/09/65/41/1136096541.db2.gz DKXMSMVWPGSGIR-SNVBAGLBSA-N 1 1 334.247 3.722 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279698 1136134628 /nfs/dbraw/zinc/13/46/28/1136134628.db2.gz XENNFJNEXIYUNE-QZTJIDSGSA-N 1 1 330.359 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279694 1136134812 /nfs/dbraw/zinc/13/48/12/1136134812.db2.gz XENNFJNEXIYUNE-MSOLQXFVSA-N 1 1 330.359 3.604 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851221 1136261464 /nfs/dbraw/zinc/26/14/64/1136261464.db2.gz QOSAXEJOFLIJFB-HNAYVOBHSA-N 1 1 328.412 3.847 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000813329301 1136322655 /nfs/dbraw/zinc/32/26/55/1136322655.db2.gz OJIBROYPDICBRN-KBPBESRZSA-N 1 1 328.416 3.848 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCc1nsc3ccccc31)C2 ZINC000851869366 1136414641 /nfs/dbraw/zinc/41/46/41/1136414641.db2.gz FNWJLFNRUKFTCH-UHFFFAOYSA-N 1 1 339.420 3.805 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccsc1)[C@H]1CC[C@H](O)CC1 ZINC000852205379 1136440074 /nfs/dbraw/zinc/44/00/74/1136440074.db2.gz ZCHPHBYWCDUNMS-QAQDUYKDSA-N 1 1 346.452 3.962 20 5 EHBDMO CC(C)C[N@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577955 1136443497 /nfs/dbraw/zinc/44/34/97/1136443497.db2.gz BMDQIEUFZVFHDT-LJQANCHMSA-N 1 1 346.402 3.926 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@@H]2Cc2ccccc2)cc1 ZINC000776581263 1136444523 /nfs/dbraw/zinc/44/45/23/1136444523.db2.gz GEQAPSOUFLUXIZ-WOJBJXKFSA-N 1 1 340.423 3.725 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000814641828 1136488543 /nfs/dbraw/zinc/48/85/43/1136488543.db2.gz LLGDTLVAUICKSI-MJGOQNOKSA-N 1 1 326.396 3.508 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000814909704 1136523514 /nfs/dbraw/zinc/52/35/14/1136523514.db2.gz PJALSZQRMZKFCN-OAHLLOKOSA-N 1 1 344.242 3.824 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858015371 1136931987 /nfs/dbraw/zinc/93/19/87/1136931987.db2.gz UOQQFCFJZKUTIU-SFHVURJKSA-N 1 1 339.395 3.521 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1F ZINC000860104070 1137044443 /nfs/dbraw/zinc/04/44/43/1137044443.db2.gz GJEOFTLXMCNVKW-AWEZNQCLSA-N 1 1 348.349 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000862541564 1137149457 /nfs/dbraw/zinc/14/94/57/1137149457.db2.gz WIKLBYKXPVPKCK-ZDUSSCGKSA-N 1 1 332.787 3.943 20 5 EHBDMO CC(C)c1[nH+]ccn1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000865362565 1137277826 /nfs/dbraw/zinc/27/78/26/1137277826.db2.gz ZSLHUVWJPCYBHN-UHFFFAOYSA-N 1 1 347.762 3.666 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cccc3c2CCOC3)c1 ZINC000865726537 1137306993 /nfs/dbraw/zinc/30/69/93/1137306993.db2.gz XXLHZZIQXQFQBK-UHFFFAOYSA-N 1 1 332.787 3.611 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000872022238 1137565164 /nfs/dbraw/zinc/56/51/64/1137565164.db2.gz IHPGXFXMNTWRCD-APHBMKBZSA-N 1 1 335.473 3.594 20 5 EHBDMO COc1ccc([C@H](CCO)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872042265 1137567238 /nfs/dbraw/zinc/56/72/38/1137567238.db2.gz AEJVGVKBXAIZBD-LRDDRELGSA-N 1 1 348.374 3.517 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1C ZINC000878165122 1137705352 /nfs/dbraw/zinc/70/53/52/1137705352.db2.gz RPXACHOXKHZGFK-UWVGGRQHSA-N 1 1 336.779 3.529 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)o1 ZINC000879008773 1137735234 /nfs/dbraw/zinc/73/52/34/1137735234.db2.gz JTKZNOYLLHCKCH-ZFWWWQNUSA-N 1 1 342.399 3.799 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055381 1137766690 /nfs/dbraw/zinc/76/66/90/1137766690.db2.gz XCOWUPZUBYOBNT-SUNKGSAMSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055381 1137766691 /nfs/dbraw/zinc/76/66/91/1137766691.db2.gz XCOWUPZUBYOBNT-SUNKGSAMSA-N 1 1 332.322 3.698 20 5 EHBDMO COc1ccc(C[NH2+]C2(c3nccs3)CCCC2)cc1[N+](=O)[O-] ZINC000116374008 1137925462 /nfs/dbraw/zinc/92/54/62/1137925462.db2.gz DNBWUVIEXOSDNV-UHFFFAOYSA-N 1 1 333.413 3.619 20 5 EHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000331948609 1137926653 /nfs/dbraw/zinc/92/66/53/1137926653.db2.gz PAGXPESNAQDAPZ-PTKHLAPESA-N 1 1 332.444 3.665 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000119819303 1137944536 /nfs/dbraw/zinc/94/45/36/1137944536.db2.gz MZLDCUQMVJTIIJ-HNNXBMFYSA-N 1 1 348.447 3.550 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1Cl ZINC000134892049 1137961452 /nfs/dbraw/zinc/96/14/52/1137961452.db2.gz JOBLPSPGMZNVMU-RHSMWYFYSA-N 1 1 349.862 3.697 20 5 EHBDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135648520 1137977682 /nfs/dbraw/zinc/97/76/82/1137977682.db2.gz MYINEPUKMZAVND-LBPRGKRZSA-N 1 1 327.222 3.835 20 5 EHBDMO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886112233 1138048090 /nfs/dbraw/zinc/04/80/90/1138048090.db2.gz RYIDENFFAHWDBX-MRXNPFEDSA-N 1 1 329.400 3.875 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000886296864 1138065329 /nfs/dbraw/zinc/06/53/29/1138065329.db2.gz CFBUZJIBRFRVCK-ZDUSSCGKSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000886296864 1138065330 /nfs/dbraw/zinc/06/53/30/1138065330.db2.gz CFBUZJIBRFRVCK-ZDUSSCGKSA-N 1 1 333.338 3.648 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3C)c2C1 ZINC000066514969 1138075791 /nfs/dbraw/zinc/07/57/91/1138075791.db2.gz GOUWEDTVEFKSKZ-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3C)c2C1 ZINC000066514969 1138075794 /nfs/dbraw/zinc/07/57/94/1138075794.db2.gz GOUWEDTVEFKSKZ-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000131130873 1138497852 /nfs/dbraw/zinc/49/78/52/1138497852.db2.gz CCDBFGWVJDRDRE-QGZVFWFLSA-N 1 1 330.384 3.980 20 5 EHBDMO C[NH+](C)Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1Cl ZINC000337259338 1138511874 /nfs/dbraw/zinc/51/18/74/1138511874.db2.gz VEYIXNCORORQFG-UHFFFAOYSA-N 1 1 333.775 3.562 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178793899 1139717839 /nfs/dbraw/zinc/71/78/39/1139717839.db2.gz MLYVLIAIEDFPKY-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178793899 1139717844 /nfs/dbraw/zinc/71/78/44/1139717844.db2.gz MLYVLIAIEDFPKY-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])cc1F ZINC000184304734 1140094190 /nfs/dbraw/zinc/09/41/90/1140094190.db2.gz TZPPUOUKTOAHIT-SNVBAGLBSA-N 1 1 349.318 3.502 20 5 EHBDMO C[C@@H]1C[C@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000193466540 1140577028 /nfs/dbraw/zinc/57/70/28/1140577028.db2.gz QSFUNHPZOXRQHC-RHSMWYFYSA-N 1 1 340.427 3.642 20 5 EHBDMO COc1nc(C)cc(C)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000268834495 1141003766 /nfs/dbraw/zinc/00/37/66/1141003766.db2.gz LDGWJHVQWQLZBF-CQSZACIVSA-N 1 1 329.400 3.774 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000339140118 1141507828 /nfs/dbraw/zinc/50/78/28/1141507828.db2.gz FNMZTTLQLBFLBL-LRDDRELGSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000339140118 1141507831 /nfs/dbraw/zinc/50/78/31/1141507831.db2.gz FNMZTTLQLBFLBL-LRDDRELGSA-N 1 1 345.424 3.820 20 5 EHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000072034412 201172549 /nfs/dbraw/zinc/17/25/49/201172549.db2.gz XBQQFZVHZKDYTI-QGZVFWFLSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000072034412 201172552 /nfs/dbraw/zinc/17/25/52/201172552.db2.gz XBQQFZVHZKDYTI-QGZVFWFLSA-N 1 1 339.395 3.506 20 5 EHBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643638 719205448 /nfs/dbraw/zinc/20/54/48/719205448.db2.gz ZVADVIGMJFPKTK-STQMWFEESA-N 1 1 340.858 3.965 20 5 EHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(-n2cccn2)c(F)c1 ZINC000339426738 1014406548 /nfs/dbraw/zinc/40/65/48/1014406548.db2.gz WEMPSPLTXCUFRZ-NSHDSACASA-N 1 1 346.387 3.832 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000430160271 1014484584 /nfs/dbraw/zinc/48/45/84/1014484584.db2.gz FWIYKJFUIJRHTA-QWSHFYNQSA-N 1 1 330.428 3.747 20 5 EHBDMO CSC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189060 1014696417 /nfs/dbraw/zinc/69/64/17/1014696417.db2.gz CTHXVZABDBZQIX-LLVKDONJSA-N 1 1 346.399 3.771 20 5 EHBDMO CSC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189060 1014696421 /nfs/dbraw/zinc/69/64/21/1014696421.db2.gz CTHXVZABDBZQIX-LLVKDONJSA-N 1 1 346.399 3.771 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000153987524 1014750195 /nfs/dbraw/zinc/75/01/95/1014750195.db2.gz QLUSPWYIUKIEMM-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000153987524 1014750207 /nfs/dbraw/zinc/75/02/07/1014750207.db2.gz QLUSPWYIUKIEMM-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3cn[nH]c3C2)c2ccccc2)c1 ZINC000359895406 1015909202 /nfs/dbraw/zinc/90/92/02/1015909202.db2.gz GWIYINRSQQWNND-XLIONFOSSA-N 1 1 348.406 3.554 20 5 EHBDMO Clc1ccc2ccc3ccc(N4CCc5[nH+]ccn5CC4)nc3c2n1 ZINC001167182777 1016502576 /nfs/dbraw/zinc/50/25/76/1016502576.db2.gz TZXMJERFSXGUPI-UHFFFAOYSA-N 1 1 349.825 3.696 20 5 EHBDMO CSC1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000311320532 1016659850 /nfs/dbraw/zinc/65/98/50/1016659850.db2.gz ABVQVGKQBDXGHS-UHFFFAOYSA-N 1 1 345.262 3.685 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459770434 1032460526 /nfs/dbraw/zinc/46/05/26/1032460526.db2.gz CKGWCRMRIADFAQ-DOTOQJQBSA-N 1 1 338.835 3.621 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1 ZINC000449347950 1032464833 /nfs/dbraw/zinc/46/48/33/1032464833.db2.gz KBAWNOWEQOLEHV-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cccc4nccn43)C2)cc1 ZINC000449497631 1032668651 /nfs/dbraw/zinc/66/86/51/1032668651.db2.gz ISNPWGZRWUEOGL-INIZCTEOSA-N 1 1 336.395 3.622 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(C(F)(F)F)c1 ZINC000091480193 1032704777 /nfs/dbraw/zinc/70/47/77/1032704777.db2.gz OGZACWQKLZMQQM-SNVBAGLBSA-N 1 1 340.305 3.721 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000247233594 1017537671 /nfs/dbraw/zinc/53/76/71/1017537671.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 1 1 341.455 3.557 20 5 EHBDMO Cc1ccc(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000377407251 1017763227 /nfs/dbraw/zinc/76/32/27/1017763227.db2.gz JWECAAUNIVMATE-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCC[N@H+]3C3CCCC3)n2)cc1 ZINC000275643003 1017874459 /nfs/dbraw/zinc/87/44/59/1017874459.db2.gz ORTIKRVOXRALMZ-HNNXBMFYSA-N 1 1 328.372 3.724 20 5 EHBDMO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893069854 1018335322 /nfs/dbraw/zinc/33/53/22/1018335322.db2.gz SGJZENDZOQSSPA-HNNXBMFYSA-N 1 1 348.786 3.870 20 5 EHBDMO CC(=O)Nc1cccc2c1CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000610367993 1018536708 /nfs/dbraw/zinc/53/67/08/1018536708.db2.gz ZBIBHULCQKRCSE-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000610367993 1018536721 /nfs/dbraw/zinc/53/67/21/1018536721.db2.gz ZBIBHULCQKRCSE-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000610389646 1018706827 /nfs/dbraw/zinc/70/68/27/1018706827.db2.gz UUOLEEYDQHBSAM-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000610389646 1018706837 /nfs/dbraw/zinc/70/68/37/1018706837.db2.gz UUOLEEYDQHBSAM-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1cccc(N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111390 1018972292 /nfs/dbraw/zinc/97/22/92/1018972292.db2.gz DFSMWKCWEXNGRC-HOCLYGCPSA-N 1 1 341.411 3.678 20 5 EHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(Cl)cc3)CC2)c1 ZINC000047911107 1019356201 /nfs/dbraw/zinc/35/62/01/1019356201.db2.gz YVQZZNNYJMKBID-UHFFFAOYSA-N 1 1 331.803 3.570 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513682548 1019934483 /nfs/dbraw/zinc/93/44/83/1019934483.db2.gz AJJWVZIJLZGJTO-GOSISDBHSA-N 1 1 342.443 3.978 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103330 1020432734 /nfs/dbraw/zinc/43/27/34/1020432734.db2.gz OJSMVNKARAUKBC-HXUWFJFHSA-N 1 1 338.407 3.873 20 5 EHBDMO C[C@H]1COC[C@H](c2ccccc2)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038371 1020675001 /nfs/dbraw/zinc/67/50/01/1020675001.db2.gz JFAJFLWKWHLHFY-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO CCCOc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602516553 1032927692 /nfs/dbraw/zinc/92/76/92/1032927692.db2.gz NGJLAFDVNJNLBV-UHFFFAOYSA-N 1 1 341.367 3.815 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000184405972 1021614268 /nfs/dbraw/zinc/61/42/68/1021614268.db2.gz QVSNDFXRYJTKTQ-CYBMUJFWSA-N 1 1 337.351 3.588 20 5 EHBDMO COCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506011780 1021695770 /nfs/dbraw/zinc/69/57/70/1021695770.db2.gz GZDWMPDYQICSDX-DAXSKMNVSA-N 1 1 332.425 3.818 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000129426581 1021752626 /nfs/dbraw/zinc/75/26/26/1021752626.db2.gz NLNXYOITLQYXRN-KRWDZBQOSA-N 1 1 332.425 3.670 20 5 EHBDMO Cc1ccc(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467895 1021879483 /nfs/dbraw/zinc/87/94/83/1021879483.db2.gz UEEZFDTZUUCHJV-SOLBZPMBSA-N 1 1 331.460 3.740 20 5 EHBDMO Cc1ccc(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467893 1021880877 /nfs/dbraw/zinc/88/08/77/1021880877.db2.gz UEEZFDTZUUCHJV-JZXOWHBKSA-N 1 1 331.460 3.740 20 5 EHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCc3ccccc3Cl)CC2)c1 ZINC000058907717 1033061199 /nfs/dbraw/zinc/06/11/99/1033061199.db2.gz GZLXMTKAXXDDRU-UHFFFAOYSA-N 1 1 345.830 3.613 20 5 EHBDMO COc1cc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000310106537 1022584625 /nfs/dbraw/zinc/58/46/25/1022584625.db2.gz AQAHDRLNVDOVIE-CQSZACIVSA-N 1 1 329.400 3.536 20 5 EHBDMO Cc1cc(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748267 1024610531 /nfs/dbraw/zinc/61/05/31/1024610531.db2.gz GSGFYDULYOGLPX-OAHLLOKOSA-N 1 1 325.412 3.762 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccc(C(C)C)cc1)C1CC1 ZINC000611566617 1024681913 /nfs/dbraw/zinc/68/19/13/1024681913.db2.gz LYEPDTPBKUJNQZ-UHFFFAOYSA-N 1 1 342.443 3.888 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](CCCO)C3)s2)cc1 ZINC000449791154 1033234077 /nfs/dbraw/zinc/23/40/77/1033234077.db2.gz NVEOUPQJHBLZKD-AWEZNQCLSA-N 1 1 346.452 3.918 20 5 EHBDMO C[C@H]([NH3+])[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372449 1024857686 /nfs/dbraw/zinc/85/76/86/1024857686.db2.gz RHEHSJHGXYMHCN-RYUDHWBXSA-N 1 1 349.818 3.677 20 5 EHBDMO COc1cc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185526 1024899479 /nfs/dbraw/zinc/89/94/79/1024899479.db2.gz DYBSKHLKUGOSBA-RHSMWYFYSA-N 1 1 341.411 3.851 20 5 EHBDMO COCC1C[NH+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000895971668 1025027344 /nfs/dbraw/zinc/02/73/44/1025027344.db2.gz NUTZHTAAWICTOG-UHFFFAOYSA-N 1 1 346.358 3.604 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCOC1 ZINC000119772942 1025179682 /nfs/dbraw/zinc/17/96/82/1025179682.db2.gz QNVZBFUFISIMCK-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1c(CN2CCC[N@@H+](CC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000515509387 1025303970 /nfs/dbraw/zinc/30/39/70/1025303970.db2.gz ZOHVCXYHIYSYIO-UHFFFAOYSA-N 1 1 345.487 3.991 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000346991357 1025393863 /nfs/dbraw/zinc/39/38/63/1025393863.db2.gz UMIOQVIPTJLWJM-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000346991357 1025393879 /nfs/dbraw/zinc/39/38/79/1025393879.db2.gz UMIOQVIPTJLWJM-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO Cc1cc(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433138 1025460327 /nfs/dbraw/zinc/46/03/27/1025460327.db2.gz IARGFXJEXFMPGI-NVXWUHKLSA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCSC[C@@H]3C3CC3)co2)cc1 ZINC000451658547 1026211759 /nfs/dbraw/zinc/21/17/59/1026211759.db2.gz YHKXHZDDFWODIH-MRXNPFEDSA-N 1 1 345.424 3.577 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCSC[C@@H]3C3CC3)co2)cc1 ZINC000451658547 1026211770 /nfs/dbraw/zinc/21/17/70/1026211770.db2.gz YHKXHZDDFWODIH-MRXNPFEDSA-N 1 1 345.424 3.577 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000475140876 1026234503 /nfs/dbraw/zinc/23/45/03/1026234503.db2.gz UASADMPOSBIHFW-GOSISDBHSA-N 1 1 328.412 3.593 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000530972510 1026449484 /nfs/dbraw/zinc/44/94/84/1026449484.db2.gz SBTIILVQOPBQOE-HXUWFJFHSA-N 1 1 340.423 3.819 20 5 EHBDMO C[N@H+](Cc1ccccc1)[C@H](CNCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870454 1026867048 /nfs/dbraw/zinc/86/70/48/1026867048.db2.gz AGNUAAQMNGELGX-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H](CNCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870454 1026867054 /nfs/dbraw/zinc/86/70/54/1026867054.db2.gz AGNUAAQMNGELGX-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N3CCC[N@H+](C4CCCC4)CC3)c2c1 ZINC000413153774 1027136485 /nfs/dbraw/zinc/13/64/85/1027136485.db2.gz LYBWEWIABLRKEE-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO CC(=O)c1ccc(NCCCC[N@@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000076795441 1027324875 /nfs/dbraw/zinc/32/48/75/1027324875.db2.gz PGLAFOHJCRRWLA-CQSZACIVSA-N 1 1 333.432 3.721 20 5 EHBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916578 1027517952 /nfs/dbraw/zinc/51/79/52/1027517952.db2.gz YCTABOITTRVVHU-HOCLYGCPSA-N 1 1 344.386 3.991 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000475556004 1027596575 /nfs/dbraw/zinc/59/65/75/1027596575.db2.gz ZRJJDNKSXBPNMV-HUUCEWRRSA-N 1 1 348.447 3.596 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000366628406 1027621873 /nfs/dbraw/zinc/62/18/73/1027621873.db2.gz MUBPRHVVQVRQQX-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000366628406 1027621888 /nfs/dbraw/zinc/62/18/88/1027621888.db2.gz MUBPRHVVQVRQQX-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+](C)C1CCCCC1 ZINC000475561405 1027626214 /nfs/dbraw/zinc/62/62/14/1027626214.db2.gz YRNOIXNUVMCDAF-UHFFFAOYSA-N 1 1 348.447 3.598 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1 ZINC000347330986 1027711523 /nfs/dbraw/zinc/71/15/23/1027711523.db2.gz HXZWHAHNRKNKHR-JKSUJKDBSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1 ZINC000347330986 1027711542 /nfs/dbraw/zinc/71/15/42/1027711542.db2.gz HXZWHAHNRKNKHR-JKSUJKDBSA-N 1 1 344.436 3.596 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503584014 1027945230 /nfs/dbraw/zinc/94/52/30/1027945230.db2.gz YLQLJEHWJBCETK-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO COc1cc(C[N@@H+](CC2CC2)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000533495708 1027958927 /nfs/dbraw/zinc/95/89/27/1027958927.db2.gz YDWPHBIDPFHQOO-UHFFFAOYSA-N 1 1 344.358 3.825 20 5 EHBDMO CCc1ccc([C@H](N[C@@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407728 1028073485 /nfs/dbraw/zinc/07/34/85/1028073485.db2.gz ZFDRGSCLYMENOR-DNVCBOLYSA-N 1 1 343.427 3.523 20 5 EHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444652909 1028113199 /nfs/dbraw/zinc/11/31/99/1028113199.db2.gz UPKVCVQLPVXKNI-LJQANCHMSA-N 1 1 336.395 3.635 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC1CCC1)C(C)C ZINC000444779436 1028240998 /nfs/dbraw/zinc/24/09/98/1028240998.db2.gz YKGNIGDZDGEXMC-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000523439786 1028334487 /nfs/dbraw/zinc/33/44/87/1028334487.db2.gz NGBUUUXIBBWSQN-UHFFFAOYSA-N 1 1 345.468 3.537 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(F)c1 ZINC000178728360 1028376767 /nfs/dbraw/zinc/37/67/67/1028376767.db2.gz BZJLXOMYBHTLNO-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1ccccc1NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350565 1028485711 /nfs/dbraw/zinc/48/57/11/1028485711.db2.gz IHTHDXOHPWWSID-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1ccccc1NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350565 1028485715 /nfs/dbraw/zinc/48/57/15/1028485715.db2.gz IHTHDXOHPWWSID-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613179305 1028579291 /nfs/dbraw/zinc/57/92/91/1028579291.db2.gz SLKYQLLHTDNKSB-RDJZCZTQSA-N 1 1 325.412 3.924 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)C2CCCC2)o1 ZINC000505282911 1029434814 /nfs/dbraw/zinc/43/48/14/1029434814.db2.gz GZFKMFHHUODPOZ-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(C)cc1 ZINC000533250662 1029527846 /nfs/dbraw/zinc/52/78/46/1029527846.db2.gz GIRVYMBCKSDRSJ-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(C)cc1 ZINC000533250662 1029527856 /nfs/dbraw/zinc/52/78/56/1029527856.db2.gz GIRVYMBCKSDRSJ-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262051 1029541790 /nfs/dbraw/zinc/54/17/90/1029541790.db2.gz WTPZFAQEKCRRIG-LSDHHAIUSA-N 1 1 341.411 3.657 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000525121300 1029693145 /nfs/dbraw/zinc/69/31/45/1029693145.db2.gz FYBMBCMPMYTQHM-QGZVFWFLSA-N 1 1 326.396 3.538 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1OCc1cccnc1 ZINC000237937680 1029899993 /nfs/dbraw/zinc/89/99/93/1029899993.db2.gz NJRKXSXMUKTFBD-UHFFFAOYSA-N 1 1 349.390 3.859 20 5 EHBDMO Cc1c(-c2noc([C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246162 1029973332 /nfs/dbraw/zinc/97/33/32/1029973332.db2.gz CRVLYZWHKXJQBY-NTZNESFSSA-N 1 1 330.388 3.887 20 5 EHBDMO CSc1ccc(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000441235555 1030089715 /nfs/dbraw/zinc/08/97/15/1030089715.db2.gz SKKFGKVCXPBLCV-UHFFFAOYSA-N 1 1 332.425 3.828 20 5 EHBDMO CSc1ccc(OCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000441235555 1030089733 /nfs/dbraw/zinc/08/97/33/1030089733.db2.gz SKKFGKVCXPBLCV-UHFFFAOYSA-N 1 1 332.425 3.828 20 5 EHBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447404481 1030172423 /nfs/dbraw/zinc/17/24/23/1030172423.db2.gz JWJYQVYWYUZFHV-AWEZNQCLSA-N 1 1 338.411 3.843 20 5 EHBDMO CCOc1ccc([C@@H](C)[N@H+]2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365343 1030180648 /nfs/dbraw/zinc/18/06/48/1030180648.db2.gz LVARIAAIFKWXAN-KDOFPFPSSA-N 1 1 334.416 3.557 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)C2CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453396113 1030247416 /nfs/dbraw/zinc/24/74/16/1030247416.db2.gz YDMVQLWMDRCULL-IEBWSBKVSA-N 1 1 344.411 3.590 20 5 EHBDMO CC(C)[C@H](CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+]1CCCC1 ZINC000583604378 1030267168 /nfs/dbraw/zinc/26/71/68/1030267168.db2.gz MWXQUWDIQZVKFA-MOPGFXCFSA-N 1 1 331.460 3.682 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594504 1030331885 /nfs/dbraw/zinc/33/18/85/1030331885.db2.gz ZHZQKXUOYBHFRW-YOEHRIQHSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594504 1030331901 /nfs/dbraw/zinc/33/19/01/1030331901.db2.gz ZHZQKXUOYBHFRW-YOEHRIQHSA-N 1 1 347.459 3.661 20 5 EHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000429719382 1030373960 /nfs/dbraw/zinc/37/39/60/1030373960.db2.gz KQUYFUPJZCUQAV-QGZVFWFLSA-N 1 1 328.368 3.646 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000429719382 1030373977 /nfs/dbraw/zinc/37/39/77/1030373977.db2.gz KQUYFUPJZCUQAV-QGZVFWFLSA-N 1 1 328.368 3.646 20 5 EHBDMO C[C@H](CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729484 1030441206 /nfs/dbraw/zinc/44/12/06/1030441206.db2.gz NWROGQFDYQHODM-WBVHZDCISA-N 1 1 340.427 3.670 20 5 EHBDMO CCn1c2ccccc2nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000520460060 1030553335 /nfs/dbraw/zinc/55/33/35/1030553335.db2.gz VMZDJEAKLOCWHF-UHFFFAOYSA-N 1 1 338.411 3.639 20 5 EHBDMO CCn1c2ccccc2nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000520460060 1030553354 /nfs/dbraw/zinc/55/33/54/1030553354.db2.gz VMZDJEAKLOCWHF-UHFFFAOYSA-N 1 1 338.411 3.639 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881640 1030787060 /nfs/dbraw/zinc/78/70/60/1030787060.db2.gz DQYMNIKSRBDWAP-NSHDSACASA-N 1 1 327.812 3.555 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000483104655 1030959933 /nfs/dbraw/zinc/95/99/33/1030959933.db2.gz WFNIHZOTBLRRRZ-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483226983 1031040207 /nfs/dbraw/zinc/04/02/07/1031040207.db2.gz JGSULRNQKXRNSW-AWEZNQCLSA-N 1 1 333.432 3.600 20 5 EHBDMO CCC[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000161193191 1031388620 /nfs/dbraw/zinc/38/86/20/1031388620.db2.gz BCCADCHDJAMCSB-UHFFFAOYSA-N 1 1 338.791 3.713 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000475741218 1031720345 /nfs/dbraw/zinc/72/03/45/1031720345.db2.gz WHJUIDMUBJQCLR-UMVBOHGHSA-N 1 1 333.432 3.598 20 5 EHBDMO CC(C)(C)OC(=O)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343707088 1032029997 /nfs/dbraw/zinc/02/99/97/1032029997.db2.gz BDAVEUUHCMOLAM-UHFFFAOYSA-N 1 1 334.416 3.681 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CCC(C)CC1 ZINC000063482943 1033391029 /nfs/dbraw/zinc/39/10/29/1033391029.db2.gz VFIOWLNGBBEQOF-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC(=O)c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594597640 1033444333 /nfs/dbraw/zinc/44/43/33/1033444333.db2.gz DGOHZZQYLWFVPN-HOCLYGCPSA-N 1 1 331.416 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c2ccncc21 ZINC000594596691 1033444694 /nfs/dbraw/zinc/44/46/94/1033444694.db2.gz BEDQPNFWQPHNQO-AEFFLSMTSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1cc(OC)c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000593616155 1033455216 /nfs/dbraw/zinc/45/52/16/1033455216.db2.gz ZKHTUNVPUYTXIU-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO COc1cc(F)cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595025980 1033612804 /nfs/dbraw/zinc/61/28/04/1033612804.db2.gz LURBQKGZEQCXKH-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO COc1cccc(OC)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000595071644 1033647500 /nfs/dbraw/zinc/64/75/00/1033647500.db2.gz CFFLDFATDITLPK-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000595037741 1033658862 /nfs/dbraw/zinc/65/88/62/1033658862.db2.gz CFDYWXQKFAFKCC-CYBMUJFWSA-N 1 1 341.411 3.728 20 5 EHBDMO CC(C)(C)C(F)(F)C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000595108543 1033693196 /nfs/dbraw/zinc/69/31/96/1033693196.db2.gz SAZBNFFLLAVNBY-NWDGAFQWSA-N 1 1 330.379 3.546 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccccc2F)C2CC2)c1 ZINC000603661629 1033840206 /nfs/dbraw/zinc/84/02/06/1033840206.db2.gz JIAYFJCLKSIFJE-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566251 1033844012 /nfs/dbraw/zinc/84/40/12/1033844012.db2.gz NANYGQCVGMNVCQ-WHOFXGATSA-N 1 1 328.372 3.580 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCCCC2)CC1 ZINC000608833551 1033907799 /nfs/dbraw/zinc/90/77/99/1033907799.db2.gz PROREVMYUSLFKJ-HNNXBMFYSA-N 1 1 345.443 3.968 20 5 EHBDMO CC(C)C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)N(C)C ZINC000608835785 1033909194 /nfs/dbraw/zinc/90/91/94/1033909194.db2.gz QNRLKZIUBMCGNZ-HNNXBMFYSA-N 1 1 345.443 3.921 20 5 EHBDMO CC(C)(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000595603587 1033917687 /nfs/dbraw/zinc/91/76/87/1033917687.db2.gz YYPCEGFPGFYDAO-UHFFFAOYSA-N 1 1 347.440 3.896 20 5 EHBDMO CC(C)(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000595603587 1033917696 /nfs/dbraw/zinc/91/76/96/1033917696.db2.gz YYPCEGFPGFYDAO-UHFFFAOYSA-N 1 1 347.440 3.896 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000064029487 1033943673 /nfs/dbraw/zinc/94/36/73/1033943673.db2.gz YBTZWUBHBJVQQC-UHFFFAOYSA-N 1 1 331.441 3.677 20 5 EHBDMO Cc1cc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000603844875 1033969472 /nfs/dbraw/zinc/96/94/72/1033969472.db2.gz BQIBMXLQQAHNOA-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCCOc2ccccc2C)cc1[N+](=O)[O-] ZINC000603869881 1033997393 /nfs/dbraw/zinc/99/73/93/1033997393.db2.gz VOPNQOPVHDFRQG-UHFFFAOYSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NCC[NH+]1Cc2ccccc2C1 ZINC000596100043 1034060787 /nfs/dbraw/zinc/06/07/87/1034060787.db2.gz ZNMAAFKFJDIPQO-UHFFFAOYSA-N 1 1 333.338 3.960 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080910 1034074142 /nfs/dbraw/zinc/07/41/42/1034074142.db2.gz PMGOPXZSZYGHPK-ZDUSSCGKSA-N 1 1 342.399 3.813 20 5 EHBDMO O=[N+]([O-])c1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)ccc1C(F)(F)F ZINC000596109280 1034096764 /nfs/dbraw/zinc/09/67/64/1034096764.db2.gz UZRZZCIQECTQKX-JTQLQIEISA-N 1 1 340.305 3.721 20 5 EHBDMO COc1ccc2c(c1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000534102375 1034132256 /nfs/dbraw/zinc/13/22/56/1034132256.db2.gz DMRMEDMGGCUORY-UHFFFAOYSA-N 1 1 326.396 3.513 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598340 1034313806 /nfs/dbraw/zinc/31/38/06/1034313806.db2.gz LTKVHVUFAPNFPF-CQSZACIVSA-N 1 1 342.443 3.782 20 5 EHBDMO O=[N+]([O-])c1ccc(Nc2cccc(C[NH+]3CCOCC3)c2)c(Cl)c1 ZINC000604489044 1034397743 /nfs/dbraw/zinc/39/77/43/1034397743.db2.gz YLUTZYQZPAXZOH-UHFFFAOYSA-N 1 1 347.802 3.824 20 5 EHBDMO COc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278784034 1034537511 /nfs/dbraw/zinc/53/75/11/1034537511.db2.gz PXNZQQLAOGWYFS-UHFFFAOYSA-N 1 1 340.301 3.912 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000534656231 1034774024 /nfs/dbraw/zinc/77/40/24/1034774024.db2.gz GJXKOVSQRXOWKV-UHFFFAOYSA-N 1 1 345.443 3.910 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CN(C)C)c1ccc(Cl)cc1 ZINC000548991601 1035405511 /nfs/dbraw/zinc/40/55/11/1035405511.db2.gz KFOLMEAFDBFBQY-GOSISDBHSA-N 1 1 347.846 3.949 20 5 EHBDMO COc1cc2c(cc1OC)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000030673130 1035657210 /nfs/dbraw/zinc/65/72/10/1035657210.db2.gz RGHLVKGMYJEFOO-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000030673130 1035657219 /nfs/dbraw/zinc/65/72/19/1035657219.db2.gz RGHLVKGMYJEFOO-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595427883 1035683520 /nfs/dbraw/zinc/68/35/20/1035683520.db2.gz UFZUXOQNKPIBSC-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO C[C@@H]([N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000535085160 1035980503 /nfs/dbraw/zinc/98/05/03/1035980503.db2.gz KWUFRDWYTVQKBE-CYBMUJFWSA-N 1 1 330.432 3.862 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000780396958 1035994813 /nfs/dbraw/zinc/99/48/13/1035994813.db2.gz GRGGMFHENBNMTN-WIMDODNTSA-N 1 1 338.407 3.806 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687380 1036243094 /nfs/dbraw/zinc/24/30/94/1036243094.db2.gz JCIPZARFMLWMOV-BEFAXECRSA-N 1 1 328.412 3.938 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000492781986 1036285408 /nfs/dbraw/zinc/28/54/08/1036285408.db2.gz FKQURVNNTUZFHK-LPHOPBHVSA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000492781986 1036285425 /nfs/dbraw/zinc/28/54/25/1036285425.db2.gz FKQURVNNTUZFHK-LPHOPBHVSA-N 1 1 340.423 3.908 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492790615 1036296710 /nfs/dbraw/zinc/29/67/10/1036296710.db2.gz PWBFRBCHCJQKQF-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO CCOC(=O)c1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000589197472 1036302566 /nfs/dbraw/zinc/30/25/66/1036302566.db2.gz SUNRSBCNAASQSL-UHFFFAOYSA-N 1 1 346.383 3.778 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2c(F)cccc2OC)ccc1[N+](=O)[O-] ZINC000492938005 1036424070 /nfs/dbraw/zinc/42/40/70/1036424070.db2.gz WRVCRRKTYDYBPM-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736838 1036695176 /nfs/dbraw/zinc/69/51/76/1036695176.db2.gz LTXPSCIYHXSGDB-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000376448374 1036887463 /nfs/dbraw/zinc/88/74/63/1036887463.db2.gz MNAMAXKBEJQBJW-YVEFUNNKSA-N 1 1 346.456 3.734 20 5 EHBDMO C[C@@H]1C[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233797 1036957982 /nfs/dbraw/zinc/95/79/82/1036957982.db2.gz UYHZXTBHFAACFG-ZTNFWEORSA-N 1 1 339.439 3.757 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000542185221 1037145248 /nfs/dbraw/zinc/14/52/48/1037145248.db2.gz OCGKOWQRNATKOL-CFVMTHIKSA-N 1 1 334.416 3.623 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@H]3C3CC3)s2)cc1 ZINC000539818354 1037239518 /nfs/dbraw/zinc/23/95/18/1037239518.db2.gz XEPAFFHOCNSBKM-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO Cc1cnc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311041765 1037292111 /nfs/dbraw/zinc/29/21/11/1037292111.db2.gz SCHXWTPJEFZMGQ-KRWDZBQOSA-N 1 1 340.427 3.622 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899995 1037340911 /nfs/dbraw/zinc/34/09/11/1037340911.db2.gz MFHWOCCRKNSHRX-IAGOWNOFSA-N 1 1 332.444 3.967 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000181221524 1037465967 /nfs/dbraw/zinc/46/59/67/1037465967.db2.gz IJKPXZPNEPKPAR-KBXCAEBGSA-N 1 1 344.386 3.991 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(OC)cc2F)cc1[N+](=O)[O-] ZINC000540155645 1037630856 /nfs/dbraw/zinc/63/08/56/1037630856.db2.gz HANURBCHSIRVBX-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](CC)c2c(C)noc2C)ccc1[N+](=O)[O-] ZINC000491812127 1037701241 /nfs/dbraw/zinc/70/12/41/1037701241.db2.gz LJRLCRUWZMCEJV-AWEZNQCLSA-N 1 1 333.388 3.839 20 5 EHBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc2ccccc2c2cccnc12 ZINC000058299830 1037782377 /nfs/dbraw/zinc/78/23/77/1037782377.db2.gz WCDDTPNNRMXCRJ-PMACEKPBSA-N 1 1 345.446 3.745 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001225 1037852857 /nfs/dbraw/zinc/85/28/57/1037852857.db2.gz QDUSPZLMJZAXGZ-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001225 1037852877 /nfs/dbraw/zinc/85/28/77/1037852877.db2.gz QDUSPZLMJZAXGZ-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1O ZINC000290560830 1037900871 /nfs/dbraw/zinc/90/08/71/1037900871.db2.gz DOAKMCYLKZMDEU-SNVBAGLBSA-N 1 1 336.775 3.813 20 5 EHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)s1 ZINC000058563104 1038123330 /nfs/dbraw/zinc/12/33/30/1038123330.db2.gz FZYSHGPDJQHTKU-UHFFFAOYSA-N 1 1 326.805 3.821 20 5 EHBDMO CC(C)[N@@H+](CC[S@@](=O)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000104676588 1038452407 /nfs/dbraw/zinc/45/24/07/1038452407.db2.gz DKOCPHKWANFKDK-DEOSSOPVSA-N 1 1 346.452 3.613 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664981 1038500333 /nfs/dbraw/zinc/50/03/33/1038500333.db2.gz ZNQXUGZVSLMRKT-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664981 1038500338 /nfs/dbraw/zinc/50/03/38/1038500338.db2.gz ZNQXUGZVSLMRKT-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000538760041 1038509454 /nfs/dbraw/zinc/50/94/54/1038509454.db2.gz NPJDZVPOWSSHTC-CABCVRRESA-N 1 1 347.459 3.513 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000538760043 1038509865 /nfs/dbraw/zinc/50/98/65/1038509865.db2.gz NPJDZVPOWSSHTC-HUUCEWRRSA-N 1 1 347.459 3.513 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](CO)C(C)(C)C ZINC000538761417 1038527743 /nfs/dbraw/zinc/52/77/43/1038527743.db2.gz CKRRLLBQEGUPER-QGZVFWFLSA-N 1 1 332.400 3.694 20 5 EHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036465 1039139957 /nfs/dbraw/zinc/13/99/57/1039139957.db2.gz KXFXPUSGZAADQS-MAUKXSAKSA-N 1 1 328.416 3.573 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000432792487 1039200273 /nfs/dbraw/zinc/20/02/73/1039200273.db2.gz KSSZKMMHOLJZOM-XNTDXEJSSA-N 1 1 340.427 3.663 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000432792487 1039200292 /nfs/dbraw/zinc/20/02/92/1039200292.db2.gz KSSZKMMHOLJZOM-XNTDXEJSSA-N 1 1 340.427 3.663 20 5 EHBDMO CC(C)CC[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001167905015 1039379956 /nfs/dbraw/zinc/37/99/56/1039379956.db2.gz PUNSRPWNFBMKGH-QGZVFWFLSA-N 1 1 347.459 3.848 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328257 1039672456 /nfs/dbraw/zinc/67/24/56/1039672456.db2.gz SFFPXTDINIHVMQ-FRQCXROJSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328257 1039672459 /nfs/dbraw/zinc/67/24/59/1039672459.db2.gz SFFPXTDINIHVMQ-FRQCXROJSA-N 1 1 329.444 3.579 20 5 EHBDMO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000028955118 1039963980 /nfs/dbraw/zinc/96/39/80/1039963980.db2.gz AMIGMDLRQCOUHM-GFCCVEGCSA-N 1 1 347.802 3.562 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000554945284 1039968512 /nfs/dbraw/zinc/96/85/12/1039968512.db2.gz GQADKLUSSFVRDP-DOTOQJQBSA-N 1 1 337.423 3.793 20 5 EHBDMO CC(=O)c1cc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331062 1039979533 /nfs/dbraw/zinc/97/95/33/1039979533.db2.gz RZPZBRPFCIUQGS-MJBXVCDLSA-N 1 1 333.432 3.576 20 5 EHBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000312630299 1040361908 /nfs/dbraw/zinc/36/19/08/1040361908.db2.gz BYSFQLAGVYGVGM-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1ccoc1C[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000312630299 1040361922 /nfs/dbraw/zinc/36/19/22/1040361922.db2.gz BYSFQLAGVYGVGM-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000490561519 1040609759 /nfs/dbraw/zinc/60/97/59/1040609759.db2.gz CWMUWJBJNFWWQQ-SFHVURJKSA-N 1 1 344.386 3.568 20 5 EHBDMO COc1ccc(OC)c(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000027602550 1040712851 /nfs/dbraw/zinc/71/28/51/1040712851.db2.gz ZOGHKBKVFDJTQE-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(OC)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000027602550 1040712870 /nfs/dbraw/zinc/71/28/70/1040712870.db2.gz ZOGHKBKVFDJTQE-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117771 1040795165 /nfs/dbraw/zinc/79/51/65/1040795165.db2.gz VHERSKVWRWYSJO-INIZCTEOSA-N 1 1 331.416 3.639 20 5 EHBDMO CCC[N@@H+]1CC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173351 1040994100 /nfs/dbraw/zinc/99/41/00/1040994100.db2.gz GHBAZFJDXQENIC-RDTXWAMCSA-N 1 1 331.460 3.639 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173351 1040994127 /nfs/dbraw/zinc/99/41/27/1040994127.db2.gz GHBAZFJDXQENIC-RDTXWAMCSA-N 1 1 331.460 3.639 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCCO1 ZINC000511662217 1041372283 /nfs/dbraw/zinc/37/22/83/1041372283.db2.gz ANWYRJLWUGDZLD-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCOCC1 ZINC000123973278 1042072958 /nfs/dbraw/zinc/07/29/58/1042072958.db2.gz PMTXZYYIBKTRQM-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000278918990 1042949517 /nfs/dbraw/zinc/94/95/17/1042949517.db2.gz TVYNASBWNRCXJT-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO CC[C@]1(C)CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344220445 1043454628 /nfs/dbraw/zinc/45/46/28/1043454628.db2.gz QPMWGMOFQPASDK-SJKOYZFVSA-N 1 1 330.388 3.828 20 5 EHBDMO Cc1ccc(CN2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609962 /nfs/dbraw/zinc/60/99/62/1043609962.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 1 1 345.487 3.990 20 5 EHBDMO CC[C@H]1c2ccsc2CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930164 1044512736 /nfs/dbraw/zinc/51/27/36/1044512736.db2.gz RYHYJPWCHHMWNE-HOTGVXAUSA-N 1 1 332.425 3.699 20 5 EHBDMO C[N@@H+](CCc1ccncc1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183758036 1125773285 /nfs/dbraw/zinc/77/32/85/1125773285.db2.gz JGBRYDDEJPPGSR-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4ccccc4F)C3)nc2c1 ZINC000083171048 1127220539 /nfs/dbraw/zinc/22/05/39/1127220539.db2.gz XTQUCXWIULSMCC-GFCCVEGCSA-N 1 1 341.342 3.865 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438417 1127744041 /nfs/dbraw/zinc/74/40/41/1127744041.db2.gz HRVTZKZLNKTKDS-OLZOCXBDSA-N 1 1 337.420 3.501 20 5 EHBDMO Cc1cc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000301427760 1127873741 /nfs/dbraw/zinc/87/37/41/1127873741.db2.gz IHNLBXWKZGOINZ-CXAGYDPISA-N 1 1 346.456 3.855 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571444 1128104993 /nfs/dbraw/zinc/10/49/93/1128104993.db2.gz REQQJRMIDGTPNJ-GHMZBOCLSA-N 1 1 344.358 3.683 20 5 EHBDMO CS(=O)(=O)[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000282256052 1128132815 /nfs/dbraw/zinc/13/28/15/1128132815.db2.gz BMRGFSQXPPQGAM-KRWDZBQOSA-N 1 1 339.460 3.612 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478250 1131242262 /nfs/dbraw/zinc/24/22/62/1131242262.db2.gz XXRKYODHZIPQDE-YOEHRIQHSA-N 1 1 336.395 3.780 20 5 EHBDMO COCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccco1 ZINC000273305468 1128481881 /nfs/dbraw/zinc/48/18/81/1128481881.db2.gz SLKHNMQHCYOENJ-INIZCTEOSA-N 1 1 348.399 3.842 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301572545 1128499272 /nfs/dbraw/zinc/49/92/72/1128499272.db2.gz YSJKTOHZIMEZHZ-WBVHZDCISA-N 1 1 340.427 3.763 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CCCC[N@@H+]2CC)cc1[N+](=O)[O-] ZINC000153723462 1128655119 /nfs/dbraw/zinc/65/51/19/1128655119.db2.gz JAKUJWWHJAJSBM-GOEBONIOSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000153723462 1128655121 /nfs/dbraw/zinc/65/51/21/1128655121.db2.gz JAKUJWWHJAJSBM-GOEBONIOSA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1nc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651013 1128845887 /nfs/dbraw/zinc/84/58/87/1128845887.db2.gz JUODLXGCXRDQAN-SUMWQHHRSA-N 1 1 346.456 3.855 20 5 EHBDMO C[N@H+]1CC=C(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987435 1120923866 /nfs/dbraw/zinc/92/38/66/1120923866.db2.gz JGRYGNRJCFJAQX-FQEVSTJZSA-N 1 1 337.423 3.536 20 5 EHBDMO C[N@@H+]1CC=C(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987435 1120923868 /nfs/dbraw/zinc/92/38/68/1120923868.db2.gz JGRYGNRJCFJAQX-FQEVSTJZSA-N 1 1 337.423 3.536 20 5 EHBDMO CC(C)C[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)CC(C)(C)C ZINC000761831761 1120975852 /nfs/dbraw/zinc/97/58/52/1120975852.db2.gz OIWBQUZXZLZIMY-UHFFFAOYSA-N 1 1 347.257 3.515 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957921 1128959527 /nfs/dbraw/zinc/95/95/27/1128959527.db2.gz GEXGWCMCZKGRGG-SJLPKXTDSA-N 1 1 345.830 3.783 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000064808224 1128964898 /nfs/dbraw/zinc/96/48/98/1128964898.db2.gz FHEJZPQPHJFNCB-QWHCGFSZSA-N 1 1 334.416 3.860 20 5 EHBDMO C[C@H](CCSc1ccccc1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000495475336 1121226179 /nfs/dbraw/zinc/22/61/79/1121226179.db2.gz JQKYMYIMASFFAX-CQSZACIVSA-N 1 1 343.452 3.919 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000301114170 1121971182 /nfs/dbraw/zinc/97/11/82/1121971182.db2.gz XRGAEURAAQEEDJ-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151321 1122081494 /nfs/dbraw/zinc/08/14/94/1122081494.db2.gz FMJMCTOXEQPZBL-UONOGXRCSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151321 1122081498 /nfs/dbraw/zinc/08/14/98/1122081498.db2.gz FMJMCTOXEQPZBL-UONOGXRCSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000917073205 1122478169 /nfs/dbraw/zinc/47/81/69/1122478169.db2.gz ITROXJYTLRLKGM-CYBMUJFWSA-N 1 1 336.392 3.570 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](CCc2ccccc2)C(F)F)cc1 ZINC000497812991 1122670609 /nfs/dbraw/zinc/67/06/09/1122670609.db2.gz PGTWVYUZDYJAGR-KRWDZBQOSA-N 1 1 334.366 3.993 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672479 1123636736 /nfs/dbraw/zinc/63/67/36/1123636736.db2.gz CGFYWZZDTLYOOJ-WBVHZDCISA-N 1 1 326.396 3.852 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610002121 1123711475 /nfs/dbraw/zinc/71/14/75/1123711475.db2.gz DTJXHZWCKXIZBQ-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610002121 1123711476 /nfs/dbraw/zinc/71/14/76/1123711476.db2.gz DTJXHZWCKXIZBQ-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnn(-c3ccccc3)c2)C2CC2)c1 ZINC000195677115 1123734421 /nfs/dbraw/zinc/73/44/21/1123734421.db2.gz BURLZUJMUJYGTK-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnn(-c3ccccc3)c2)C2CC2)c1 ZINC000195677115 1123734424 /nfs/dbraw/zinc/73/44/24/1123734424.db2.gz BURLZUJMUJYGTK-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550628 1125106539 /nfs/dbraw/zinc/10/65/39/1125106539.db2.gz LPNFHXVSOTUMAN-KRWDZBQOSA-N 1 1 333.388 3.517 20 5 EHBDMO CC(C)Oc1ncccc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618565249 1125113922 /nfs/dbraw/zinc/11/39/22/1125113922.db2.gz KUGGFGCFJIGUQM-GOSISDBHSA-N 1 1 341.411 3.944 20 5 EHBDMO Cn1nc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c2ccccc21 ZINC000618575517 1125121174 /nfs/dbraw/zinc/12/11/74/1125121174.db2.gz KOBFOHPFPBGZJH-QGZVFWFLSA-N 1 1 336.395 3.649 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2C1 ZINC000066514146 1129179249 /nfs/dbraw/zinc/17/92/49/1129179249.db2.gz WTRUWLMHBGNFAC-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2C1 ZINC000066514146 1129179254 /nfs/dbraw/zinc/17/92/54/1129179254.db2.gz WTRUWLMHBGNFAC-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO O=C(C[N@@H+]1CCCC2(CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000533302986 1129468730 /nfs/dbraw/zinc/46/87/30/1129468730.db2.gz KKZKEDJEWRJCJT-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO O=C(C[N@H+]1CCCC2(CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000533302986 1129468735 /nfs/dbraw/zinc/46/87/35/1129468735.db2.gz KKZKEDJEWRJCJT-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000466488076 1129489589 /nfs/dbraw/zinc/48/95/89/1129489589.db2.gz GOVSWUWMHVMYIY-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000922467449 1129543136 /nfs/dbraw/zinc/54/31/36/1129543136.db2.gz USOVWECRPSZZTH-UHFFFAOYSA-N 1 1 341.411 3.557 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000092586113 1129552878 /nfs/dbraw/zinc/55/28/78/1129552878.db2.gz FUCPPIXUMHSNHS-AWEZNQCLSA-N 1 1 328.416 3.617 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000509030916 1129671945 /nfs/dbraw/zinc/67/19/45/1129671945.db2.gz KLWISOUNMUSEMC-FZKQIMNGSA-N 1 1 348.349 3.740 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000125235815 1129672615 /nfs/dbraw/zinc/67/26/15/1129672615.db2.gz QCRDQFUORISOLM-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433875 1129691755 /nfs/dbraw/zinc/69/17/55/1129691755.db2.gz FOXKSGOKCFWXCY-STQMWFEESA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)CN1CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000131161467 1129772243 /nfs/dbraw/zinc/77/22/43/1129772243.db2.gz PQOMULFKNAERLX-LJQANCHMSA-N 1 1 345.487 3.626 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148174 1129854284 /nfs/dbraw/zinc/85/42/84/1129854284.db2.gz AQAATKKWPNKYRV-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000174035567 1130331927 /nfs/dbraw/zinc/33/19/27/1130331927.db2.gz VWUMAMSIEOMUAZ-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO CC(C)CN(CC(C)C)C(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429252504 1130375532 /nfs/dbraw/zinc/37/55/32/1130375532.db2.gz FXKDSFAEMVIYAT-UHFFFAOYSA-N 1 1 349.475 3.560 20 5 EHBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000741250978 1131587857 /nfs/dbraw/zinc/58/78/57/1131587857.db2.gz LFOAQACTZCZIIO-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000741250978 1131587863 /nfs/dbraw/zinc/58/78/63/1131587863.db2.gz LFOAQACTZCZIIO-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO O=C1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@H]12 ZINC001172908403 1131887973 /nfs/dbraw/zinc/88/79/73/1131887973.db2.gz MDOITLZGSHBJDY-NZSAHSFTSA-N 1 1 342.439 3.676 20 5 EHBDMO CCCCC[NH+]1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172916523 1131903991 /nfs/dbraw/zinc/90/39/91/1131903991.db2.gz TWIYJNDBZKITQD-LJQANCHMSA-N 1 1 345.487 3.650 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCOC3(CCCCC3)C1)CC2 ZINC001172919222 1131904401 /nfs/dbraw/zinc/90/44/01/1131904401.db2.gz FJECSIYOXIKXDK-SFHVURJKSA-N 1 1 344.455 3.877 20 5 EHBDMO CC(C)(C)OC(=O)C(C)(C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912755 1131918214 /nfs/dbraw/zinc/91/82/14/1131918214.db2.gz PBYUDELMEPWWBN-HNNXBMFYSA-N 1 1 348.443 3.552 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2ccc(C)nc2)c1F ZINC001173191200 1131995050 /nfs/dbraw/zinc/99/50/50/1131995050.db2.gz BACCWDNJIGCXIZ-CYBMUJFWSA-N 1 1 347.390 3.509 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC001173228360 1132008173 /nfs/dbraw/zinc/00/81/73/1132008173.db2.gz VJHBAQMLCJXIRD-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO CC(=O)c1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173231868 1132008923 /nfs/dbraw/zinc/00/89/23/1132008923.db2.gz OGESFUWMELSUMT-CQSZACIVSA-N 1 1 338.407 3.787 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1nc2ccccc2o1 ZINC001173231720 1132009500 /nfs/dbraw/zinc/00/95/00/1132009500.db2.gz CMKYGZACFCBLNC-CYBMUJFWSA-N 1 1 325.368 3.799 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)c1ccccc1 ZINC001173233723 1132010713 /nfs/dbraw/zinc/01/07/13/1132010713.db2.gz MRTTYXRRNXWJFX-HNNXBMFYSA-N 1 1 326.396 3.731 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173233668 1132010862 /nfs/dbraw/zinc/01/08/62/1132010862.db2.gz XWPUUVUEXUNBAF-OAHLLOKOSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009705 1132631412 /nfs/dbraw/zinc/63/14/12/1132631412.db2.gz XHOMEXLSPXELQL-RTBURBONSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@]3(CCc4c3cccc4F)C2)C1 ZINC001169051290 1132643268 /nfs/dbraw/zinc/64/32/68/1132643268.db2.gz CTWPQZDOQGJCSE-SPYBWZPUSA-N 1 1 332.419 3.551 20 5 EHBDMO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001175992684 1132809242 /nfs/dbraw/zinc/80/92/42/1132809242.db2.gz VILHWXVMNMVHBJ-LLVKDONJSA-N 1 1 328.347 3.769 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001176200437 1132888018 /nfs/dbraw/zinc/88/80/18/1132888018.db2.gz BSMFDRVJDKJRSR-HZMBPMFUSA-N 1 1 332.297 3.898 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001176200437 1132888027 /nfs/dbraw/zinc/88/80/27/1132888027.db2.gz BSMFDRVJDKJRSR-HZMBPMFUSA-N 1 1 332.297 3.898 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762597 1133048970 /nfs/dbraw/zinc/04/89/70/1133048970.db2.gz IZLCKWBJZUCAEW-MLGOLLRUSA-N 1 1 331.420 3.506 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765173 1133050617 /nfs/dbraw/zinc/05/06/17/1133050617.db2.gz KHOHLPBIUORPEB-ZBFHGGJFSA-N 1 1 343.431 3.711 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940065 1133073779 /nfs/dbraw/zinc/07/37/79/1133073779.db2.gz DHCLZEZKMKUSKX-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1Cl ZINC000773700957 1133090514 /nfs/dbraw/zinc/09/05/14/1133090514.db2.gz LGFDFAWLESGVEF-ZFWWWQNUSA-N 1 1 338.835 3.887 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C/C=C/c2ccc(F)cc2)CC1 ZINC001180497392 1133385425 /nfs/dbraw/zinc/38/54/25/1133385425.db2.gz IPNQRYPEBLNUEQ-ONEGZZNKSA-N 1 1 341.386 3.569 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@H+]1CCCC[C@H]1C ZINC001184856825 1133999154 /nfs/dbraw/zinc/99/91/54/1133999154.db2.gz MTYGYMMSRLNJFS-ZIAGYGMSSA-N 1 1 328.416 3.818 20 5 EHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774909427 1134116646 /nfs/dbraw/zinc/11/66/46/1134116646.db2.gz PZNCGOMEIYOVGD-GOSISDBHSA-N 1 1 341.367 3.667 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352938 1134754243 /nfs/dbraw/zinc/75/42/43/1134754243.db2.gz UXLQYHAPMPFGMH-LBPRGKRZSA-N 1 1 349.818 3.715 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000793617790 1134973689 /nfs/dbraw/zinc/97/36/89/1134973689.db2.gz SJJYBPHZGGRKIO-UONOGXRCSA-N 1 1 329.227 3.919 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199955 1134978592 /nfs/dbraw/zinc/97/85/92/1134978592.db2.gz PXVCSAZDSWHBLK-HOTGVXAUSA-N 1 1 347.459 3.988 20 5 EHBDMO Cc1cccc(C)c1C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(C)C ZINC001195428779 1135428250 /nfs/dbraw/zinc/42/82/50/1135428250.db2.gz YUIRZDYXTUIXBK-UHFFFAOYSA-N 1 1 330.432 3.566 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC001197284443 1135672835 /nfs/dbraw/zinc/67/28/35/1135672835.db2.gz JGTZNBHWWQEXDY-GOSISDBHSA-N 1 1 332.444 3.932 20 5 EHBDMO CCC(CC)[C@@H](CNC/C(C)=C\c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC001199170656 1135884773 /nfs/dbraw/zinc/88/47/73/1135884773.db2.gz LZCHRVRIPWXFKP-ILCZHQDMSA-N 1 1 333.476 3.954 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274470 1136129505 /nfs/dbraw/zinc/12/95/05/1136129505.db2.gz DHHTXZGLEQQZPK-SJKOYZFVSA-N 1 1 334.803 3.975 20 5 EHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812854328 1136262933 /nfs/dbraw/zinc/26/29/33/1136262933.db2.gz XEZHGCFAYGZBHH-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812854326 1136262967 /nfs/dbraw/zinc/26/29/67/1136262967.db2.gz XEZHGCFAYGZBHH-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000851832827 1136411854 /nfs/dbraw/zinc/41/18/54/1136411854.db2.gz DXRBVBHQSGKEDX-MJGOQNOKSA-N 1 1 344.386 3.822 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586087 1136445443 /nfs/dbraw/zinc/44/54/43/1136445443.db2.gz JLVZGAKNDBVMJS-UYAOXDASSA-N 1 1 342.439 3.971 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587638 1136447770 /nfs/dbraw/zinc/44/77/70/1136447770.db2.gz XPPZBTKYBXIYEC-VOJFVSQTSA-N 1 1 348.349 3.526 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587638 1136447772 /nfs/dbraw/zinc/44/77/72/1136447772.db2.gz XPPZBTKYBXIYEC-VOJFVSQTSA-N 1 1 348.349 3.526 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852779703 1136485791 /nfs/dbraw/zinc/48/57/91/1136485791.db2.gz CADPINKTIDTYIC-LBPRGKRZSA-N 1 1 330.359 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@H](c1ccccc1)C1(CO)CCC1 ZINC000814666767 1136491652 /nfs/dbraw/zinc/49/16/52/1136491652.db2.gz HWYSHHFJGDQVES-GOSISDBHSA-N 1 1 344.386 3.727 20 5 EHBDMO 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345.418 3.955 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000066514673 1138075561 /nfs/dbraw/zinc/07/55/61/1138075561.db2.gz CEZHWGWBMAKEQI-UHFFFAOYSA-N 1 1 325.368 3.573 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000066514673 1138075564 /nfs/dbraw/zinc/07/55/64/1138075564.db2.gz CEZHWGWBMAKEQI-UHFFFAOYSA-N 1 1 325.368 3.573 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3C3CCCC3)o2)cc1 ZINC000079393821 1138155710 /nfs/dbraw/zinc/15/57/10/1138155710.db2.gz VQRIOEBHDTUPQW-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091413795 1138219439 /nfs/dbraw/zinc/21/94/39/1138219439.db2.gz UBSCZOBBSNQOFO-GTNSWQLSSA-N 1 1 336.338 3.911 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000091957889 1138223432 /nfs/dbraw/zinc/22/34/32/1138223432.db2.gz VRBOJDGOILLOBB-BMTPJICMSA-N 1 1 342.395 3.789 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300683 1138467793 /nfs/dbraw/zinc/46/77/93/1138467793.db2.gz VLPWEPZQMFZOPV-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000130909122 1138483621 /nfs/dbraw/zinc/48/36/21/1138483621.db2.gz UORRYHQCHVQFPW-HNNXBMFYSA-N 1 1 346.383 3.680 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000130909122 1138483623 /nfs/dbraw/zinc/48/36/23/1138483623.db2.gz UORRYHQCHVQFPW-HNNXBMFYSA-N 1 1 346.383 3.680 20 5 EHBDMO CC1CCC([N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000337344139 1138539634 /nfs/dbraw/zinc/53/96/34/1138539634.db2.gz YPHWSCZUTWERQF-UHFFFAOYSA-N 1 1 345.443 3.967 20 5 EHBDMO CCCn1nccc1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000337355968 1138542404 /nfs/dbraw/zinc/54/24/04/1138542404.db2.gz DZXWFCUPGWWDFQ-UHFFFAOYSA-N 1 1 334.445 3.642 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552518 1140701575 /nfs/dbraw/zinc/70/15/75/1140701575.db2.gz UYUQMSWONFHLRB-KBPBESRZSA-N 1 1 349.431 3.502 20 5 EHBDMO CC(C)(C)C1=CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000270403456 1141218560 /nfs/dbraw/zinc/21/85/60/1141218560.db2.gz VQBNFCGUVTYHOZ-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000270403456 1141218564 /nfs/dbraw/zinc/21/85/64/1141218564.db2.gz VQBNFCGUVTYHOZ-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO Cc1nc(CC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 ZINC000270959697 1141287577 /nfs/dbraw/zinc/28/75/77/1141287577.db2.gz ANORZKQVIXLRQC-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO Cc1nc(CC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 ZINC000270959697 1141287583 /nfs/dbraw/zinc/28/75/83/1141287583.db2.gz ANORZKQVIXLRQC-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cn3ccsc3n2)cc1[N+](=O)[O-] ZINC000271021021 1141295128 /nfs/dbraw/zinc/29/51/28/1141295128.db2.gz AOPTYVBQBCTUAB-NSHDSACASA-N 1 1 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C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115118 1141501652 /nfs/dbraw/zinc/50/16/52/1141501652.db2.gz YVOZLVAZHHZQKL-JRPNMDOOSA-N 1 1 346.349 3.595 20 5 EHBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115118 1141501654 /nfs/dbraw/zinc/50/16/54/1141501654.db2.gz YVOZLVAZHHZQKL-JRPNMDOOSA-N 1 1 346.349 3.595 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000052244791 214122730 /nfs/dbraw/zinc/12/27/30/214122730.db2.gz OPIZTFNMWWDMJT-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(Br)o1 ZINC000183257262 1125484479 /nfs/dbraw/zinc/48/44/79/1125484479.db2.gz MJNZXMKDVACKEW-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(Br)o1 ZINC000183257262 1125484483 /nfs/dbraw/zinc/48/44/83/1125484483.db2.gz MJNZXMKDVACKEW-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1c1cccn1C ZINC000430235055 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Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@H]1/C=C\c1cccs1 ZINC000611941714 1027659064 /nfs/dbraw/zinc/65/90/64/1027659064.db2.gz YAGWWDYIMCLDAF-CKXPSTMWSA-N 1 1 346.456 3.848 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@H]1/C=C\c1cccs1 ZINC000611941714 1027659068 /nfs/dbraw/zinc/65/90/68/1027659068.db2.gz YAGWWDYIMCLDAF-CKXPSTMWSA-N 1 1 346.456 3.848 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])nc2)[C@@H]1c1cccs1 ZINC000078338381 1027687530 /nfs/dbraw/zinc/68/75/30/1027687530.db2.gz GYEKCLVOWOOUOJ-MLGOLLRUSA-N 1 1 332.429 3.546 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCCC1 ZINC000533398449 1027770129 /nfs/dbraw/zinc/77/01/29/1027770129.db2.gz QIVBLYKMLMNCBN-NSHDSACASA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000366725331 1027849833 /nfs/dbraw/zinc/84/98/33/1027849833.db2.gz WMYDHSMIEBZJGX-KUHUBIRLSA-N 1 1 336.395 3.769 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503584015 1027944916 /nfs/dbraw/zinc/94/49/16/1027944916.db2.gz YLQLJEHWJBCETK-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1c(CN2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512144 1027997097 /nfs/dbraw/zinc/99/70/97/1027997097.db2.gz MNPPQENNCPBYRU-RVKKMQEKSA-N 1 1 331.460 3.740 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000532692535 1028150087 /nfs/dbraw/zinc/15/00/87/1028150087.db2.gz QEGNJEDJESOSNW-UHFFFAOYSA-N 1 1 333.432 3.601 20 5 EHBDMO C[C@H](NC[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202079 1028270834 /nfs/dbraw/zinc/27/08/34/1028270834.db2.gz ALHMPRDMDCBAIC-KBPBESRZSA-N 1 1 345.468 3.974 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H](O)CC23CCC3)o1 ZINC000421374434 1028335303 /nfs/dbraw/zinc/33/53/03/1028335303.db2.gz OVIMUFAWPGFSMK-AWEZNQCLSA-N 1 1 342.395 3.734 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C[NH3+])C1CCCC1 ZINC000423504702 1028468975 /nfs/dbraw/zinc/46/89/75/1028468975.db2.gz NUHVEZGIOZDESX-HUUCEWRRSA-N 1 1 337.489 3.573 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(F)c3cccnc13)CC2 ZINC000088607997 1028593328 /nfs/dbraw/zinc/59/33/28/1028593328.db2.gz HVRAWZIGZVUKRV-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(F)c3cccnc13)CC2 ZINC000088607997 1028593333 /nfs/dbraw/zinc/59/33/33/1028593333.db2.gz HVRAWZIGZVUKRV-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000008173493 1028706877 /nfs/dbraw/zinc/70/68/77/1028706877.db2.gz BITFAONHKSXJDI-GFCCVEGCSA-N 1 1 347.802 3.846 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903859 1028831781 /nfs/dbraw/zinc/83/17/81/1028831781.db2.gz TWJLSMGOTFYMHD-INIZCTEOSA-N 1 1 333.432 3.864 20 5 EHBDMO C[C@H]1CC[C@@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592997 1028884235 /nfs/dbraw/zinc/88/42/35/1028884235.db2.gz RHUGFYJFCTXPGQ-DZGCQCFKSA-N 1 1 329.400 3.913 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000445578102 1028960678 /nfs/dbraw/zinc/96/06/78/1028960678.db2.gz CAZVVFBVMJSPQZ-AWEZNQCLSA-N 1 1 329.400 3.808 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000533248715 1029526550 /nfs/dbraw/zinc/52/65/50/1029526550.db2.gz MLFHECFMTIZLJF-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285233 1029574050 /nfs/dbraw/zinc/57/40/50/1029574050.db2.gz XUAKTXAIKNBLPT-TZMCWYRMSA-N 1 1 333.432 3.741 20 5 EHBDMO COc1cc(C[N@@H+](C)CCC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000052246212 1029598596 /nfs/dbraw/zinc/59/85/96/1029598596.db2.gz UQPINWWJAPDXMU-UHFFFAOYSA-N 1 1 332.347 3.683 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000441189705 1029896967 /nfs/dbraw/zinc/89/69/67/1029896967.db2.gz PRTCXMUPKCZAAI-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000481763712 1029927811 /nfs/dbraw/zinc/92/78/11/1029927811.db2.gz ONNGHFDZOMRNFU-JQWIXIFHSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000481763712 1029927834 /nfs/dbraw/zinc/92/78/34/1029927834.db2.gz ONNGHFDZOMRNFU-JQWIXIFHSA-N 1 1 332.322 3.766 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159528306 1030252341 /nfs/dbraw/zinc/25/23/41/1030252341.db2.gz JKIJQJDKYDPRQV-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ncccc2F)CC1 ZINC000278378090 1030487307 /nfs/dbraw/zinc/48/73/07/1030487307.db2.gz UCQRYCFTWNQFDF-CYBMUJFWSA-N 1 1 345.374 3.733 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441295807 1030534468 /nfs/dbraw/zinc/53/44/68/1030534468.db2.gz UATQVSYPTUBEPB-HZPDHXFCSA-N 1 1 348.443 3.631 20 5 EHBDMO CC[C@@H](N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807241 1031343217 /nfs/dbraw/zinc/34/32/17/1031343217.db2.gz LZSWMABKDKUVPZ-PKOBYXMFSA-N 1 1 331.460 3.900 20 5 EHBDMO CC[C@@H]([NH2+][C@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807241 1031343235 /nfs/dbraw/zinc/34/32/35/1031343235.db2.gz LZSWMABKDKUVPZ-PKOBYXMFSA-N 1 1 331.460 3.900 20 5 EHBDMO C[N@H+]1CC[C@H](Cc2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000904132215 1031770505 /nfs/dbraw/zinc/77/05/05/1031770505.db2.gz UQACGJSBJWXRBV-CQSZACIVSA-N 1 1 344.418 3.932 20 5 EHBDMO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594522405 1033431732 /nfs/dbraw/zinc/43/17/32/1033431732.db2.gz LGXPWCOLLGVUPP-VDYXNGCNSA-N 1 1 328.343 3.833 20 5 EHBDMO CN(C(=O)C[N@@H+](CC1CCCCC1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000059409402 1033611385 /nfs/dbraw/zinc/61/13/85/1033611385.db2.gz ITHYYFMXJXPWKX-UHFFFAOYSA-N 1 1 345.443 3.602 20 5 EHBDMO COc1ccccc1[C@H]1CC[C@H](C)C[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489416 1033811148 /nfs/dbraw/zinc/81/11/48/1033811148.db2.gz AOOSWTLCHFVISH-SWLSCSKDSA-N 1 1 345.399 3.873 20 5 EHBDMO COc1ccccc1[C@H]1CC[C@H](C)C[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489416 1033811157 /nfs/dbraw/zinc/81/11/57/1033811157.db2.gz AOOSWTLCHFVISH-SWLSCSKDSA-N 1 1 345.399 3.873 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000603851030 1033977364 /nfs/dbraw/zinc/97/73/64/1033977364.db2.gz ZZOKANZMALHESG-UHFFFAOYSA-N 1 1 339.439 3.924 20 5 EHBDMO COc1cc(C[NH2+][C@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])cc1F ZINC000599573438 1034019005 /nfs/dbraw/zinc/01/90/05/1034019005.db2.gz HWYGZRPDDBOXRW-SFHVURJKSA-N 1 1 345.374 3.769 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599573584 1034020348 /nfs/dbraw/zinc/02/03/48/1034020348.db2.gz ISLQCSXNNJNOSQ-GOSISDBHSA-N 1 1 327.384 3.629 20 5 EHBDMO C[C@H]1CC[N@@H+](CCN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610447 1034070129 /nfs/dbraw/zinc/07/01/29/1034070129.db2.gz MAWXHWOMPSNDJR-JXFKEZNVSA-N 1 1 339.439 3.616 20 5 EHBDMO C[C@H]1CCN(CC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610447 1034070142 /nfs/dbraw/zinc/07/01/42/1034070142.db2.gz MAWXHWOMPSNDJR-JXFKEZNVSA-N 1 1 339.439 3.616 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599676918 1034082673 /nfs/dbraw/zinc/08/26/73/1034082673.db2.gz FTUCXCFPFOQAFZ-INIZCTEOSA-N 1 1 344.386 3.775 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691143 1034094026 /nfs/dbraw/zinc/09/40/26/1034094026.db2.gz QSLZBPZLRWGHBB-HSWBROFVSA-N 1 1 342.399 3.823 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCOC4(CCCC4)C3)o2)c1 ZINC000537615366 1034151552 /nfs/dbraw/zinc/15/15/52/1034151552.db2.gz FBKXPSBMTKINRV-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOC4(CCCC4)C3)o2)c1 ZINC000537615366 1034151556 /nfs/dbraw/zinc/15/15/56/1034151556.db2.gz FBKXPSBMTKINRV-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO CCC[C@@H]([NH2+]Cc1c(CC)nn(C)c1OC)c1cccc([N+](=O)[O-])c1 ZINC000089212677 1034269446 /nfs/dbraw/zinc/26/94/46/1034269446.db2.gz PEQMUKVAOACHJU-QGZVFWFLSA-N 1 1 346.431 3.530 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000179394950 1034277216 /nfs/dbraw/zinc/27/72/16/1034277216.db2.gz WZHXLBPFUMNNSY-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000179442157 1034306732 /nfs/dbraw/zinc/30/67/32/1034306732.db2.gz PXYPYLHOKIKYRB-LJQANCHMSA-N 1 1 344.386 3.507 20 5 EHBDMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000604492954 1034400039 /nfs/dbraw/zinc/40/00/39/1034400039.db2.gz IWWJEPZHLOTHSS-UHFFFAOYSA-N 1 1 345.374 3.585 20 5 EHBDMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000604492954 1034400056 /nfs/dbraw/zinc/40/00/56/1034400056.db2.gz IWWJEPZHLOTHSS-UHFFFAOYSA-N 1 1 345.374 3.585 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1=CCCOC1 ZINC000597205017 1034609034 /nfs/dbraw/zinc/60/90/34/1034609034.db2.gz BZNXCJCKHAMUMN-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000597225034 1034625087 /nfs/dbraw/zinc/62/50/87/1034625087.db2.gz LXIGQLRSVOSRPP-JZJRWUJFSA-N 1 1 330.428 3.889 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000075721904 1034716017 /nfs/dbraw/zinc/71/60/17/1034716017.db2.gz FWWAREJMCHMXEE-JTQLQIEISA-N 1 1 340.305 3.721 20 5 EHBDMO C[N@@H+](CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000450933514 1034957338 /nfs/dbraw/zinc/95/73/38/1034957338.db2.gz DRXZXUNXSUPWHB-UHFFFAOYSA-N 1 1 326.396 3.732 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(OC(F)F)c1 ZINC000548934053 1034998567 /nfs/dbraw/zinc/99/85/67/1034998567.db2.gz OPRNETJVSQFAET-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO C[C@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2F)c1)[NH+]1CCOCC1 ZINC000511374569 1035206782 /nfs/dbraw/zinc/20/67/82/1035206782.db2.gz AVEVTXIBOSLSPU-CYBMUJFWSA-N 1 1 345.374 3.871 20 5 EHBDMO CC1(C)C[C@H](N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390421 1035434283 /nfs/dbraw/zinc/43/42/83/1035434283.db2.gz XJCHAXOGYFCURI-SQNIBIBYSA-N 1 1 329.444 3.534 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@@H]2CCN3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390421 1035434284 /nfs/dbraw/zinc/43/42/84/1035434284.db2.gz XJCHAXOGYFCURI-SQNIBIBYSA-N 1 1 329.444 3.534 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)n1 ZINC000613188200 1035444564 /nfs/dbraw/zinc/44/45/64/1035444564.db2.gz UOSCPFJPMLTNEQ-AWEZNQCLSA-N 1 1 346.456 3.551 20 5 EHBDMO CC(C)CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000044898421 1035510314 /nfs/dbraw/zinc/51/03/14/1035510314.db2.gz REDMFEGBESOPBH-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000044898443 1035510752 /nfs/dbraw/zinc/51/07/52/1035510752.db2.gz QPUFCGMFZZLLPY-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](COC(F)F)C2)cc1[N+](=O)[O-] ZINC000582030516 1035683032 /nfs/dbraw/zinc/68/30/32/1035683032.db2.gz VBEKYWITMFJQMT-CYBMUJFWSA-N 1 1 328.359 3.779 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCOc2ccccc2)ccc1[N+](=O)[O-] ZINC000492356901 1035698711 /nfs/dbraw/zinc/69/87/11/1035698711.db2.gz LQMNRJMRDWTDIL-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000535068399 1035985676 /nfs/dbraw/zinc/98/56/76/1035985676.db2.gz MSYYFJOYLZZKQJ-GQCTYLIASA-N 1 1 340.379 3.511 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)CC(C)(C)C1 ZINC000541326121 1036200669 /nfs/dbraw/zinc/20/06/69/1036200669.db2.gz UNFIPJRQLZXUNK-CYBMUJFWSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000165264835 1036352241 /nfs/dbraw/zinc/35/22/41/1036352241.db2.gz YMWYAQLXUIJUPY-INIZCTEOSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccccc1F ZINC000026224711 1036394285 /nfs/dbraw/zinc/39/42/85/1036394285.db2.gz GUTGXRNOIZRHII-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CCO[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590161133 1036780077 /nfs/dbraw/zinc/78/00/77/1036780077.db2.gz AXDDMSCPXFIHRL-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO CCO[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590161133 1036780090 /nfs/dbraw/zinc/78/00/90/1036780090.db2.gz AXDDMSCPXFIHRL-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519660 1037097498 /nfs/dbraw/zinc/09/74/98/1037097498.db2.gz CYQXVXHRORRXDG-AWEZNQCLSA-N 1 1 325.840 3.602 20 5 EHBDMO CC[C@H]1CCCCN1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519660 1037097515 /nfs/dbraw/zinc/09/75/15/1037097515.db2.gz CYQXVXHRORRXDG-AWEZNQCLSA-N 1 1 325.840 3.602 20 5 EHBDMO CN(C)CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525444 1037109395 /nfs/dbraw/zinc/10/93/95/1037109395.db2.gz KATZRSDCGYJXIR-HNNXBMFYSA-N 1 1 327.856 3.704 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NCCc1cn2c([nH+]1)CCCC2 ZINC000596072427 1037148434 /nfs/dbraw/zinc/14/84/34/1037148434.db2.gz AGBVBKIYGJEJIP-UHFFFAOYSA-N 1 1 336.342 3.720 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539820978 1037243046 /nfs/dbraw/zinc/24/30/46/1037243046.db2.gz TZVWITFZARBKCS-CQSZACIVSA-N 1 1 330.432 3.863 20 5 EHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829599 1037255691 /nfs/dbraw/zinc/25/56/91/1037255691.db2.gz REKKBSJDDNWHES-CZUORRHYSA-N 1 1 328.416 3.616 20 5 EHBDMO C[N@@H+]1CCc2c(NCc3nccc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001167704509 1037257513 /nfs/dbraw/zinc/25/75/13/1037257513.db2.gz UKKKDAKYHGIYJJ-UHFFFAOYSA-N 1 1 348.406 3.743 20 5 EHBDMO C[N@H+]1CCc2c(NCc3nccc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001167704509 1037257528 /nfs/dbraw/zinc/25/75/28/1037257528.db2.gz UKKKDAKYHGIYJJ-UHFFFAOYSA-N 1 1 348.406 3.743 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000311066172 1037308204 /nfs/dbraw/zinc/30/82/04/1037308204.db2.gz YDKDFSJKEDCVDQ-QGZVFWFLSA-N 1 1 340.427 3.622 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899996 1037341456 /nfs/dbraw/zinc/34/14/56/1037341456.db2.gz MFHWOCCRKNSHRX-IRXDYDNUSA-N 1 1 332.444 3.967 20 5 EHBDMO CN(C)c1nc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000591348050 1037368346 /nfs/dbraw/zinc/36/83/46/1037368346.db2.gz YTFCLYCBMNAFLY-INIZCTEOSA-N 1 1 346.456 3.675 20 5 EHBDMO C[C@H]1CCN(c2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000463070789 1037735601 /nfs/dbraw/zinc/73/56/01/1037735601.db2.gz PDDLTDAQBYCWOS-INIZCTEOSA-N 1 1 325.412 3.696 20 5 EHBDMO CC[C@@]1(C)C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000443848598 1037769417 /nfs/dbraw/zinc/76/94/17/1037769417.db2.gz BAKHWBFSQHNUNP-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000443848598 1037769448 /nfs/dbraw/zinc/76/94/48/1037769448.db2.gz BAKHWBFSQHNUNP-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058452116 1037918992 /nfs/dbraw/zinc/91/89/92/1037918992.db2.gz OUVUTAFDCXTQLD-GFCCVEGCSA-N 1 1 344.358 3.969 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000058563181 1038121974 /nfs/dbraw/zinc/12/19/74/1038121974.db2.gz LORZGUITBMJYNN-KRWDZBQOSA-N 1 1 326.396 3.681 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058563587 1038123987 /nfs/dbraw/zinc/12/39/87/1038123987.db2.gz DSXAIBRWYADHOH-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000538735736 1038501093 /nfs/dbraw/zinc/50/10/93/1038501093.db2.gz YDZFCNFNFZISFA-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC[C@@H]2C2CC2)s1 ZINC000538735736 1038501097 /nfs/dbraw/zinc/50/10/97/1038501097.db2.gz YDZFCNFNFZISFA-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000544108701 1038606639 /nfs/dbraw/zinc/60/66/39/1038606639.db2.gz DEIHHKVBHUMMJR-GXTWGEPZSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1cc(CNc2cc(C)c([N+](=O)[O-])cc2F)cc(N2CCCC2)[nH+]1 ZINC000461886307 1038648114 /nfs/dbraw/zinc/64/81/14/1038648114.db2.gz WZRUYLJJGSYQCS-UHFFFAOYSA-N 1 1 344.390 3.958 20 5 EHBDMO C[N@H+](Cc1ccccc1)[C@H](CNCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871577 1038817192 /nfs/dbraw/zinc/81/71/92/1038817192.db2.gz GVHSJWNKVYSZRJ-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H](CNCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871577 1038817216 /nfs/dbraw/zinc/81/72/16/1038817216.db2.gz GVHSJWNKVYSZRJ-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC[N@H+](C2CCCC2)CC1 ZINC000488053345 1038826231 /nfs/dbraw/zinc/82/62/31/1038826231.db2.gz DXKLANFOPXBBEO-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000478049292 1039169887 /nfs/dbraw/zinc/16/98/87/1039169887.db2.gz WFZNUDOBLIHASS-KRWDZBQOSA-N 1 1 348.422 3.520 20 5 EHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000015366929 1039275424 /nfs/dbraw/zinc/27/54/24/1039275424.db2.gz JETZQMOLTQZULR-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000015366929 1039275436 /nfs/dbraw/zinc/27/54/36/1039275436.db2.gz JETZQMOLTQZULR-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1ccc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000500788422 1039499258 /nfs/dbraw/zinc/49/92/58/1039499258.db2.gz SAQSWYNXGACXBO-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000549808076 1039925248 /nfs/dbraw/zinc/92/52/48/1039925248.db2.gz IOUJIBWDMPUUFM-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000894060918 1040026919 /nfs/dbraw/zinc/02/69/19/1040026919.db2.gz XPESZSJBEORVSK-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000512552837 1040084131 /nfs/dbraw/zinc/08/41/31/1040084131.db2.gz VFUDSTISLCQJPW-UHFFFAOYSA-N 1 1 343.402 3.932 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000490029781 1040298972 /nfs/dbraw/zinc/29/89/72/1040298972.db2.gz YABIYBTYDKJJQW-QGZVFWFLSA-N 1 1 341.411 3.550 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075413 1040435390 /nfs/dbraw/zinc/43/53/90/1040435390.db2.gz PLUASMGBLMDSKW-IJEWVQPXSA-N 1 1 331.416 3.576 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000486783620 1040441478 /nfs/dbraw/zinc/44/14/78/1040441478.db2.gz ZKLFLDZONMPAIZ-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486813414 1040466255 /nfs/dbraw/zinc/46/62/55/1040466255.db2.gz UXQAOUTWWIDHHB-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c(F)c1 ZINC000029584803 1040731500 /nfs/dbraw/zinc/73/15/00/1040731500.db2.gz QZTOHIXPYMYJOV-UHFFFAOYSA-N 1 1 340.358 3.633 20 5 EHBDMO COC(=O)c1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000490801923 1040747920 /nfs/dbraw/zinc/74/79/20/1040747920.db2.gz MIKGXXYHOVUXSK-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO CC1(C)C[C@H](N[C@H]2CC[N@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114680 1040765425 /nfs/dbraw/zinc/76/54/25/1040765425.db2.gz GTIKIRFAQFDIBV-LIRRHRJNSA-N 1 1 343.471 3.924 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@H]2CCN(C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114680 1040765439 /nfs/dbraw/zinc/76/54/39/1040765439.db2.gz GTIKIRFAQFDIBV-LIRRHRJNSA-N 1 1 343.471 3.924 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487200448 1040785953 /nfs/dbraw/zinc/78/59/53/1040785953.db2.gz PPYTYQPJSFPUNB-AWEZNQCLSA-N 1 1 335.448 3.550 20 5 EHBDMO CC[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798612 1040839460 /nfs/dbraw/zinc/83/94/60/1040839460.db2.gz INORURFVFMOSIY-CQSZACIVSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798612 1040839471 /nfs/dbraw/zinc/83/94/71/1040839471.db2.gz INORURFVFMOSIY-CQSZACIVSA-N 1 1 332.425 3.934 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@@H]21 ZINC000555721021 1041043758 /nfs/dbraw/zinc/04/37/58/1041043758.db2.gz FJQLBDLEXLWSPX-GJZGRUSLSA-N 1 1 342.399 3.655 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721466 1041059624 /nfs/dbraw/zinc/05/96/24/1041059624.db2.gz REJPPJATMIELLI-LSDHHAIUSA-N 1 1 342.399 3.655 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](c1ccccc1F)[C@H](C)O ZINC000571289426 1041255920 /nfs/dbraw/zinc/25/59/20/1041255920.db2.gz BCLNJESRCNVZAB-ZJNRKIDTSA-N 1 1 332.375 3.815 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744388 1041256382 /nfs/dbraw/zinc/25/63/82/1041256382.db2.gz CGVCBAUCRFLLRF-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000053778607 1041847266 /nfs/dbraw/zinc/84/72/66/1041847266.db2.gz IUGFEZCFLJOAFT-SNVBAGLBSA-N 1 1 330.331 3.579 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000112659802 1042416479 /nfs/dbraw/zinc/41/64/79/1042416479.db2.gz PGAAIYTWYOHQAP-IBGZPJMESA-N 1 1 328.412 3.614 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@H](C)C1 ZINC000248557224 1042526999 /nfs/dbraw/zinc/52/69/99/1042526999.db2.gz LJGJAQVSCLQIHB-QWHCGFSZSA-N 1 1 330.388 3.828 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(OC(C)C)cc1NCc1ccc(N)[nH+]c1C ZINC001167788365 1042544865 /nfs/dbraw/zinc/54/48/65/1042544865.db2.gz ZWACAWMLHLFWMB-UHFFFAOYSA-N 1 1 330.388 3.588 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000070696045 1042849843 /nfs/dbraw/zinc/84/98/43/1042849843.db2.gz MPJBPNWFVWZQRR-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792085 1043461302 /nfs/dbraw/zinc/46/13/02/1043461302.db2.gz XTQLEUGSPOEJPM-CGTJXYLNSA-N 1 1 336.407 3.640 20 5 EHBDMO CC[N@@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000051924188 1044600873 /nfs/dbraw/zinc/60/08/73/1044600873.db2.gz GEBBAWQUVJRFRP-UHFFFAOYSA-N 1 1 342.395 3.526 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000072597909 1126793754 /nfs/dbraw/zinc/79/37/54/1126793754.db2.gz RVLZOBDLRYCXMO-AUUYWEPGSA-N 1 1 326.396 3.902 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000083170489 1127221464 /nfs/dbraw/zinc/22/14/64/1127221464.db2.gz CAKPTOIUDWLGCA-CYBMUJFWSA-N 1 1 325.368 3.972 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CCN(c2cc[nH+]c3ccsc32)CC1 ZINC000301377006 1127739898 /nfs/dbraw/zinc/73/98/98/1127739898.db2.gz WPVHVXRODVUOKZ-UHFFFAOYSA-N 1 1 340.408 3.531 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000785438418 1127744129 /nfs/dbraw/zinc/74/41/29/1127744129.db2.gz HRVTZKZLNKTKDS-QWHCGFSZSA-N 1 1 337.420 3.501 20 5 EHBDMO CC[C@@H](CSC)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001116650595 1128705931 /nfs/dbraw/zinc/70/59/31/1128705931.db2.gz BJADMFSSINQVTJ-NSHDSACASA-N 1 1 347.278 3.931 20 5 EHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001116650595 1128705933 /nfs/dbraw/zinc/70/59/33/1128705933.db2.gz BJADMFSSINQVTJ-NSHDSACASA-N 1 1 347.278 3.931 20 5 EHBDMO COc1cc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000302157003 1120273071 /nfs/dbraw/zinc/27/30/71/1120273071.db2.gz FJQLFBDRRHYVJO-WMLDXEAASA-N 1 1 341.411 3.536 20 5 EHBDMO C[N@@H+]1CC[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957919 1128947924 /nfs/dbraw/zinc/94/79/24/1128947924.db2.gz GEXGWCMCZKGRGG-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957919 1128947927 /nfs/dbraw/zinc/94/79/27/1128947927.db2.gz GEXGWCMCZKGRGG-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@H]12 ZINC000915210188 1121254790 /nfs/dbraw/zinc/25/47/90/1121254790.db2.gz WUHGRNYEGJIRFI-MZMPZRCHSA-N 1 1 328.416 3.803 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2sccc2C1 ZINC000301061725 1121281821 /nfs/dbraw/zinc/28/18/21/1121281821.db2.gz CIOAHWUAPDWDEA-NSHDSACASA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2sccc2C1 ZINC000301061725 1121281824 /nfs/dbraw/zinc/28/18/24/1121281824.db2.gz CIOAHWUAPDWDEA-NSHDSACASA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2ncccc2[N+](=O)[O-])cc1 ZINC000301069432 1121312613 /nfs/dbraw/zinc/31/26/13/1121312613.db2.gz COPYRWMGQPJMGW-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO Cc1cnc(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039577 1128977604 /nfs/dbraw/zinc/97/76/04/1128977604.db2.gz DWZQUFWAEDXCEL-NVXWUHKLSA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000762632411 1121389151 /nfs/dbraw/zinc/38/91/51/1121389151.db2.gz ISOBYQUINFZCMX-MOPGFXCFSA-N 1 1 326.396 3.855 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(F)cc2)CC1 ZINC000487999498 1121577172 /nfs/dbraw/zinc/57/71/72/1121577172.db2.gz AWIVKNSEKVFGAL-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccncc2)cs1 ZINC000076895669 1121970315 /nfs/dbraw/zinc/97/03/15/1121970315.db2.gz AFAFCTVAAPEFID-GFCCVEGCSA-N 1 1 340.408 3.964 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCC[C@H]1O ZINC000497157476 1122354853 /nfs/dbraw/zinc/35/48/53/1122354853.db2.gz AFRLKOUSTVCDGC-MAUKXSAKSA-N 1 1 344.411 3.838 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000154311039 1122552571 /nfs/dbraw/zinc/55/25/71/1122552571.db2.gz BLSAAPSXYBFRKY-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775457 1129063447 /nfs/dbraw/zinc/06/34/47/1129063447.db2.gz LCIRCOFLJCIHFP-MLGOLLRUSA-N 1 1 335.835 3.701 20 5 EHBDMO C[C@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063471 1122800456 /nfs/dbraw/zinc/80/04/56/1122800456.db2.gz HAYGKLLVMPHCNK-BEFAXECRSA-N 1 1 331.460 3.684 20 5 EHBDMO CC(C)[N@H+](Cc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000919957232 1123245941 /nfs/dbraw/zinc/24/59/41/1123245941.db2.gz VAXFEDNMMKRLBS-UHFFFAOYSA-N 1 1 330.413 3.874 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000609384339 1123567695 /nfs/dbraw/zinc/56/76/95/1123567695.db2.gz LGFHUMPQVQTTAS-GFCCVEGCSA-N 1 1 329.322 3.510 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1[N+](=O)[O-] ZINC000064350326 1123574497 /nfs/dbraw/zinc/57/44/97/1123574497.db2.gz LJBKKSRLXRXBGP-UHFFFAOYSA-N 1 1 329.356 3.914 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1[N+](=O)[O-] ZINC000064350326 1123574501 /nfs/dbraw/zinc/57/45/01/1123574501.db2.gz LJBKKSRLXRXBGP-UHFFFAOYSA-N 1 1 329.356 3.914 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672692 1123641571 /nfs/dbraw/zinc/64/15/71/1123641571.db2.gz XXCWCCCRXYAPRV-DOTOQJQBSA-N 1 1 326.396 3.852 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000609800858 1123664295 /nfs/dbraw/zinc/66/42/95/1123664295.db2.gz UEWFCXMFKFFGKZ-GOSISDBHSA-N 1 1 344.436 3.764 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(-n3cccn3)cc2)C2CC2)c1 ZINC000195677120 1123734354 /nfs/dbraw/zinc/73/43/54/1123734354.db2.gz YKDCIWITGMIWHU-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO CC(C)CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000078536770 1129159501 /nfs/dbraw/zinc/15/95/01/1129159501.db2.gz JAFDUJQKLWVZOI-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539663 1129160294 /nfs/dbraw/zinc/16/02/94/1129160294.db2.gz DNJUPBFKECSJOH-IUODEOHRSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216827 1124100367 /nfs/dbraw/zinc/10/03/67/1124100367.db2.gz ZQJWZVYOHHMWIH-RDJZCZTQSA-N 1 1 348.443 3.632 20 5 EHBDMO Cc1cc(NC2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181460686 1124854853 /nfs/dbraw/zinc/85/48/53/1124854853.db2.gz LKRMQKFQNHQGFG-UHFFFAOYSA-N 1 1 340.427 3.738 20 5 EHBDMO CCC1(CC)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCS1 ZINC001307663092 1125369073 /nfs/dbraw/zinc/36/90/73/1125369073.db2.gz YPILCMNHDAIEBQ-UHFFFAOYSA-N 1 1 338.473 3.971 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491939 1131352802 /nfs/dbraw/zinc/35/28/02/1131352802.db2.gz LZLIJMWUGCMYAB-GFCCVEGCSA-N 1 1 326.824 3.764 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894152 1129292367 /nfs/dbraw/zinc/29/23/67/1129292367.db2.gz WWEOAMCRNSXCSQ-PBHICJAKSA-N 1 1 346.818 3.809 20 5 EHBDMO CC(C)(C)n1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000154299920 1129547361 /nfs/dbraw/zinc/54/73/61/1129547361.db2.gz JDMPMACGJQWCAA-UHFFFAOYSA-N 1 1 328.416 3.711 20 5 EHBDMO CC(C)(C)n1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000154299920 1129547363 /nfs/dbraw/zinc/54/73/63/1129547363.db2.gz JDMPMACGJQWCAA-UHFFFAOYSA-N 1 1 328.416 3.711 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1F ZINC000173005797 1129553985 /nfs/dbraw/zinc/55/39/85/1129553985.db2.gz ZBKCHEXRUKNZBF-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC1CCC([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000302600449 1129783077 /nfs/dbraw/zinc/78/30/77/1129783077.db2.gz YTXNUHFYZPJAEE-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]3C3CCCC3)n2)cc1 ZINC000055927279 1129790609 /nfs/dbraw/zinc/79/06/09/1129790609.db2.gz ZTKOZVOKWGNXQT-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(NCC[N@H+]3CCc4ccccc4C3)ccc2c1 ZINC000302958405 1129802127 /nfs/dbraw/zinc/80/21/27/1129802127.db2.gz PRWJUZOVGCNQJH-UHFFFAOYSA-N 1 1 348.406 3.613 20 5 EHBDMO CC(C)[N@@H+](CCOC1CCSCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000929337181 1129991996 /nfs/dbraw/zinc/99/19/96/1129991996.db2.gz CAQXDJHWRITOPR-UHFFFAOYSA-N 1 1 338.473 3.717 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731208706 1130779027 /nfs/dbraw/zinc/77/90/27/1130779027.db2.gz GCNWWYWTPDPLHO-GFCCVEGCSA-N 1 1 334.445 3.737 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209175 1130897742 /nfs/dbraw/zinc/89/77/42/1130897742.db2.gz JQVPMXOVOWKHQH-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209175 1130897750 /nfs/dbraw/zinc/89/77/50/1130897750.db2.gz JQVPMXOVOWKHQH-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC(F)(F)[C@@H](F)C1)CC2 ZINC001172902665 1131884953 /nfs/dbraw/zinc/88/49/53/1131884953.db2.gz BNIHHPWTUTVLRW-HIFRSBDPSA-N 1 1 328.334 3.521 20 5 EHBDMO Cc1nc2c(s1)C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172914834 1131902376 /nfs/dbraw/zinc/90/23/76/1131902376.db2.gz JTUPKBDAYNEGCL-OAHLLOKOSA-N 1 1 343.452 3.665 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCOc3ccccc3C1)CC2 ZINC001172916411 1131904433 /nfs/dbraw/zinc/90/44/33/1131904433.db2.gz RMOBNOSBEUGUGA-SFHVURJKSA-N 1 1 338.407 3.737 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381103 1131914943 /nfs/dbraw/zinc/91/49/43/1131914943.db2.gz VZVFOFQIPWOCED-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@@H]1c2cccn2CC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912465 1131917489 /nfs/dbraw/zinc/91/74/89/1131917489.db2.gz ABVUQZXLILPUHF-RHSMWYFYSA-N 1 1 325.412 3.721 20 5 EHBDMO C[C@@H]1c2cccn2CC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912465 1131917490 /nfs/dbraw/zinc/91/74/90/1131917490.db2.gz ABVUQZXLILPUHF-RHSMWYFYSA-N 1 1 325.412 3.721 20 5 EHBDMO CC[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173019980 1131936338 /nfs/dbraw/zinc/93/63/38/1131936338.db2.gz NQVJJPMWUUHYPV-GFCCVEGCSA-N 1 1 339.386 3.574 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000743855408 1131988033 /nfs/dbraw/zinc/98/80/33/1131988033.db2.gz OGNLWGNAOBSDNU-CQSZACIVSA-N 1 1 325.840 3.554 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2cccc(O)c2)c1F ZINC001173180346 1131992507 /nfs/dbraw/zinc/99/25/07/1131992507.db2.gz JXYDBENJVRAVTD-GFCCVEGCSA-N 1 1 348.374 3.511 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC001173223488 1132005590 /nfs/dbraw/zinc/00/55/90/1132005590.db2.gz ANFJYUGABFRLNS-UZLBHIALSA-N 1 1 339.439 3.515 20 5 EHBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C[C@@H]1CC1(C)C ZINC001174915709 1132503932 /nfs/dbraw/zinc/50/39/32/1132503932.db2.gz MTKGJPWSYQWLKO-JTQLQIEISA-N 1 1 327.222 3.835 20 5 EHBDMO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C[C@@H]1CC1(C)C ZINC001174915709 1132503937 /nfs/dbraw/zinc/50/39/37/1132503937.db2.gz MTKGJPWSYQWLKO-JTQLQIEISA-N 1 1 327.222 3.835 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009410 1132631081 /nfs/dbraw/zinc/63/10/81/1132631081.db2.gz WCMXKLXGHJCEBU-PKOBYXMFSA-N 1 1 325.412 3.529 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169395953 1132745914 /nfs/dbraw/zinc/74/59/14/1132745914.db2.gz OLOLBPLGJXMWJA-LJQANCHMSA-N 1 1 346.402 3.897 20 5 EHBDMO C[C@H](C[NH+]1CCCCC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001177222950 1133042640 /nfs/dbraw/zinc/04/26/40/1133042640.db2.gz WJTIRJYHCXVUTP-OAHLLOKOSA-N 1 1 343.427 3.819 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@H]2CCCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000767763360 1133048373 /nfs/dbraw/zinc/04/83/73/1133048373.db2.gz NYCKIMSULXIYGD-GOSISDBHSA-N 1 1 342.443 3.853 20 5 EHBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766833 1133050537 /nfs/dbraw/zinc/05/05/37/1133050537.db2.gz XWISEZADOXSUPF-INIZCTEOSA-N 1 1 343.431 3.711 20 5 EHBDMO C[N@H+]1CC[C@@H](CNC(=O)CCc2c3ccccc3cc3ccccc32)C1 ZINC001182413932 1133656458 /nfs/dbraw/zinc/65/64/58/1133656458.db2.gz JNYUEROECXVMQP-KRWDZBQOSA-N 1 1 346.474 3.994 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)c2ccc(Cl)cc2)C2CC2)c1 ZINC000772198406 1133659254 /nfs/dbraw/zinc/65/92/54/1133659254.db2.gz CXRWSTPDSCPAIL-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC1CCCC1 ZINC000788817660 1134176454 /nfs/dbraw/zinc/17/64/54/1134176454.db2.gz GHQGQUBRKLOXPL-OAHLLOKOSA-N 1 1 326.824 3.621 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC1CCCC1 ZINC000788817660 1134176458 /nfs/dbraw/zinc/17/64/58/1134176458.db2.gz GHQGQUBRKLOXPL-OAHLLOKOSA-N 1 1 326.824 3.621 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190978 1134307820 /nfs/dbraw/zinc/30/78/20/1134307820.db2.gz WWCKNDGWGXYITH-OAHLLOKOSA-N 1 1 331.441 3.960 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606105 1134582674 /nfs/dbraw/zinc/58/26/74/1134582674.db2.gz QMDFJUOFNRJTQX-PXNSSMCTSA-N 1 1 340.423 3.735 20 5 EHBDMO CC(C)N(CC[N@@H+]1C[C@H](C)C[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527810 1134712963 /nfs/dbraw/zinc/71/29/63/1134712963.db2.gz HLMYVPHIOJJBFY-CALCHBBNSA-N 1 1 333.476 3.783 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329029 1134748926 /nfs/dbraw/zinc/74/89/26/1134748926.db2.gz NGJAINQNLUDCDD-XHDPSFHLSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329840 1134749532 /nfs/dbraw/zinc/74/95/32/1134749532.db2.gz VRCMLUXFOADKFF-NEPJUHHUSA-N 1 1 328.359 3.512 20 5 EHBDMO C[C@]12CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(Cl)Cl ZINC000792916272 1134824434 /nfs/dbraw/zinc/82/44/34/1134824434.db2.gz XDQOEUWFYRKOPG-KGLIPLIRSA-N 1 1 329.227 3.653 20 5 EHBDMO C[C@H]1C[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499131 1135024565 /nfs/dbraw/zinc/02/45/65/1135024565.db2.gz AKQSHVWAKIMBLF-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499131 1135024568 /nfs/dbraw/zinc/02/45/68/1135024568.db2.gz AKQSHVWAKIMBLF-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2ccc(F)cc2)CC1 ZINC001192514933 1135025627 /nfs/dbraw/zinc/02/56/27/1135025627.db2.gz JTOYFZANLUKDTF-HNNXBMFYSA-N 1 1 346.406 3.509 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477554 1135276912 /nfs/dbraw/zinc/27/69/12/1135276912.db2.gz MLIQADZJDBLRQC-ZIFCJYIRSA-N 1 1 345.487 3.752 20 5 EHBDMO C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287107 1135407286 /nfs/dbraw/zinc/40/72/86/1135407286.db2.gz APXAMQVWRIXMFT-GOEBONIOSA-N 1 1 348.443 3.580 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC(C)(C)CCC1(C)C ZINC001196275811 1135541529 /nfs/dbraw/zinc/54/15/29/1135541529.db2.gz PWBBOFJWANYZEJ-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001196329780 1135547200 /nfs/dbraw/zinc/54/72/00/1135547200.db2.gz RJTATBCSRKEBNY-LSDHHAIUSA-N 1 1 333.432 3.885 20 5 EHBDMO COC(=O)CC[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468855 1135693485 /nfs/dbraw/zinc/69/34/85/1135693485.db2.gz OMFCEDPZEFFEGA-GJZGRUSLSA-N 1 1 334.416 3.629 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000808790799 1135738676 /nfs/dbraw/zinc/73/86/76/1135738676.db2.gz NFZQFKOQSVRCQN-YDHLFZDLSA-N 1 1 349.431 3.643 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000808790799 1135738679 /nfs/dbraw/zinc/73/86/79/1135738679.db2.gz NFZQFKOQSVRCQN-YDHLFZDLSA-N 1 1 349.431 3.643 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700319 1135869040 /nfs/dbraw/zinc/86/90/40/1135869040.db2.gz CPTYFTGQFHIUPE-JSGCOSHPSA-N 1 1 326.824 3.764 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809768235 1135880484 /nfs/dbraw/zinc/88/04/84/1135880484.db2.gz FORJQKUYNLGZJU-HNNXBMFYSA-N 1 1 334.807 3.925 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809768235 1135880486 /nfs/dbraw/zinc/88/04/86/1135880486.db2.gz FORJQKUYNLGZJU-HNNXBMFYSA-N 1 1 334.807 3.925 20 5 EHBDMO C[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000811484367 1136091945 /nfs/dbraw/zinc/09/19/45/1136091945.db2.gz VJUBXPBZFORUOO-SKDRFNHKSA-N 1 1 344.242 3.616 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484367 1136091947 /nfs/dbraw/zinc/09/19/47/1136091947.db2.gz VJUBXPBZFORUOO-SKDRFNHKSA-N 1 1 344.242 3.616 20 5 EHBDMO CC1CCN(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811473736 1136095813 /nfs/dbraw/zinc/09/58/13/1136095813.db2.gz KHOPOLQIYYMAOA-UHFFFAOYSA-N 1 1 346.258 3.723 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)s1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273946 1136128519 /nfs/dbraw/zinc/12/85/19/1136128519.db2.gz FNCPWWMGZXSYGZ-AWEZNQCLSA-N 1 1 340.832 3.865 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000851832825 1136412210 /nfs/dbraw/zinc/41/22/10/1136412210.db2.gz DXRBVBHQSGKEDX-HKUYNNGSSA-N 1 1 344.386 3.822 20 5 EHBDMO CC(C)C[N@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577953 1136443644 /nfs/dbraw/zinc/44/36/44/1136443644.db2.gz BMDQIEUFZVFHDT-IBGZPJMESA-N 1 1 346.402 3.926 20 5 EHBDMO CCc1ccc(C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000776579782 1136444706 /nfs/dbraw/zinc/44/47/06/1136444706.db2.gz QFTSAZORRFPJHA-HXUWFJFHSA-N 1 1 340.423 3.855 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585598 1136448574 /nfs/dbraw/zinc/44/85/74/1136448574.db2.gz XLQDYMPCSRELSD-SWLSCSKDSA-N 1 1 349.456 3.649 20 5 EHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588695 1136452993 /nfs/dbraw/zinc/45/29/93/1136452993.db2.gz NXTNMRJAGUIMAG-ICSRJNTNSA-N 1 1 342.439 3.890 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000852426870 1136455244 /nfs/dbraw/zinc/45/52/44/1136455244.db2.gz PURCLXDHKAYYCH-AEFFLSMTSA-N 1 1 342.395 3.839 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000814667694 1136492304 /nfs/dbraw/zinc/49/23/04/1136492304.db2.gz VDVXLLXOYROSNY-QAPCUYQASA-N 1 1 346.814 3.771 20 5 EHBDMO CCC1(CC)CC[NH+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000776771971 1136659326 /nfs/dbraw/zinc/65/93/26/1136659326.db2.gz LZDUFAZJWJQSIS-UHFFFAOYSA-N 1 1 343.431 3.713 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nc1 ZINC000858012070 1136930241 /nfs/dbraw/zinc/93/02/41/1136930241.db2.gz CBRFEJAJKOTBMF-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nc1 ZINC000858012070 1136930244 /nfs/dbraw/zinc/93/02/44/1136930244.db2.gz CBRFEJAJKOTBMF-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nc1 ZINC000858012995 1136930892 /nfs/dbraw/zinc/93/08/92/1136930892.db2.gz OJMSCRKNSNIWJM-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nc1 ZINC000858012995 1136930894 /nfs/dbraw/zinc/93/08/94/1136930894.db2.gz OJMSCRKNSNIWJM-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030875 1136933876 /nfs/dbraw/zinc/93/38/76/1136933876.db2.gz BZNAVAYJTYHFIJ-PBHICJAKSA-N 1 1 327.384 3.513 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858041001 1136934151 /nfs/dbraw/zinc/93/41/51/1136934151.db2.gz QGEJQCXSUFLQPN-WBVHZDCISA-N 1 1 341.411 3.821 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@]3(CCSC3)C2)ccc1Cl ZINC000825215642 1137169124 /nfs/dbraw/zinc/16/91/24/1137169124.db2.gz UQRYHWTVAUTRPE-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)cc1Cl ZINC000825215482 1137169195 /nfs/dbraw/zinc/16/91/95/1137169195.db2.gz PLGIOYFMQGWUKH-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000866541567 1137363052 /nfs/dbraw/zinc/36/30/52/1137363052.db2.gz OQABLBQMXROEAC-QGZVFWFLSA-N 1 1 328.416 3.588 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)nc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020127 1137565113 /nfs/dbraw/zinc/56/51/13/1137565113.db2.gz DHFLPEWLXMADMP-CYBMUJFWSA-N 1 1 344.390 3.580 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1OC ZINC000872036386 1137566750 /nfs/dbraw/zinc/56/67/50/1137566750.db2.gz UTGMVCVTSAYYBU-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086666 1137570558 /nfs/dbraw/zinc/57/05/58/1137570558.db2.gz BNHWWAMYWLCMDV-UKRRQHHQSA-N 1 1 335.423 3.507 20 5 EHBDMO Cc1c(C[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000873139490 1137591148 /nfs/dbraw/zinc/59/11/48/1137591148.db2.gz BYPOKWCBTJCGNU-KRWDZBQOSA-N 1 1 348.406 3.866 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000877399190 1137675301 /nfs/dbraw/zinc/67/53/01/1137675301.db2.gz LSGHKIAYAUQZBO-HXUWFJFHSA-N 1 1 338.407 3.843 20 5 EHBDMO CC(C)CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000877966798 1137697401 /nfs/dbraw/zinc/69/74/01/1137697401.db2.gz WHFVKPKJQJZPDS-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135256 1137704035 /nfs/dbraw/zinc/70/40/35/1137704035.db2.gz VXWHCXYCNFINFV-UMVBOHGHSA-N 1 1 342.399 3.798 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3nc4ccccc4[nH]3)CC2)cs1 ZINC000109765276 1137897238 /nfs/dbraw/zinc/89/72/38/1137897238.db2.gz FDWQKJWZDITTIU-UHFFFAOYSA-N 1 1 342.424 3.912 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000075866241 1138129163 /nfs/dbraw/zinc/12/91/63/1138129163.db2.gz QUJKZRWZOPFAAZ-QGZVFWFLSA-N 1 1 326.396 3.634 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000132354978 1138575656 /nfs/dbraw/zinc/57/56/56/1138575656.db2.gz BLWKPADTXHMXLK-UHFFFAOYSA-N 1 1 333.413 3.507 20 5 EHBDMO CC[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000173931719 1139387784 /nfs/dbraw/zinc/38/77/84/1139387784.db2.gz MNWMVYIPUBFKRR-OAHLLOKOSA-N 1 1 347.440 3.620 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1O ZINC000182840913 1139995952 /nfs/dbraw/zinc/99/59/52/1139995952.db2.gz JTQUKYLVEKBBKB-CYBMUJFWSA-N 1 1 330.384 3.810 20 5 EHBDMO CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483079 1140466228 /nfs/dbraw/zinc/46/62/28/1140466228.db2.gz ZHUVLNUQVZBHRJ-HNNXBMFYSA-N 1 1 330.432 3.827 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192460158 1140534343 /nfs/dbraw/zinc/53/43/43/1140534343.db2.gz BFEMBQSIUVIRLB-HIFRSBDPSA-N 1 1 346.456 3.541 20 5 EHBDMO Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271628923 1141408934 /nfs/dbraw/zinc/40/89/34/1141408934.db2.gz OOUPHUPCUYDZFZ-CABCVRRESA-N 1 1 341.411 3.889 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCOCC1 ZINC000536650253 1032061103 /nfs/dbraw/zinc/06/11/03/1032061103.db2.gz WHLZEFJJAILISP-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000536685877 1032126541 /nfs/dbraw/zinc/12/65/41/1032126541.db2.gz PANAJXLVEYRENI-UHFFFAOYSA-N 1 1 343.427 3.565 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000060208940 1016270597 /nfs/dbraw/zinc/27/05/97/1016270597.db2.gz RIAJUFOFEIOLTR-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000066696032 1016414327 /nfs/dbraw/zinc/41/43/27/1016414327.db2.gz VFAZRXWREOZDBQ-HNNXBMFYSA-N 1 1 332.425 3.838 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000066696032 1016414335 /nfs/dbraw/zinc/41/43/35/1016414335.db2.gz VFAZRXWREOZDBQ-HNNXBMFYSA-N 1 1 332.425 3.838 20 5 EHBDMO Cc1cnc(Nc2cccc(CC[N@H+](C)C3CC3)c2)c([N+](=O)[O-])c1 ZINC000538138211 1032160504 /nfs/dbraw/zinc/16/05/04/1032160504.db2.gz NBIKAHOEOXBDPO-UHFFFAOYSA-N 1 1 326.400 3.679 20 5 EHBDMO CC[C@@H]1C[C@@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503965 1032686399 /nfs/dbraw/zinc/68/63/99/1032686399.db2.gz VGLPYUHZRPUFTF-KVSKMBFKSA-N 1 1 332.444 3.979 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952390 1017352539 /nfs/dbraw/zinc/35/25/39/1017352539.db2.gz QQRGAABWCLIUQZ-JSGCOSHPSA-N 1 1 331.441 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CNCCC[NH2+]C3CC3)s2)cc1 ZINC000415067261 1017496972 /nfs/dbraw/zinc/49/69/72/1017496972.db2.gz KIZSMOGZMRIUML-UHFFFAOYSA-N 1 1 331.441 3.555 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000118846846 1017965282 /nfs/dbraw/zinc/96/52/82/1017965282.db2.gz SAFLQSGDAWYJIE-INIZCTEOSA-N 1 1 334.441 3.675 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](CCO)c1ccccc1 ZINC000122709743 1018570661 /nfs/dbraw/zinc/57/06/61/1018570661.db2.gz QNYMJPRYRJEXMZ-INIZCTEOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](CCC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000548061793 1018637956 /nfs/dbraw/zinc/63/79/56/1018637956.db2.gz XTCWYXDYUMQNCL-UHFFFAOYSA-N 1 1 347.459 3.601 20 5 EHBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])nc1 ZINC000398038050 1018957067 /nfs/dbraw/zinc/95/70/67/1018957067.db2.gz QQMKBLFHUZSJRT-KRWDZBQOSA-N 1 1 328.416 3.558 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000025447889 1018981521 /nfs/dbraw/zinc/98/15/21/1018981521.db2.gz QWVVMFCSNMGONE-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO C[C@H]1[C@@H](C)[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000419379862 1019009554 /nfs/dbraw/zinc/00/95/54/1019009554.db2.gz XEZWWNMHLYQYCG-MGPQQGTHSA-N 1 1 329.400 3.769 20 5 EHBDMO CC(C)(C)Oc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000580345471 1019120248 /nfs/dbraw/zinc/12/02/48/1019120248.db2.gz JTVXTPRHQNDDNI-INIZCTEOSA-N 1 1 341.411 3.944 20 5 EHBDMO CC[N@H+](CC(=O)N1CCCCCC1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000513217928 1019431859 /nfs/dbraw/zinc/43/18/59/1019431859.db2.gz KGXRBIBGWSUTGM-INIZCTEOSA-N 1 1 347.459 3.689 20 5 EHBDMO CC[N@@H+](CC(=O)N1CCCCCC1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000513217928 1019431873 /nfs/dbraw/zinc/43/18/73/1019431873.db2.gz KGXRBIBGWSUTGM-INIZCTEOSA-N 1 1 347.459 3.689 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(CC(F)(F)F)CC1 ZINC000182652522 1019731987 /nfs/dbraw/zinc/73/19/87/1019731987.db2.gz ZGMXNJAMTMAEMJ-CYBMUJFWSA-N 1 1 345.365 3.534 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(CC(F)(F)F)CC1 ZINC000182652522 1019732011 /nfs/dbraw/zinc/73/20/11/1019732011.db2.gz ZGMXNJAMTMAEMJ-CYBMUJFWSA-N 1 1 345.365 3.534 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000513683218 1019934987 /nfs/dbraw/zinc/93/49/87/1019934987.db2.gz HYKXOMSXDOJFDK-SFHVURJKSA-N 1 1 342.443 3.978 20 5 EHBDMO COc1ccc(OCC[N@@H+]2CC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505523 1020868693 /nfs/dbraw/zinc/86/86/93/1020868693.db2.gz NFNWCBHPQYIUEN-MRXNPFEDSA-N 1 1 346.358 3.568 20 5 EHBDMO COc1ccc(OCC[N@H+]2CC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505523 1020868700 /nfs/dbraw/zinc/86/87/00/1020868700.db2.gz NFNWCBHPQYIUEN-MRXNPFEDSA-N 1 1 346.358 3.568 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(-n2ccnc2)cc1)C1CC1 ZINC000135221162 1020904040 /nfs/dbraw/zinc/90/40/40/1020904040.db2.gz PXVVHIZDQGODPG-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc[nH]1 ZINC000760446281 1032959832 /nfs/dbraw/zinc/95/98/32/1032959832.db2.gz RTRRQXLJOBRGIZ-LLVKDONJSA-N 1 1 328.397 3.897 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H]4CCC[C@H]43)o2)c1 ZINC000426485343 1021689430 /nfs/dbraw/zinc/68/94/30/1021689430.db2.gz JDJHGYABTPFXGD-XJKSGUPXSA-N 1 1 327.384 3.667 20 5 EHBDMO Cc1cccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000302491778 1021795202 /nfs/dbraw/zinc/79/52/02/1021795202.db2.gz KGRXHLSBPIDAJM-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000140487316 1021799377 /nfs/dbraw/zinc/79/93/77/1021799377.db2.gz DXPFMKTYUFRFKS-LBPRGKRZSA-N 1 1 344.358 3.825 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)s1 ZINC000426524796 1021810439 /nfs/dbraw/zinc/81/04/39/1021810439.db2.gz PNBDIWNELVQKLY-SFHVURJKSA-N 1 1 344.436 3.670 20 5 EHBDMO CCC[N@@H+](CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506772757 1021973556 /nfs/dbraw/zinc/97/35/56/1021973556.db2.gz PMTBVMIWGJOXMR-UHFFFAOYSA-N 1 1 348.374 3.731 20 5 EHBDMO CCC1(CC)CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438503416 1022100755 /nfs/dbraw/zinc/10/07/55/1022100755.db2.gz RGVKVCOPTSZAPD-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000184511717 1022426129 /nfs/dbraw/zinc/42/61/29/1022426129.db2.gz ISRUJUMMJMMZBS-UHFFFAOYSA-N 1 1 347.440 3.550 20 5 EHBDMO C[N@@H+](CCc1ccccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000120809030 1022644434 /nfs/dbraw/zinc/64/44/34/1022644434.db2.gz UDOPKGZCQWKBBI-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])c1 ZINC000441434239 1022650444 /nfs/dbraw/zinc/65/04/44/1022650444.db2.gz BEQAYZRVYXEOJT-UHFFFAOYSA-N 1 1 334.416 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000610582240 1022795003 /nfs/dbraw/zinc/79/50/03/1022795003.db2.gz PQYHFEPPXLQIFY-GOSISDBHSA-N 1 1 327.384 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(CN2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000048562754 1023179909 /nfs/dbraw/zinc/17/99/09/1023179909.db2.gz QNJYQMLLRMJCNM-UHFFFAOYSA-N 1 1 331.460 3.683 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441486310 1023194965 /nfs/dbraw/zinc/19/49/65/1023194965.db2.gz DZMDKTHHIGCLLC-HNNXBMFYSA-N 1 1 344.411 3.718 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475576 1023239510 /nfs/dbraw/zinc/23/95/10/1023239510.db2.gz XZOSWXDIZVTYQY-HZPDHXFCSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)c(Cl)c1 ZINC000449733931 1033126761 /nfs/dbraw/zinc/12/67/61/1033126761.db2.gz QMRKNTXXVRCHPC-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288626 1024011737 /nfs/dbraw/zinc/01/17/37/1024011737.db2.gz YEGPFBVVNKFQJR-STQMWFEESA-N 1 1 336.823 3.569 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529663 1024039356 /nfs/dbraw/zinc/03/93/56/1024039356.db2.gz AHCIWVCVONQCCL-XHSDSOJGSA-N 1 1 347.459 3.673 20 5 EHBDMO C[N@@H+](CCOc1ccccc1Cl)CCc1ccc([N+](=O)[O-])cc1 ZINC000522268256 1024128374 /nfs/dbraw/zinc/12/83/74/1024128374.db2.gz AGTPYNRIRYKJGQ-UHFFFAOYSA-N 1 1 334.803 3.802 20 5 EHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500305 1024242482 /nfs/dbraw/zinc/24/24/82/1024242482.db2.gz SMICETROQZKRJV-MFKMUULPSA-N 1 1 327.222 3.978 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000434953150 1024523769 /nfs/dbraw/zinc/52/37/69/1024523769.db2.gz ZJNUZVBXKFZQER-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO COCC[N@@H+](C)CC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000505585139 1024547752 /nfs/dbraw/zinc/54/77/52/1024547752.db2.gz LJTSTDVQPSBZJL-IBGZPJMESA-N 1 1 343.427 3.716 20 5 EHBDMO O=[N+]([O-])c1cnccc1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425281078 1024623666 /nfs/dbraw/zinc/62/36/66/1024623666.db2.gz LGDSEZZBYMTZSW-OAHLLOKOSA-N 1 1 329.425 3.747 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065535213 1024624616 /nfs/dbraw/zinc/62/46/16/1024624616.db2.gz NMSCTZIXBZZLBQ-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065535213 1024624622 /nfs/dbraw/zinc/62/46/22/1024624622.db2.gz NMSCTZIXBZZLBQ-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO Cc1c(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235676 1024625916 /nfs/dbraw/zinc/62/59/16/1024625916.db2.gz DIAFLKZVIUYGRT-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235676 1024625928 /nfs/dbraw/zinc/62/59/28/1024625928.db2.gz DIAFLKZVIUYGRT-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235676 1024625937 /nfs/dbraw/zinc/62/59/37/1024625937.db2.gz DIAFLKZVIUYGRT-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO COc1ccccc1C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000065535504 1024632291 /nfs/dbraw/zinc/63/22/91/1024632291.db2.gz UEJXZTOVQWIPPG-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792087 1024654432 /nfs/dbraw/zinc/65/44/32/1024654432.db2.gz XTQLEUGSPOEJPM-KBAYOESNSA-N 1 1 336.407 3.640 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000346394447 1024712683 /nfs/dbraw/zinc/71/26/83/1024712683.db2.gz DVLJHDPLZMTIKY-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO Cc1cccc(C)c1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000342285195 1024727490 /nfs/dbraw/zinc/72/74/90/1024727490.db2.gz SGPNHFPDUNJINJ-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2C[C@@H](O)C2(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427871706 1024855431 /nfs/dbraw/zinc/85/54/31/1024855431.db2.gz WQRPYQCHQZEPGM-RCCFBDPRSA-N 1 1 344.411 3.589 20 5 EHBDMO C[C@@H]1C[C@@H](C[NH3+])CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371215 1024857614 /nfs/dbraw/zinc/85/76/14/1024857614.db2.gz LYFSNRFNLKWPGL-NEPJUHHUSA-N 1 1 349.818 3.677 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccc(F)cn2)CC1 ZINC000602902831 1033252240 /nfs/dbraw/zinc/25/22/40/1033252240.db2.gz FEWHSLYKHNVGFG-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO Cc1ccc(C(=O)CC[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511058290 1025090306 /nfs/dbraw/zinc/09/03/06/1025090306.db2.gz FKDOBTWSMPWHGH-UHFFFAOYSA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1ccc(CN2CCC[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000435767557 1025129228 /nfs/dbraw/zinc/12/92/28/1025129228.db2.gz IUVXUUIFUSKBBF-UHFFFAOYSA-N 1 1 339.439 3.611 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+](Cc3c(F)cccc3F)C2)cc1 ZINC000521372295 1025347959 /nfs/dbraw/zinc/34/79/59/1025347959.db2.gz GTBHNPMEKVBPHV-CQSZACIVSA-N 1 1 347.365 3.950 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](Cc3c(F)cccc3F)C2)cc1 ZINC000521372295 1025347974 /nfs/dbraw/zinc/34/79/74/1025347974.db2.gz GTBHNPMEKVBPHV-CQSZACIVSA-N 1 1 347.365 3.950 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000521479313 1025403382 /nfs/dbraw/zinc/40/33/82/1025403382.db2.gz QCWVQGOVDWEYIO-IBGZPJMESA-N 1 1 342.395 3.819 20 5 EHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606531 1025456098 /nfs/dbraw/zinc/45/60/98/1025456098.db2.gz CLJFPMMCJQSLOL-CZUORRHYSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240797 1025489348 /nfs/dbraw/zinc/48/93/48/1025489348.db2.gz RFGPMOAFHOPEDG-GXTWGEPZSA-N 1 1 333.432 3.741 20 5 EHBDMO C[C@@H]1[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000310399063 1025494677 /nfs/dbraw/zinc/49/46/77/1025494677.db2.gz UBVDILRTWNRYBB-MLGOLLRUSA-N 1 1 346.818 3.718 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478234 1025658853 /nfs/dbraw/zinc/65/88/53/1025658853.db2.gz HEEKVOKEPUDIPW-JSGCOSHPSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213765 1025682886 /nfs/dbraw/zinc/68/28/86/1025682886.db2.gz WFIMYFNFGPIAOV-KDOFPFPSSA-N 1 1 341.411 3.972 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451354535 1025860049 /nfs/dbraw/zinc/86/00/49/1025860049.db2.gz RZDMZDBNCRMFSJ-WLWJZTKJSA-N 1 1 332.444 3.980 20 5 EHBDMO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417554 1026096999 /nfs/dbraw/zinc/09/69/99/1026096999.db2.gz NTJAGIRNARRXBM-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO Cc1cccc([C@H]2CCCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000472239341 1026888959 /nfs/dbraw/zinc/88/89/59/1026888959.db2.gz IHTKVTNXNINRMI-GOSISDBHSA-N 1 1 328.416 3.717 20 5 EHBDMO COc1ccc(C[N@H+]2CCSC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000531429791 1026904113 /nfs/dbraw/zinc/90/41/13/1026904113.db2.gz RGNANPQTTAVXKE-UHFFFAOYSA-N 1 1 336.457 3.855 20 5 EHBDMO C[NH+](C)[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000237031365 1027133297 /nfs/dbraw/zinc/13/32/97/1027133297.db2.gz CMHJXHLFOZAYGL-QGZVFWFLSA-N 1 1 345.468 3.753 20 5 EHBDMO CCC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)O ZINC000513713288 1027240164 /nfs/dbraw/zinc/24/01/64/1027240164.db2.gz NDSSNCNMHIAREP-UHFFFAOYSA-N 1 1 332.400 3.838 20 5 EHBDMO Cc1c(C[N@@H+]2CCO[C@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000531841726 1027502861 /nfs/dbraw/zinc/50/28/61/1027502861.db2.gz DCQXIQSLQCVXDX-IBGZPJMESA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1c(C[N@H+]2CCO[C@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000531841726 1027502882 /nfs/dbraw/zinc/50/28/82/1027502882.db2.gz DCQXIQSLQCVXDX-IBGZPJMESA-N 1 1 326.396 3.651 20 5 EHBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293730630 1027701878 /nfs/dbraw/zinc/70/18/78/1027701878.db2.gz GQOASDHPUHAUGJ-HNNXBMFYSA-N 1 1 346.349 3.741 20 5 EHBDMO CC(C)CC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000053361044 1027961062 /nfs/dbraw/zinc/96/10/62/1027961062.db2.gz NNITTZVHQGQIRV-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000533511378 1027993607 /nfs/dbraw/zinc/99/36/07/1027993607.db2.gz FADKVYRIQZXYOJ-YYAJDYIMSA-N 1 1 331.460 3.993 20 5 EHBDMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496898 1028088263 /nfs/dbraw/zinc/08/82/63/1028088263.db2.gz TUFRHUSGOXDCPR-WBVHZDCISA-N 1 1 344.390 3.766 20 5 EHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648907 1028111797 /nfs/dbraw/zinc/11/17/97/1028111797.db2.gz OUZKRECSXAJAKA-BBRMVZONSA-N 1 1 336.395 3.849 20 5 EHBDMO CC(C)CC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001167634021 1028143422 /nfs/dbraw/zinc/14/34/22/1028143422.db2.gz HKVNCCISQIXSKY-CQSZACIVSA-N 1 1 333.432 3.680 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444700076 1028172660 /nfs/dbraw/zinc/17/26/60/1028172660.db2.gz NVKXKZFTLGUYBG-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444700076 1028172669 /nfs/dbraw/zinc/17/26/69/1028172669.db2.gz NVKXKZFTLGUYBG-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@@H](NC1CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423175433 1028245925 /nfs/dbraw/zinc/24/59/25/1028245925.db2.gz AJIUAFJTEWZBPD-GFCCVEGCSA-N 1 1 331.441 3.726 20 5 EHBDMO CCOc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289694 1028326406 /nfs/dbraw/zinc/32/64/06/1028326406.db2.gz BONIFYZXZZEDHF-UONOGXRCSA-N 1 1 343.427 3.864 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]34CCOC4)o2)c(Cl)c1 ZINC000421393937 1028373651 /nfs/dbraw/zinc/37/36/51/1028373651.db2.gz FOQIHNOIRRPWAQ-KRWDZBQOSA-N 1 1 348.786 3.873 20 5 EHBDMO C[N@@H+](CCOc1cccc(Cl)c1)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701632 1028554009 /nfs/dbraw/zinc/55/40/09/1028554009.db2.gz RLYHTTFPERKGAG-UHFFFAOYSA-N 1 1 334.803 3.802 20 5 EHBDMO CC(C)(C)OC(=O)C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000513755233 1028690593 /nfs/dbraw/zinc/69/05/93/1028690593.db2.gz RBNXISZZGBDRSJ-VURMDHGXSA-N 1 1 346.427 3.662 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CC[N@@H+](C3CCCC3)C1)CCC2 ZINC000583064229 1028716420 /nfs/dbraw/zinc/71/64/20/1028716420.db2.gz ISPNGHAGZNTJAO-KXBFYZLASA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CC[N@H+](C3CCCC3)C1)CCC2 ZINC000583064229 1028716436 /nfs/dbraw/zinc/71/64/36/1028716436.db2.gz ISPNGHAGZNTJAO-KXBFYZLASA-N 1 1 329.444 3.579 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000524221853 1028993429 /nfs/dbraw/zinc/99/34/29/1028993429.db2.gz NKXUIVQVXQGKEV-NSHDSACASA-N 1 1 342.237 3.644 20 5 EHBDMO Cc1cccn2cc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)nc12 ZINC000138401621 1029092752 /nfs/dbraw/zinc/09/27/52/1029092752.db2.gz PKRGYERPSDDHCP-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO Cc1cccn2cc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)nc12 ZINC000138401621 1029092765 /nfs/dbraw/zinc/09/27/65/1029092765.db2.gz PKRGYERPSDDHCP-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CC(C)C)C1CCCC1 ZINC000533254987 1029534201 /nfs/dbraw/zinc/53/42/01/1029534201.db2.gz BMIJIMRUBYVZQX-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000508679542 1029634138 /nfs/dbraw/zinc/63/41/38/1029634138.db2.gz MNUQIUWUZOOGIZ-OAHLLOKOSA-N 1 1 346.818 3.638 20 5 EHBDMO Cc1oc2ccccc2c1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446853608 1029833267 /nfs/dbraw/zinc/83/32/67/1029833267.db2.gz QYYKDDSNSUKFCE-UHFFFAOYSA-N 1 1 336.351 3.816 20 5 EHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[N@@H+](C)C1 ZINC000508579737 1029873147 /nfs/dbraw/zinc/87/31/47/1029873147.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@H](C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000508579737 1029873173 /nfs/dbraw/zinc/87/31/73/1029873173.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@H](C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000508579737 1029873176 /nfs/dbraw/zinc/87/31/76/1029873176.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000441184013 1029876993 /nfs/dbraw/zinc/87/69/93/1029876993.db2.gz YMSXSAVTKKIQGS-QGZVFWFLSA-N 1 1 342.395 3.602 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)n1 ZINC000441221583 1030002163 /nfs/dbraw/zinc/00/21/63/1030002163.db2.gz AIBBNIOIHWYCCE-GOSISDBHSA-N 1 1 342.443 3.526 20 5 EHBDMO Cc1cnn([C@@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514986 1030110376 /nfs/dbraw/zinc/11/03/76/1030110376.db2.gz CXSDBPBANURGEM-DOTOQJQBSA-N 1 1 328.416 3.806 20 5 EHBDMO C[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000525781332 1030115727 /nfs/dbraw/zinc/11/57/27/1030115727.db2.gz CTXZGDOUOZLXMW-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000520348491 1030328772 /nfs/dbraw/zinc/32/87/72/1030328772.db2.gz XRLWUDHVBYIWQT-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160343837 1030696805 /nfs/dbraw/zinc/69/68/05/1030696805.db2.gz DTUAVBCGJPOJBR-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000160343837 1030696816 /nfs/dbraw/zinc/69/68/16/1030696816.db2.gz DTUAVBCGJPOJBR-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC(C)(C)C1 ZINC000483103395 1030961176 /nfs/dbraw/zinc/96/11/76/1030961176.db2.gz GIEDQIGYJQUDSH-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361714 1030983914 /nfs/dbraw/zinc/98/39/14/1030983914.db2.gz YCOTULQTZAPZBW-ZBFHGGJFSA-N 1 1 344.411 3.980 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cn1 ZINC000902853064 1031131630 /nfs/dbraw/zinc/13/16/30/1031131630.db2.gz IHBFVOPLTNARLJ-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[NH+](Cc2ccsc2)CC1 ZINC000052722456 1031283347 /nfs/dbraw/zinc/28/33/47/1031283347.db2.gz JKKFIOVBEVTPNJ-UHFFFAOYSA-N 1 1 337.832 3.632 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000343590175 1031522615 /nfs/dbraw/zinc/52/26/15/1031522615.db2.gz ANBDRFDYLIABNH-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000343590175 1031522633 /nfs/dbraw/zinc/52/26/33/1031522633.db2.gz ANBDRFDYLIABNH-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000477440638 1031568247 /nfs/dbraw/zinc/56/82/47/1031568247.db2.gz SSKAOLAFOYZNOW-KRWDZBQOSA-N 1 1 340.379 3.969 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000063493769 1033403548 /nfs/dbraw/zinc/40/35/48/1033403548.db2.gz ZQFYKKKDPHOZLB-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1OC(F)F ZINC000594597685 1033443162 /nfs/dbraw/zinc/44/31/62/1033443162.db2.gz DXMKCTXRFCIURB-STQMWFEESA-N 1 1 341.358 3.625 20 5 EHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611940063 1033458380 /nfs/dbraw/zinc/45/83/80/1033458380.db2.gz RDMICMYBXMOLNU-ZDUSSCGKSA-N 1 1 338.367 3.804 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000594615397 1033480082 /nfs/dbraw/zinc/48/00/82/1033480082.db2.gz OBQFYSBQKXHBCL-GFCCVEGCSA-N 1 1 332.425 3.669 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000595019581 1033612111 /nfs/dbraw/zinc/61/21/11/1033612111.db2.gz RSSQLDVRUKJGCA-CHWSQXEVSA-N 1 1 332.404 3.793 20 5 EHBDMO COCC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccco1 ZINC000595035080 1033655714 /nfs/dbraw/zinc/65/57/14/1033655714.db2.gz URPHZHKVRKGDJZ-DOMZBBRYSA-N 1 1 334.372 3.625 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500875 1033831855 /nfs/dbraw/zinc/83/18/55/1033831855.db2.gz GFYKFSJRKBQROL-ZDUSSCGKSA-N 1 1 345.374 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500875 1033831863 /nfs/dbraw/zinc/83/18/63/1033831863.db2.gz GFYKFSJRKBQROL-ZDUSSCGKSA-N 1 1 345.374 3.517 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)C1 ZINC000603855873 1033981092 /nfs/dbraw/zinc/98/10/92/1033981092.db2.gz CBQHJWPKTVVVRN-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000603859557 1033984698 /nfs/dbraw/zinc/98/46/98/1033984698.db2.gz JEOOPXBUOBXJLQ-OAHLLOKOSA-N 1 1 342.443 3.631 20 5 EHBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094861 1034079058 /nfs/dbraw/zinc/07/90/58/1034079058.db2.gz NQWOMVHQIHTQEW-NVXWUHKLSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094861 1034079070 /nfs/dbraw/zinc/07/90/70/1034079070.db2.gz NQWOMVHQIHTQEW-NVXWUHKLSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1cc(NCc2ccc(C)[nH+]c2N2CCCC2)c([N+](=O)[O-])s1 ZINC000596186453 1034102365 /nfs/dbraw/zinc/10/23/65/1034102365.db2.gz KFUVZSNTYYXLRR-UHFFFAOYSA-N 1 1 332.429 3.880 20 5 EHBDMO COc1ccc2oc(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])cc2c1 ZINC000179316880 1034108127 /nfs/dbraw/zinc/10/81/27/1034108127.db2.gz LQIIRXYTEMGCNY-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO COc1ccc2oc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])cc2c1 ZINC000179316880 1034108134 /nfs/dbraw/zinc/10/81/34/1034108134.db2.gz LQIIRXYTEMGCNY-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO C[N@H+](Cc1c[nH]nc1-c1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000179315862 1034108986 /nfs/dbraw/zinc/10/89/86/1034108986.db2.gz BBFWYOHMQXBGDC-UHFFFAOYSA-N 1 1 340.358 3.756 20 5 EHBDMO C[N@@H+](Cc1c[nH]nc1-c1ccccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000179315862 1034109000 /nfs/dbraw/zinc/10/90/00/1034109000.db2.gz BBFWYOHMQXBGDC-UHFFFAOYSA-N 1 1 340.358 3.756 20 5 EHBDMO COc1cccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000604012373 1034135772 /nfs/dbraw/zinc/13/57/72/1034135772.db2.gz JQFKILVQXPVJGK-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141118 1034146635 /nfs/dbraw/zinc/14/66/35/1034146635.db2.gz BKZIGRNOIQSMRG-SZTZYQKNSA-N 1 1 344.333 3.651 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141118 1034146640 /nfs/dbraw/zinc/14/66/40/1034146640.db2.gz BKZIGRNOIQSMRG-SZTZYQKNSA-N 1 1 344.333 3.651 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000596309294 1034165363 /nfs/dbraw/zinc/16/53/63/1034165363.db2.gz XTHSRAQWEGCKGH-CYBMUJFWSA-N 1 1 328.416 3.675 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@](C)(O)c1ccccc1 ZINC000179374587 1034260215 /nfs/dbraw/zinc/26/02/15/1034260215.db2.gz JRGZWXDYJYFBNC-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@](C)(O)c1ccccc1 ZINC000179374587 1034260231 /nfs/dbraw/zinc/26/02/31/1034260231.db2.gz JRGZWXDYJYFBNC-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571728 1034293921 /nfs/dbraw/zinc/29/39/21/1034293921.db2.gz ZEUVPSOXNXQMDG-OAHLLOKOSA-N 1 1 345.443 3.721 20 5 EHBDMO COCc1csc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000596980364 1034480169 /nfs/dbraw/zinc/48/01/69/1034480169.db2.gz YXDGFUDMDDUYLR-UHFFFAOYSA-N 1 1 332.425 3.967 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000597225651 1034626068 /nfs/dbraw/zinc/62/60/68/1034626068.db2.gz RYHFNJUPGURRBV-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(CO)CCC1 ZINC000597256976 1034629808 /nfs/dbraw/zinc/62/98/08/1034629808.db2.gz ZFTSGGPLPYBYKG-UHFFFAOYSA-N 1 1 332.425 3.670 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]CCOC(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612574886 1035069145 /nfs/dbraw/zinc/06/91/45/1035069145.db2.gz QEUUVKISTWVODG-SFHVURJKSA-N 1 1 332.400 3.854 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+]([C@H](C)c3ccsc3)CC2)n1 ZINC000613188202 1035444609 /nfs/dbraw/zinc/44/46/09/1035444609.db2.gz UOSCPFJPMLTNEQ-CQSZACIVSA-N 1 1 346.456 3.551 20 5 EHBDMO Cn1cc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655303 1035446787 /nfs/dbraw/zinc/44/67/87/1035446787.db2.gz FFNWWEVGUCISAO-GOSISDBHSA-N 1 1 340.427 3.616 20 5 EHBDMO C[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129445 1035603413 /nfs/dbraw/zinc/60/34/13/1035603413.db2.gz OKVNABLJFOSDOT-MRXNPFEDSA-N 1 1 339.439 3.910 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936043 1035673849 /nfs/dbraw/zinc/67/38/49/1035673849.db2.gz VDSZQKCASXEWDV-WBVHZDCISA-N 1 1 326.396 3.852 20 5 EHBDMO C[N@@H+](CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CCCC1 ZINC000582611032 1036036959 /nfs/dbraw/zinc/03/69/59/1036036959.db2.gz JCCWWWWYGGBTFX-OAHLLOKOSA-N 1 1 345.365 3.662 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC000492781987 1036284912 /nfs/dbraw/zinc/28/49/12/1036284912.db2.gz FKQURVNNTUZFHK-QFBILLFUSA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC000492781987 1036284933 /nfs/dbraw/zinc/28/49/33/1036284933.db2.gz FKQURVNNTUZFHK-QFBILLFUSA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC000492781988 1036286013 /nfs/dbraw/zinc/28/60/13/1036286013.db2.gz FKQURVNNTUZFHK-VQIMIIECSA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@H](Cc2ccccc2)C1 ZINC000492781988 1036286017 /nfs/dbraw/zinc/28/60/17/1036286017.db2.gz FKQURVNNTUZFHK-VQIMIIECSA-N 1 1 340.423 3.908 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000376366675 1036323704 /nfs/dbraw/zinc/32/37/04/1036323704.db2.gz HYDYLHPFIFUKSZ-CQSZACIVSA-N 1 1 331.803 3.708 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000589281438 1036338886 /nfs/dbraw/zinc/33/88/86/1036338886.db2.gz HFNRDCVUDKWDCV-BEFAXECRSA-N 1 1 337.423 3.793 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000589299840 1036345045 /nfs/dbraw/zinc/34/50/45/1036345045.db2.gz BQVMEPKBKBEMPK-UHFFFAOYSA-N 1 1 330.409 3.712 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000589299840 1036345063 /nfs/dbraw/zinc/34/50/63/1036345063.db2.gz BQVMEPKBKBEMPK-UHFFFAOYSA-N 1 1 330.409 3.712 20 5 EHBDMO COc1cc(C[N@@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464691277 1036672489 /nfs/dbraw/zinc/67/24/89/1036672489.db2.gz OPAIEXDWAGWVPS-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO COc1cc(C[N@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464691277 1036672497 /nfs/dbraw/zinc/67/24/97/1036672497.db2.gz OPAIEXDWAGWVPS-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1=CCCOC1 ZINC000597206839 1036859671 /nfs/dbraw/zinc/85/96/71/1036859671.db2.gz UHXIFZNMGBGWJF-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)n1 ZINC000541935858 1036861474 /nfs/dbraw/zinc/86/14/74/1036861474.db2.gz NAETWWQEKLWUHA-WBVHZDCISA-N 1 1 340.427 3.854 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519662 1037097159 /nfs/dbraw/zinc/09/71/59/1037097159.db2.gz CYQXVXHRORRXDG-CQSZACIVSA-N 1 1 325.840 3.602 20 5 EHBDMO CC[C@@H]1CCCCN1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519662 1037097174 /nfs/dbraw/zinc/09/71/74/1037097174.db2.gz CYQXVXHRORRXDG-CQSZACIVSA-N 1 1 325.840 3.602 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@H]2/C=C\c2cccs2)n1 ZINC000542131641 1037108578 /nfs/dbraw/zinc/10/85/78/1037108578.db2.gz NKZDUSHJMZKCTR-LZNQSLFOSA-N 1 1 346.456 3.811 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000591061788 1037223636 /nfs/dbraw/zinc/22/36/36/1037223636.db2.gz IJRZIFUAFMCBLT-IUODEOHRSA-N 1 1 342.399 3.828 20 5 EHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850255 1037281117 /nfs/dbraw/zinc/28/11/17/1037281117.db2.gz LBHMWFDPMLXVSP-GOSISDBHSA-N 1 1 328.412 3.676 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899997 1037342224 /nfs/dbraw/zinc/34/22/24/1037342224.db2.gz MFHWOCCRKNSHRX-SJORKVTESA-N 1 1 332.444 3.967 20 5 EHBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150536 1037623182 /nfs/dbraw/zinc/62/31/82/1037623182.db2.gz FURLWNZUSZQCEC-DLBZAZTESA-N 1 1 333.476 3.922 20 5 EHBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150536 1037623185 /nfs/dbraw/zinc/62/31/85/1037623185.db2.gz FURLWNZUSZQCEC-DLBZAZTESA-N 1 1 333.476 3.922 20 5 EHBDMO C[C@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2)c1)[NH+]1CCOCC1 ZINC000540297784 1037774868 /nfs/dbraw/zinc/77/48/68/1037774868.db2.gz QBFINBNAEGWUAC-CQSZACIVSA-N 1 1 327.384 3.732 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccc(F)cc2)C2CC2)c1 ZINC000058562842 1038124186 /nfs/dbraw/zinc/12/41/86/1038124186.db2.gz VZXVOSNHFANPDN-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO Cc1cccc([C@@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001167735184 1038444565 /nfs/dbraw/zinc/44/45/65/1038444565.db2.gz UTQFLTWBBXGVSJ-IBGZPJMESA-N 1 1 326.396 3.601 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1CC(C)C ZINC000500471383 1038780761 /nfs/dbraw/zinc/78/07/61/1038780761.db2.gz TWVRXSRIOFTUTJ-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1CC(C)C ZINC000500471384 1038782212 /nfs/dbraw/zinc/78/22/12/1038782212.db2.gz TWVRXSRIOFTUTJ-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc(F)cc2C)c([N+](=O)[O-])cc1OC ZINC000488588881 1039287324 /nfs/dbraw/zinc/28/73/24/1039287324.db2.gz LXBDVNPNHSMGKI-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc(F)cc2C)c([N+](=O)[O-])cc1OC ZINC000488588881 1039287335 /nfs/dbraw/zinc/28/73/35/1039287335.db2.gz LXBDVNPNHSMGKI-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO CCCCn1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC000893289626 1039379913 /nfs/dbraw/zinc/37/99/13/1039379913.db2.gz JNFCVMVHGCGYAY-UHFFFAOYSA-N 1 1 336.823 3.843 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCCOC4)o2)cc1 ZINC000342836623 1039702100 /nfs/dbraw/zinc/70/21/00/1039702100.db2.gz KMUXOTBUQOGMCK-IBGZPJMESA-N 1 1 342.395 3.857 20 5 EHBDMO C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000028955121 1039964683 /nfs/dbraw/zinc/96/46/83/1039964683.db2.gz AMIGMDLRQCOUHM-LBPRGKRZSA-N 1 1 347.802 3.562 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOCC34CC4)s2)cc1 ZINC000549847102 1040034977 /nfs/dbraw/zinc/03/49/77/1040034977.db2.gz BFEYTTLDPAJRFJ-UHFFFAOYSA-N 1 1 330.409 3.688 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOCC34CC4)s2)cc1 ZINC000549847102 1040034993 /nfs/dbraw/zinc/03/49/93/1040034993.db2.gz BFEYTTLDPAJRFJ-UHFFFAOYSA-N 1 1 330.409 3.688 20 5 EHBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000192954495 1040327208 /nfs/dbraw/zinc/32/72/08/1040327208.db2.gz QEIDECPBAWAJNH-AWEZNQCLSA-N 1 1 346.818 3.577 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000486936600 1040583913 /nfs/dbraw/zinc/58/39/13/1040583913.db2.gz GDVYCTKKUCJQLI-UHFFFAOYSA-N 1 1 349.475 3.942 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000490561512 1040611116 /nfs/dbraw/zinc/61/11/16/1040611116.db2.gz CWMUWJBJNFWWQQ-GOSISDBHSA-N 1 1 344.386 3.568 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCOc2ccccc2F)C2CC2)cc1 ZINC000490823402 1040751786 /nfs/dbraw/zinc/75/17/86/1040751786.db2.gz FVXAKBBWKCRBKP-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO COC(=O)[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509782844 1040815193 /nfs/dbraw/zinc/81/51/93/1040815193.db2.gz OCLPGSSZLRYUAC-LBPRGKRZSA-N 1 1 348.424 3.564 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491087487 1040908629 /nfs/dbraw/zinc/90/86/29/1040908629.db2.gz JGZDQTNELPJMQD-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000078333061 1041029298 /nfs/dbraw/zinc/02/92/98/1041029298.db2.gz MQMUGEZRGAIYSI-UHFFFAOYSA-N 1 1 328.294 3.621 20 5 EHBDMO COC(=O)c1cc([C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202497 1041057786 /nfs/dbraw/zinc/05/77/86/1041057786.db2.gz RBTQPBKBJYBRJY-LBPRGKRZSA-N 1 1 346.383 3.518 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000481682991 1041231376 /nfs/dbraw/zinc/23/13/76/1041231376.db2.gz BWZIIGNESLIDGG-FQEVSTJZSA-N 1 1 338.407 3.659 20 5 EHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820818 1042906473 /nfs/dbraw/zinc/90/64/73/1042906473.db2.gz WUSMMBICVPLTBQ-SJORKVTESA-N 1 1 336.432 3.716 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000432339478 1042972544 /nfs/dbraw/zinc/97/25/44/1042972544.db2.gz ITYXSOHXACWZBI-WFASDCNBSA-N 1 1 335.835 3.701 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000432339476 1042972609 /nfs/dbraw/zinc/97/26/09/1042972609.db2.gz ITYXSOHXACWZBI-IUODEOHRSA-N 1 1 335.835 3.701 20 5 EHBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@@H]1CCCC[N@H+]1C ZINC000765525279 1127640214 /nfs/dbraw/zinc/64/02/14/1127640214.db2.gz CJZPAOZZUGFURQ-SJORKVTESA-N 1 1 348.443 3.581 20 5 EHBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@@H]1CCCC[N@H+]1C ZINC000765525277 1127640314 /nfs/dbraw/zinc/64/03/14/1127640314.db2.gz CJZPAOZZUGFURQ-IRXDYDNUSA-N 1 1 348.443 3.581 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000301293617 1127735525 /nfs/dbraw/zinc/73/55/25/1127735525.db2.gz WEBDZMDMOCAHHJ-CQSZACIVSA-N 1 1 346.818 3.720 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000301455311 1128345887 /nfs/dbraw/zinc/34/58/87/1128345887.db2.gz YOQVSVIAXRKXSG-XJKSGUPXSA-N 1 1 346.456 3.855 20 5 EHBDMO CCOc1cc(NCC[N@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301514983 1128485089 /nfs/dbraw/zinc/48/50/89/1128485089.db2.gz JOVDYFHZGNRTLU-UHFFFAOYSA-N 1 1 347.440 3.525 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000301554963 1128496288 /nfs/dbraw/zinc/49/62/88/1128496288.db2.gz ICXPBAWNVXSAHO-GXSJLCMTSA-N 1 1 329.322 3.651 20 5 EHBDMO Cc1nc(NCc2ccccc2C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000301622589 1128765900 /nfs/dbraw/zinc/76/59/00/1128765900.db2.gz FVFVQDUIIFCIOO-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@H+]1Cc1ccccc1 ZINC000301636022 1128777229 /nfs/dbraw/zinc/77/72/29/1128777229.db2.gz WRDYUQICNGYRKI-TZMCWYRMSA-N 1 1 346.818 3.718 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](CCO)c1ccccc1 ZINC000542927502 1128849370 /nfs/dbraw/zinc/84/93/70/1128849370.db2.gz LBOFCNMXDNOKOI-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](CCO)c1ccccc1 ZINC000542927502 1128849374 /nfs/dbraw/zinc/84/93/74/1128849374.db2.gz LBOFCNMXDNOKOI-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673404 1128902645 /nfs/dbraw/zinc/90/26/45/1128902645.db2.gz RJWAONUPVYSHLT-WMLDXEAASA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000303753353 1121180675 /nfs/dbraw/zinc/18/06/75/1121180675.db2.gz MJPGDCZXNNXSNW-MRXNPFEDSA-N 1 1 328.412 3.845 20 5 EHBDMO Cc1cc(NC[C@H](C)[N@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301067610 1121302527 /nfs/dbraw/zinc/30/25/27/1121302527.db2.gz CEKKBOPPARSNQY-ZDUSSCGKSA-N 1 1 331.441 3.823 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCSC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272484932 1121662524 /nfs/dbraw/zinc/66/25/24/1121662524.db2.gz CSEOGDWYYDBDHJ-OAHLLOKOSA-N 1 1 348.472 3.539 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000282119437 1121798104 /nfs/dbraw/zinc/79/81/04/1121798104.db2.gz ARLBJMHYTCUNRL-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000282119442 1121798329 /nfs/dbraw/zinc/79/83/29/1121798329.db2.gz ARLBJMHYTCUNRL-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO COc1ccc(C[N@@H+](C)C2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000153798028 1122008791 /nfs/dbraw/zinc/00/87/91/1122008791.db2.gz LIQFIUCBMNMRRP-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000130650726 1122144892 /nfs/dbraw/zinc/14/48/92/1122144892.db2.gz PHGHZZWSUFLRDJ-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO C[C@H]([NH2+]Cc1nc2cc(Cl)ccc2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000488134021 1122208820 /nfs/dbraw/zinc/20/88/20/1122208820.db2.gz ZNPHYJSIKCTRRV-NSHDSACASA-N 1 1 344.802 3.986 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(N2CCC[N@@H+](Cc3ccccc3)CC2)c(F)c1 ZINC000301793476 1129086070 /nfs/dbraw/zinc/08/60/70/1129086070.db2.gz PFJSBCOIUDJTTM-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000609323421 1123475247 /nfs/dbraw/zinc/47/52/47/1123475247.db2.gz JDYCDTVLGDZHGX-OAHLLOKOSA-N 1 1 344.386 3.992 20 5 EHBDMO CC(C)[N@H+](CC(=O)N[C@@H]1CCCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350442 1123573272 /nfs/dbraw/zinc/57/32/72/1123573272.db2.gz JDNKUODSXUYMEZ-CRAIPNDOSA-N 1 1 347.459 3.500 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N[C@@H]1CCCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350442 1123573274 /nfs/dbraw/zinc/57/32/74/1123573274.db2.gz JDNKUODSXUYMEZ-CRAIPNDOSA-N 1 1 347.459 3.500 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000610003516 1123711644 /nfs/dbraw/zinc/71/16/44/1123711644.db2.gz GUFJCGIUAPDLOV-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301827771 1129143518 /nfs/dbraw/zinc/14/35/18/1129143518.db2.gz FUTNLCPLXOIZSC-NVXWUHKLSA-N 1 1 333.338 3.730 20 5 EHBDMO Cn1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C(C)(C)C)n1 ZINC000179694804 1123826305 /nfs/dbraw/zinc/82/63/05/1123826305.db2.gz KAGYTVLKNFTOKR-UHFFFAOYSA-N 1 1 342.443 3.790 20 5 EHBDMO Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C(C)(C)C)n1 ZINC000179694804 1123826307 /nfs/dbraw/zinc/82/63/07/1123826307.db2.gz KAGYTVLKNFTOKR-UHFFFAOYSA-N 1 1 342.443 3.790 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000615837654 1123885373 /nfs/dbraw/zinc/88/53/73/1123885373.db2.gz SNGNOTOVPMBHPH-QMDZLVRISA-N 1 1 337.423 3.958 20 5 EHBDMO COc1cc(C[N@H+]2CCCC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000170872737 1123928928 /nfs/dbraw/zinc/92/89/28/1123928928.db2.gz YWZZPFXVYIPLJY-UHFFFAOYSA-N 1 1 330.331 3.579 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CC1CC1)C1CCCCC1 ZINC000069079474 1124451816 /nfs/dbraw/zinc/45/18/16/1124451816.db2.gz VNNOFXHVBAUVRD-UHFFFAOYSA-N 1 1 345.443 3.886 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000069472430 1124801843 /nfs/dbraw/zinc/80/18/43/1124801843.db2.gz RHIMLUBFULEGKN-INIZCTEOSA-N 1 1 347.462 3.850 20 5 EHBDMO C[C@H]1CO[C@@H](c2ccccc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851866 1129216486 /nfs/dbraw/zinc/21/64/86/1129216486.db2.gz IFPUYHOMJJFCKJ-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181737 1129316430 /nfs/dbraw/zinc/31/64/30/1129316430.db2.gz IYXZSELUSQFTLB-CABCVRRESA-N 1 1 331.416 3.518 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000116276252 1129348886 /nfs/dbraw/zinc/34/88/86/1129348886.db2.gz DLYLVDMAYDLYKL-INIZCTEOSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000116276252 1129348887 /nfs/dbraw/zinc/34/88/87/1129348887.db2.gz DLYLVDMAYDLYKL-INIZCTEOSA-N 1 1 331.803 3.935 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000086187637 1129423932 /nfs/dbraw/zinc/42/39/32/1129423932.db2.gz YDYSHVRRMGCQRB-ZDUSSCGKSA-N 1 1 337.383 3.965 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000117345596 1129434974 /nfs/dbraw/zinc/43/49/74/1129434974.db2.gz NDZJMPULANTXPX-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383676 1129504176 /nfs/dbraw/zinc/50/41/76/1129504176.db2.gz CLSQHRJCGPYMRK-CHWSQXEVSA-N 1 1 326.824 3.764 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301995349 1129508811 /nfs/dbraw/zinc/50/88/11/1129508811.db2.gz SJRFABWFGQUODO-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO Cc1ccc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)n2c1 ZINC000154274751 1129545577 /nfs/dbraw/zinc/54/55/77/1129545577.db2.gz UTAKZZPVPMIZFX-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1ccc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)n2c1 ZINC000154274751 1129545581 /nfs/dbraw/zinc/54/55/81/1129545581.db2.gz UTAKZZPVPMIZFX-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000092436350 1129546027 /nfs/dbraw/zinc/54/60/27/1129546027.db2.gz ZZZQJZDQMSEYMZ-JGIVAVPZSA-N 1 1 342.395 3.882 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000092436350 1129546029 /nfs/dbraw/zinc/54/60/29/1129546029.db2.gz ZZZQJZDQMSEYMZ-JGIVAVPZSA-N 1 1 342.395 3.882 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000330640046 1129642114 /nfs/dbraw/zinc/64/21/14/1129642114.db2.gz HLCAUZVKNFNEBD-SOXILONMSA-N 1 1 347.459 3.575 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000331075870 1129652564 /nfs/dbraw/zinc/65/25/64/1129652564.db2.gz WDVWGTMYWVFDSU-HUUCEWRRSA-N 1 1 348.447 3.548 20 5 EHBDMO COc1cc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000347778498 1129749639 /nfs/dbraw/zinc/74/96/39/1129749639.db2.gz DORDLMLZTDNABW-HNNXBMFYSA-N 1 1 333.413 3.609 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000096992917 1129753753 /nfs/dbraw/zinc/75/37/53/1129753753.db2.gz VVVDCXKMHBVGSS-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)c1cccs1 ZINC000096992917 1129753756 /nfs/dbraw/zinc/75/37/56/1129753756.db2.gz VVVDCXKMHBVGSS-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000157327654 1129757920 /nfs/dbraw/zinc/75/79/20/1129757920.db2.gz PLUVQNUSPDYSNX-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302040821 1129765211 /nfs/dbraw/zinc/76/52/11/1129765211.db2.gz HYTJPRWNDBIZAP-RYUDHWBXSA-N 1 1 339.386 3.938 20 5 EHBDMO Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302167186 1129771280 /nfs/dbraw/zinc/77/12/80/1129771280.db2.gz LCXFBKGOJSEKIL-MRXNPFEDSA-N 1 1 340.427 3.516 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000030002469 1129909901 /nfs/dbraw/zinc/90/99/01/1129909901.db2.gz WTBJLUFGVZFCJJ-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000030002469 1129909903 /nfs/dbraw/zinc/90/99/03/1129909903.db2.gz WTBJLUFGVZFCJJ-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO Cc1nc(C[C@@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514441 1130228611 /nfs/dbraw/zinc/22/86/11/1130228611.db2.gz BWLNLPPWYBNUAD-ZFWWWQNUSA-N 1 1 344.415 3.610 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173464995 1130235708 /nfs/dbraw/zinc/23/57/08/1130235708.db2.gz KZVOWUFJBFCTGU-RYUDHWBXSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173464995 1130235716 /nfs/dbraw/zinc/23/57/16/1130235716.db2.gz KZVOWUFJBFCTGU-RYUDHWBXSA-N 1 1 348.353 3.515 20 5 EHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000174832765 1130387414 /nfs/dbraw/zinc/38/74/14/1130387414.db2.gz MGOWVQHNRDITBK-CYBMUJFWSA-N 1 1 328.372 3.621 20 5 EHBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000727823336 1130600273 /nfs/dbraw/zinc/60/02/73/1130600273.db2.gz IUKKZWDSVIZYMG-UHFFFAOYSA-N 1 1 345.399 3.505 20 5 EHBDMO CO[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(F)(F)F ZINC000733329379 1131027140 /nfs/dbraw/zinc/02/71/40/1131027140.db2.gz RVESSWHJRDDJJZ-CQSZACIVSA-N 1 1 344.289 3.522 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000347948968 1131101550 /nfs/dbraw/zinc/10/15/50/1131101550.db2.gz AFVXGANCYUBYLS-CQSZACIVSA-N 1 1 336.823 3.839 20 5 EHBDMO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885977 1131553596 /nfs/dbraw/zinc/55/35/96/1131553596.db2.gz BJZQEJJGDOTRNS-HUUCEWRRSA-N 1 1 326.824 3.884 20 5 EHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885977 1131553601 /nfs/dbraw/zinc/55/36/01/1131553601.db2.gz BJZQEJJGDOTRNS-HUUCEWRRSA-N 1 1 326.824 3.884 20 5 EHBDMO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885975 1131554390 /nfs/dbraw/zinc/55/43/90/1131554390.db2.gz BJZQEJJGDOTRNS-CABCVRRESA-N 1 1 326.824 3.884 20 5 EHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885975 1131554395 /nfs/dbraw/zinc/55/43/95/1131554395.db2.gz BJZQEJJGDOTRNS-CABCVRRESA-N 1 1 326.824 3.884 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NCCC[N@@H+](C)Cc2ccccc2)c1 ZINC000741746440 1131638805 /nfs/dbraw/zinc/63/88/05/1131638805.db2.gz JKRPWOCGACHGLF-UHFFFAOYSA-N 1 1 347.390 3.677 20 5 EHBDMO CC(C)CN1CCC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172901710 1131884591 /nfs/dbraw/zinc/88/45/91/1131884591.db2.gz JLHWSXIPFXNYPE-GOSISDBHSA-N 1 1 345.487 3.552 20 5 EHBDMO CC[N@@H+](Cc1ccncc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172905052 1131886092 /nfs/dbraw/zinc/88/60/92/1131886092.db2.gz BUFMIZWSTBFCNC-SFHVURJKSA-N 1 1 325.412 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](F)C(F)(F)CC1)CC2 ZINC001172907903 1131888008 /nfs/dbraw/zinc/88/80/08/1131888008.db2.gz JJPLPXJAMUCTLY-GOEBONIOSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](c3ccccn3)C1)CC2 ZINC001172914251 1131902300 /nfs/dbraw/zinc/90/23/00/1131902300.db2.gz FSYUFEQUSQZVQT-ZWKOTPCHSA-N 1 1 337.423 3.727 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](C(F)(F)F)C1)CC2 ZINC001172914274 1131902678 /nfs/dbraw/zinc/90/26/78/1131902678.db2.gz GFDYQZACDTXDLG-UONOGXRCSA-N 1 1 328.334 3.726 20 5 EHBDMO CCC[N@@H+](C1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922586 1131907091 /nfs/dbraw/zinc/90/70/91/1131907091.db2.gz YYFRTNICJWEKKV-KRWDZBQOSA-N 1 1 332.444 3.733 20 5 EHBDMO CC(C)[N@@H+](C1CCN(C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911755 1131917809 /nfs/dbraw/zinc/91/78/09/1131917809.db2.gz FRFPFYKIEAZMRD-SFHVURJKSA-N 1 1 345.487 3.647 20 5 EHBDMO C[N@@H+](CC1CCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014759 1131935910 /nfs/dbraw/zinc/93/59/10/1131935910.db2.gz AKIWUTJIAKOPEC-UHFFFAOYSA-N 1 1 339.386 3.574 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2cccc(O)c2)c1F ZINC001173180347 1131992561 /nfs/dbraw/zinc/99/25/61/1131992561.db2.gz JXYDBENJVRAVTD-LBPRGKRZSA-N 1 1 348.374 3.511 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC(F)(F)CC2)c1F ZINC001173180687 1131992740 /nfs/dbraw/zinc/99/27/40/1131992740.db2.gz LWRVMAZTYDEPQW-LLVKDONJSA-N 1 1 346.349 3.795 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCCC[C@](C)(F)C2)c1F ZINC001173181900 1131993448 /nfs/dbraw/zinc/99/34/48/1131993448.db2.gz QGBRFVHCPJKKPB-PXAZEXFGSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@](C)(F)C2)c1F ZINC001173181900 1131993455 /nfs/dbraw/zinc/99/34/55/1131993455.db2.gz QGBRFVHCPJKKPB-PXAZEXFGSA-N 1 1 342.386 3.888 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001173219313 1132003514 /nfs/dbraw/zinc/00/35/14/1132003514.db2.gz ATMIYKWVIVZBGE-DOTOQJQBSA-N 1 1 331.460 3.522 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001173219313 1132003520 /nfs/dbraw/zinc/00/35/20/1132003520.db2.gz ATMIYKWVIVZBGE-DOTOQJQBSA-N 1 1 331.460 3.522 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001173228223 1132007981 /nfs/dbraw/zinc/00/79/81/1132007981.db2.gz UQFRABYZHQUGCF-GOEBONIOSA-N 1 1 348.443 3.580 20 5 EHBDMO C[N@@H+](CCc1ccc2c(c1)CCO2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000744385369 1132085584 /nfs/dbraw/zinc/08/55/84/1132085584.db2.gz YTFYYYYCRJPRFI-UHFFFAOYSA-N 1 1 346.814 3.858 20 5 EHBDMO CC(C)C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000746056034 1132358176 /nfs/dbraw/zinc/35/81/76/1132358176.db2.gz PPTMJKNQHLAOTG-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO CCOc1cc(C[N@H+]2CCSC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001175698487 1132729408 /nfs/dbraw/zinc/72/94/08/1132729408.db2.gz PTBUPLDDVYUNOT-MRXNPFEDSA-N 1 1 338.473 3.957 20 5 EHBDMO C[C@@H]1CCSCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001169980186 1133087728 /nfs/dbraw/zinc/08/77/28/1133087728.db2.gz VFWGJPWOSOGIDV-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001169980186 1133087732 /nfs/dbraw/zinc/08/77/32/1133087732.db2.gz VFWGJPWOSOGIDV-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO O=C1OC[C@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769482566 1133287768 /nfs/dbraw/zinc/28/77/68/1133287768.db2.gz ATOHCYHMBISZTI-QGZVFWFLSA-N 1 1 332.403 3.629 20 5 EHBDMO C[C@H]1COCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455709 1133294445 /nfs/dbraw/zinc/29/44/45/1133294445.db2.gz JLWATHFTVWMJCA-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO Cc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774834794 1134037546 /nfs/dbraw/zinc/03/75/46/1134037546.db2.gz IABPNYVBQXGLER-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774834794 1134037550 /nfs/dbraw/zinc/03/75/50/1134037550.db2.gz IABPNYVBQXGLER-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1 ZINC001185428577 1134084416 /nfs/dbraw/zinc/08/44/16/1134084416.db2.gz CKHORGORYMHRBW-INIZCTEOSA-N 1 1 325.412 3.696 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907253 1134115647 /nfs/dbraw/zinc/11/56/47/1134115647.db2.gz GHVBJHIXGZQUFS-CXAGYDPISA-N 1 1 341.367 3.881 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000788469584 1134128999 /nfs/dbraw/zinc/12/89/99/1134128999.db2.gz HBRVTGGXLPWPKP-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c2ccccc21 ZINC001186873536 1134264509 /nfs/dbraw/zinc/26/45/09/1134264509.db2.gz YFNDBCKTUNACBK-HZPDHXFCSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c2ccccc21 ZINC001186873535 1134264924 /nfs/dbraw/zinc/26/49/24/1134264924.db2.gz YFNDBCKTUNACBK-HOTGVXAUSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC001187243208 1134312911 /nfs/dbraw/zinc/31/29/11/1134312911.db2.gz SYDBUOMRSHOJPN-HNNXBMFYSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390242 1134334624 /nfs/dbraw/zinc/33/46/24/1134334624.db2.gz FMGLOCPSZNTMRQ-HNNXBMFYSA-N 1 1 346.818 3.638 20 5 EHBDMO CC(C)[N@@H+](CCN(C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527291 1134712757 /nfs/dbraw/zinc/71/27/57/1134712757.db2.gz GWQNMCMTVBAZNS-UHFFFAOYSA-N 1 1 327.428 3.942 20 5 EHBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](CC)c1ccccc1 ZINC001190581954 1134722294 /nfs/dbraw/zinc/72/22/94/1134722294.db2.gz KYXLKZUADUPMJV-KRWDZBQOSA-N 1 1 330.432 3.963 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170329558 1134749330 /nfs/dbraw/zinc/74/93/30/1134749330.db2.gz RJAHVCMLLZLVEU-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC001191368239 1134858018 /nfs/dbraw/zinc/85/80/18/1134858018.db2.gz YYKXFLVXSSLJKS-IAGOWNOFSA-N 1 1 336.457 3.724 20 5 EHBDMO C[C@@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000804606401 1135136123 /nfs/dbraw/zinc/13/61/23/1135136123.db2.gz LPUBJPMEHXKOHB-CHWSQXEVSA-N 1 1 348.403 3.568 20 5 EHBDMO CC[C@@H](C[N@@H+](CC)CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001193594111 1135155809 /nfs/dbraw/zinc/15/58/09/1135155809.db2.gz PMYGRNUIPMSJDT-INIZCTEOSA-N 1 1 330.432 3.615 20 5 EHBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834349 1135332563 /nfs/dbraw/zinc/33/25/63/1135332563.db2.gz FXIKGSHGOYLJKN-QZTJIDSGSA-N 1 1 344.411 3.720 20 5 EHBDMO CC(C)(C)OC(=O)C[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195798122 1135471505 /nfs/dbraw/zinc/47/15/05/1135471505.db2.gz MZVOZUXUHXOGHP-KRWDZBQOSA-N 1 1 348.443 3.724 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000807926263 1135591602 /nfs/dbraw/zinc/59/16/02/1135591602.db2.gz GDEDVPAIAODRHL-CQSZACIVSA-N 1 1 333.432 3.721 20 5 EHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761688 1135729125 /nfs/dbraw/zinc/72/91/25/1135729125.db2.gz QNAMVDLEQMFLHH-OALUTQOASA-N 1 1 344.411 3.720 20 5 EHBDMO C[N@@H+](CCc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001197826120 1135744374 /nfs/dbraw/zinc/74/43/74/1135744374.db2.gz JOWJLQCZWMWEAP-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCSC[C@@H]1C1CC1 ZINC001198270907 1135798587 /nfs/dbraw/zinc/79/85/87/1135798587.db2.gz SKZXLKIPADJJKB-OAHLLOKOSA-N 1 1 326.849 3.966 20 5 EHBDMO C[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)N1CCN(C)CC1 ZINC000105467023 1135948500 /nfs/dbraw/zinc/94/85/00/1135948500.db2.gz KBMDOFKVVZRDHU-GOSISDBHSA-N 1 1 347.506 3.719 20 5 EHBDMO C[N@H+](Cc1cccc2ccccc21)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278273 1136133772 /nfs/dbraw/zinc/13/37/72/1136133772.db2.gz TTWUJJGIZSTBFB-FQEVSTJZSA-N 1 1 336.391 3.913 20 5 EHBDMO Cc1ccc(C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000776280090 1136135356 /nfs/dbraw/zinc/13/53/56/1136135356.db2.gz ZJULPOUDGYHJKM-QGZVFWFLSA-N 1 1 334.441 3.909 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c(F)c1 ZINC000747840761 1136306877 /nfs/dbraw/zinc/30/68/77/1136306877.db2.gz SRKSQGUKILHNLQ-RBUKOAKNSA-N 1 1 344.386 3.822 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000776579582 1136444556 /nfs/dbraw/zinc/44/45/56/1136444556.db2.gz NRNUGIQQOYBPDW-KUHUBIRLSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@H]2Cc2ccccc2)cc1 ZINC000776581262 1136444968 /nfs/dbraw/zinc/44/49/68/1136444968.db2.gz GEQAPSOUFLUXIZ-VQTJNVASSA-N 1 1 340.423 3.725 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585596 1136448523 /nfs/dbraw/zinc/44/85/23/1136448523.db2.gz XLQDYMPCSRELSD-DOMZBBRYSA-N 1 1 349.456 3.649 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593022 1136453767 /nfs/dbraw/zinc/45/37/67/1136453767.db2.gz TUKXPSXDBHFJJB-IAGOWNOFSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593022 1136453769 /nfs/dbraw/zinc/45/37/69/1136453769.db2.gz TUKXPSXDBHFJJB-IAGOWNOFSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000814667692 1136492127 /nfs/dbraw/zinc/49/21/27/1136492127.db2.gz VDVXLLXOYROSNY-MAUKXSAKSA-N 1 1 346.814 3.771 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)cc1 ZINC000858014451 1136931294 /nfs/dbraw/zinc/93/12/94/1136931294.db2.gz LKFVOUMUNOEPGK-GOSISDBHSA-N 1 1 339.395 3.521 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030879 1136933719 /nfs/dbraw/zinc/93/37/19/1136933719.db2.gz BZNAVAYJTYHFIJ-WMLDXEAASA-N 1 1 327.384 3.513 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215044 1137008094 /nfs/dbraw/zinc/00/80/94/1137008094.db2.gz VAQWOEPTCNPZRI-OAHLLOKOSA-N 1 1 327.428 3.849 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@](C)(O)c1ccccc1 ZINC000823590558 1137105175 /nfs/dbraw/zinc/10/51/75/1137105175.db2.gz DZJIOROMBNIBRQ-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000823659960 1137108499 /nfs/dbraw/zinc/10/84/99/1137108499.db2.gz AQTZZBJJYXINDZ-KRWDZBQOSA-N 1 1 334.391 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1Cl ZINC000862540662 1137149461 /nfs/dbraw/zinc/14/94/61/1137149461.db2.gz IYIQTBSQHDEAIX-CQSZACIVSA-N 1 1 332.787 3.943 20 5 EHBDMO NC(CCC(F)(F)F)=[NH+]OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000863490047 1137188927 /nfs/dbraw/zinc/18/89/27/1137188927.db2.gz CAWVAMMXSNYOTF-UHFFFAOYSA-N 1 1 325.674 3.589 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cc2cc(F)ccc2F)CC1 ZINC001171098149 1137193289 /nfs/dbraw/zinc/19/32/89/1137193289.db2.gz IHUZUADXFVGHGB-UHFFFAOYSA-N 1 1 347.365 3.723 20 5 EHBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000844255943 1137208168 /nfs/dbraw/zinc/20/81/68/1137208168.db2.gz RESOZOCLSASLNR-CQSZACIVSA-N 1 1 339.395 3.543 20 5 EHBDMO C[C@@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1F ZINC000846013158 1137325950 /nfs/dbraw/zinc/32/59/50/1137325950.db2.gz KOEKBMHOFLKMOY-HWPZZCPQSA-N 1 1 338.766 3.599 20 5 EHBDMO C[C@@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000795122226 1137493111 /nfs/dbraw/zinc/49/31/11/1137493111.db2.gz QUPKPWHXWIJCLP-CYBMUJFWSA-N 1 1 337.851 3.554 20 5 EHBDMO C[C@H](NC[C@@H](c1ccsc1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017904 1137564790 /nfs/dbraw/zinc/56/47/90/1137564790.db2.gz GUWQZFMHHLPXOD-NHYWBVRUSA-N 1 1 337.420 3.749 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000872019141 1137564865 /nfs/dbraw/zinc/56/48/65/1137564865.db2.gz TZPMUGNVTGSGPD-RYUDHWBXSA-N 1 1 346.358 3.917 20 5 EHBDMO CCOc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872023391 1137565559 /nfs/dbraw/zinc/56/55/59/1137565559.db2.gz RMKBCOXFUSSIBR-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](c1ccccc1F)[C@@H](C)O ZINC000877609966 1137682880 /nfs/dbraw/zinc/68/28/80/1137682880.db2.gz GBFOYFXUSGLOTD-ACJLOTCBSA-N 1 1 332.375 3.562 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877936029 1137696245 /nfs/dbraw/zinc/69/62/45/1137696245.db2.gz QLYJIGUVYYNEDL-SNVBAGLBSA-N 1 1 336.779 3.673 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054897 1137700906 /nfs/dbraw/zinc/70/09/06/1137700906.db2.gz NAHCIYHOLCLRLE-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+](CCC2CC2)CC2CC2)o1 ZINC000878995337 1137734733 /nfs/dbraw/zinc/73/47/33/1137734733.db2.gz BXTILWPGZSSJGU-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061729 1137766849 /nfs/dbraw/zinc/76/68/49/1137766849.db2.gz ZZQYIJYKJGGYST-UHIISALHSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061729 1137766850 /nfs/dbraw/zinc/76/68/50/1137766850.db2.gz ZZQYIJYKJGGYST-UHIISALHSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880097043 1137768014 /nfs/dbraw/zinc/76/80/14/1137768014.db2.gz YUCHMMIMFZFENE-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO CCC[C@@H](C)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000883257587 1137850843 /nfs/dbraw/zinc/85/08/43/1137850843.db2.gz GDLJUUALKIRHIV-PBHICJAKSA-N 1 1 330.432 3.834 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CC1CCC(C(F)(F)F)CC1)CC2 ZINC000332498162 1137945626 /nfs/dbraw/zinc/94/56/26/1137945626.db2.gz CHKVCHPOYKFPGT-UHFFFAOYSA-N 1 1 343.349 3.717 20 5 EHBDMO CCOc1ccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])C(C)C)cc1 ZINC000885968855 1138029336 /nfs/dbraw/zinc/02/93/36/1138029336.db2.gz BTMSZJUFAAYDER-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO CCOc1ccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])C(C)C)cc1 ZINC000885968855 1138029338 /nfs/dbraw/zinc/02/93/38/1138029338.db2.gz BTMSZJUFAAYDER-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000886048966 1138035164 /nfs/dbraw/zinc/03/51/64/1138035164.db2.gz BZUWHZFLPAMGBJ-AWEZNQCLSA-N 1 1 338.367 3.511 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1OCC ZINC000886104639 1138047085 /nfs/dbraw/zinc/04/70/85/1138047085.db2.gz HHYMSBQXZRSUAK-CYBMUJFWSA-N 1 1 345.399 3.638 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000886296863 1138065395 /nfs/dbraw/zinc/06/53/95/1138065395.db2.gz CFBUZJIBRFRVCK-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000886296863 1138065398 /nfs/dbraw/zinc/06/53/98/1138065398.db2.gz CFBUZJIBRFRVCK-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C1 ZINC000066514939 1138075449 /nfs/dbraw/zinc/07/54/49/1138075449.db2.gz BHDNBDBPDAMAAD-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C1 ZINC000066514939 1138075450 /nfs/dbraw/zinc/07/54/50/1138075450.db2.gz BHDNBDBPDAMAAD-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cc3ccccc3[N+](=O)[O-])c2C1 ZINC000066514976 1138075597 /nfs/dbraw/zinc/07/55/97/1138075597.db2.gz VLWDNNOUWXBTRH-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cc3ccccc3[N+](=O)[O-])c2C1 ZINC000066514976 1138075599 /nfs/dbraw/zinc/07/55/99/1138075599.db2.gz VLWDNNOUWXBTRH-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C)CC1 ZINC000068837698 1138086304 /nfs/dbraw/zinc/08/63/04/1138086304.db2.gz RXSDBQYYTWVLNO-OLZOCXBDSA-N 1 1 330.388 3.828 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000074994520 1138125514 /nfs/dbraw/zinc/12/55/14/1138125514.db2.gz WHOXWNJRDKBCFS-CYBMUJFWSA-N 1 1 330.388 3.513 20 5 EHBDMO COc1cc(C[NH2+][C@@H]2CCc3c2cccc3F)c([N+](=O)[O-])cc1F ZINC000886927810 1138173250 /nfs/dbraw/zinc/17/32/50/1138173250.db2.gz XYNIEBLKGJWFTN-OAHLLOKOSA-N 1 1 334.322 3.659 20 5 EHBDMO CCOC[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093838651 1138241901 /nfs/dbraw/zinc/24/19/01/1138241901.db2.gz LPGNCMNLBWFXSX-ZDUSSCGKSA-N 1 1 347.440 3.577 20 5 EHBDMO C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000093871974 1138242377 /nfs/dbraw/zinc/24/23/77/1138242377.db2.gz GOLUCJWDQHUKSH-VQHVLOKHSA-N 1 1 329.444 3.558 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000337820728 1138675829 /nfs/dbraw/zinc/67/58/29/1138675829.db2.gz QPLZDLFXPGLZTF-UHFFFAOYSA-N 1 1 332.404 3.779 20 5 EHBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc3ccccc3c3cccnc13)C2 ZINC000174628443 1139431785 /nfs/dbraw/zinc/43/17/85/1139431785.db2.gz YPUYEFJSIWTGBZ-DLBZAZTESA-N 1 1 345.446 3.697 20 5 EHBDMO Cc1c(CN[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722960 1140166359 /nfs/dbraw/zinc/16/63/59/1140166359.db2.gz DVMCVPBQPOBQTI-NVXWUHKLSA-N 1 1 331.460 3.646 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCS[C@@H](C)CC1 ZINC000192175638 1140508432 /nfs/dbraw/zinc/50/84/32/1140508432.db2.gz ZPILTHLLYYXTRN-RYUDHWBXSA-N 1 1 348.428 3.533 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000271558773 1141397996 /nfs/dbraw/zinc/39/79/96/1141397996.db2.gz WIBDAPHEKCVWEI-KBPBESRZSA-N 1 1 346.456 3.856 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000175280130 1014348605 /nfs/dbraw/zinc/34/86/05/1014348605.db2.gz DTEHXYRUNJOJGF-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000584303776 1032100693 /nfs/dbraw/zinc/10/06/93/1032100693.db2.gz PFHSYYDYFVXYGV-SFHVURJKSA-N 1 1 330.359 3.544 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000584303776 1032100702 /nfs/dbraw/zinc/10/07/02/1032100702.db2.gz PFHSYYDYFVXYGV-SFHVURJKSA-N 1 1 330.359 3.544 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000198594720 1125488751 /nfs/dbraw/zinc/48/87/51/1125488751.db2.gz HPQZQNBZKJZKPH-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091919186 1015838711 /nfs/dbraw/zinc/83/87/11/1015838711.db2.gz YHXBEXIINQZPCJ-CQSZACIVSA-N 1 1 328.416 3.617 20 5 EHBDMO Cc1ccc(C[C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)cc1 ZINC001167263976 1016867080 /nfs/dbraw/zinc/86/70/80/1016867080.db2.gz HAZSLYQOCFOPDU-KRWDZBQOSA-N 1 1 325.412 3.753 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593524 1032314579 /nfs/dbraw/zinc/31/45/79/1032314579.db2.gz VOYBOPWMXNVOAE-SCLBCKFNSA-N 1 1 334.416 3.710 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835051 1032330169 /nfs/dbraw/zinc/33/01/69/1032330169.db2.gz ZGSGKAUHUBYGMZ-IAGOWNOFSA-N 1 1 333.476 3.922 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)CC(C)C ZINC000536891957 1032401681 /nfs/dbraw/zinc/40/16/81/1032401681.db2.gz BGKNRRQAXIFAPW-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC000449421835 1032556265 /nfs/dbraw/zinc/55/62/65/1032556265.db2.gz BXFLOMUYOOANPB-CXAGYDPISA-N 1 1 342.395 3.995 20 5 EHBDMO C[C@H]1CCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000761234300 1032609171 /nfs/dbraw/zinc/60/91/71/1032609171.db2.gz KVNVPTVIVFDGBW-AWEZNQCLSA-N 1 1 326.400 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc4ccccc4[nH]3)C2)cc1 ZINC000449498467 1032671069 /nfs/dbraw/zinc/67/10/69/1032671069.db2.gz KQFRZHRTBMIZHS-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4ccccc4[nH]3)C2)cc1 ZINC000449498467 1032671083 /nfs/dbraw/zinc/67/10/83/1032671083.db2.gz KQFRZHRTBMIZHS-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnn4ccccc34)C2)cc1 ZINC000449501188 1032680943 /nfs/dbraw/zinc/68/09/43/1032680943.db2.gz PGAWOHGJYQDMGZ-INIZCTEOSA-N 1 1 336.395 3.622 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449507235 1032692048 /nfs/dbraw/zinc/69/20/48/1032692048.db2.gz STLDSXKLSMUSKY-GUYCJALGSA-N 1 1 330.384 3.712 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947346 1017346537 /nfs/dbraw/zinc/34/65/37/1017346537.db2.gz KSHWCMUUFSKSCW-STQMWFEESA-N 1 1 331.441 3.553 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916479 1017429176 /nfs/dbraw/zinc/42/91/76/1017429176.db2.gz RKWFYLWZHTWTCX-INIZCTEOSA-N 1 1 344.386 3.677 20 5 EHBDMO COc1nc(C)cc(C)c1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892861495 1017602368 /nfs/dbraw/zinc/60/23/68/1017602368.db2.gz AOZAPNPJAJPMLG-UHFFFAOYSA-N 1 1 335.791 3.558 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000610285212 1017658605 /nfs/dbraw/zinc/65/86/05/1017658605.db2.gz PNKBZQBEYRPYEL-HNNXBMFYSA-N 1 1 331.441 3.615 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)o2)c1 ZINC000177528974 1017687426 /nfs/dbraw/zinc/68/74/26/1017687426.db2.gz ZKEDRILMUOVMMF-IYBDPMFKSA-N 1 1 341.411 3.914 20 5 EHBDMO Cc1ccc(C[N@H+](CCO)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000783030143 1017928564 /nfs/dbraw/zinc/92/85/64/1017928564.db2.gz GSWSQOKHMMEXNV-UHFFFAOYSA-N 1 1 334.803 3.551 20 5 EHBDMO Cc1ccc(C[N@@H+](CCO)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000783030143 1017928576 /nfs/dbraw/zinc/92/85/76/1017928576.db2.gz GSWSQOKHMMEXNV-UHFFFAOYSA-N 1 1 334.803 3.551 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)C1CC1 ZINC000072559231 1017943420 /nfs/dbraw/zinc/94/34/20/1017943420.db2.gz IQIVTFAYWWSORE-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C1CC1 ZINC000072559231 1017943434 /nfs/dbraw/zinc/94/34/34/1017943434.db2.gz IQIVTFAYWWSORE-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000118849886 1017993477 /nfs/dbraw/zinc/99/34/77/1017993477.db2.gz WALCDVDUTBFCFG-XPKDYRNWSA-N 1 1 342.399 3.798 20 5 EHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccco3)o2)c([N+](=O)[O-])c1 ZINC000102419378 1018524602 /nfs/dbraw/zinc/52/46/02/1018524602.db2.gz OKJHSIRYPPZQTA-UHFFFAOYSA-N 1 1 328.324 3.746 20 5 EHBDMO Cc1ccnc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000594008454 1032770877 /nfs/dbraw/zinc/77/08/77/1032770877.db2.gz OXEPKSFPMUSJKW-MRXNPFEDSA-N 1 1 341.411 3.557 20 5 EHBDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584730 /nfs/dbraw/zinc/58/47/30/1018584730.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584739 /nfs/dbraw/zinc/58/47/39/1018584739.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584747 /nfs/dbraw/zinc/58/47/47/1018584747.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CCO)c1ccccc1F ZINC000592402409 1032797363 /nfs/dbraw/zinc/79/73/63/1032797363.db2.gz GSWLBVZOKMYWAF-UGSOOPFHSA-N 1 1 332.375 3.817 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000419374436 1018972888 /nfs/dbraw/zinc/97/28/88/1018972888.db2.gz PVIFARGSWNYDJN-NOOOWODRSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000419374436 1018972902 /nfs/dbraw/zinc/97/29/02/1018972902.db2.gz PVIFARGSWNYDJN-NOOOWODRSA-N 1 1 339.823 3.552 20 5 EHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000025447905 1018979991 /nfs/dbraw/zinc/97/99/91/1018979991.db2.gz MMWFHRZFNDPOLD-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000025447905 1018980000 /nfs/dbraw/zinc/98/00/00/1018980000.db2.gz MMWFHRZFNDPOLD-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO CC[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427623 1032816810 /nfs/dbraw/zinc/81/68/10/1032816810.db2.gz JFBZSKYVLDHTCJ-CZUORRHYSA-N 1 1 345.468 3.883 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C1(C)COC1 ZINC001143388673 1020417263 /nfs/dbraw/zinc/41/72/63/1020417263.db2.gz SRZNEMKUISULKT-UHFFFAOYSA-N 1 1 349.434 3.737 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC001167453970 1020658747 /nfs/dbraw/zinc/65/87/47/1020658747.db2.gz PKACUIPBTDIAQD-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO Cc1ccc(-c2nn(C)cc2C[N@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000592497809 1032929942 /nfs/dbraw/zinc/92/99/42/1032929942.db2.gz HSSHPGGFOMZZAV-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO Cc1ccc(-c2nn(C)cc2C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000592497809 1032929952 /nfs/dbraw/zinc/92/99/52/1032929952.db2.gz HSSHPGGFOMZZAV-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO COC(=O)c1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135236715 1020927980 /nfs/dbraw/zinc/92/79/80/1020927980.db2.gz MLFJCGXUYMYJCP-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO COC(=O)c1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135236715 1020927983 /nfs/dbraw/zinc/92/79/83/1020927983.db2.gz MLFJCGXUYMYJCP-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436042 1021147998 /nfs/dbraw/zinc/14/79/98/1021147998.db2.gz YAQLVGKIUURGKP-GDBMZVCRSA-N 1 1 336.395 3.953 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000341253568 1021195158 /nfs/dbraw/zinc/19/51/58/1021195158.db2.gz CPPSBXJCKRBVCR-AWEZNQCLSA-N 1 1 341.411 3.504 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000439262693 1021286113 /nfs/dbraw/zinc/28/61/13/1021286113.db2.gz PSDDLPZWYRTDEL-LJQANCHMSA-N 1 1 328.412 3.758 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(c2ccccc2)CC1 ZINC000518582800 1021348852 /nfs/dbraw/zinc/34/88/52/1021348852.db2.gz XCMDCXZVEIAVMD-MRXNPFEDSA-N 1 1 325.412 3.868 20 5 EHBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1-c1ccccc1 ZINC000157899295 1021515217 /nfs/dbraw/zinc/51/52/17/1021515217.db2.gz OGJYAFZVVWUMPX-UHFFFAOYSA-N 1 1 336.395 3.590 20 5 EHBDMO Cn1cc(C[N@@H+](C)C[C@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519670679 1021611154 /nfs/dbraw/zinc/61/11/54/1021611154.db2.gz LOQQJBXNYAZFBP-HNNXBMFYSA-N 1 1 340.427 3.783 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(Cl)cc1O ZINC000602580304 1032997493 /nfs/dbraw/zinc/99/74/93/1032997493.db2.gz DBJKQRMHNCLJOU-SNVBAGLBSA-N 1 1 336.775 3.813 20 5 EHBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000924365987 1022087524 /nfs/dbraw/zinc/08/75/24/1022087524.db2.gz MWULXJGHBLTKQO-ZDUSSCGKSA-N 1 1 348.424 3.841 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]c(=O)oc21 ZINC000891624810 1022142456 /nfs/dbraw/zinc/14/24/56/1022142456.db2.gz HFUJMHXUFJERJS-UHFFFAOYSA-N 1 1 341.367 3.852 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000602651340 1033039910 /nfs/dbraw/zinc/03/99/10/1033039910.db2.gz HEHDOBKMWJQISD-HNNXBMFYSA-N 1 1 344.333 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550082469 1022368603 /nfs/dbraw/zinc/36/86/03/1022368603.db2.gz SPQGDSLZJLSXKB-GOSISDBHSA-N 1 1 346.814 3.864 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550082469 1022368618 /nfs/dbraw/zinc/36/86/18/1022368618.db2.gz SPQGDSLZJLSXKB-GOSISDBHSA-N 1 1 346.814 3.864 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000441424528 1022461731 /nfs/dbraw/zinc/46/17/31/1022461731.db2.gz IVMYTRMCMZNUPY-HNNXBMFYSA-N 1 1 328.412 3.709 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184224050 1022586282 /nfs/dbraw/zinc/58/62/82/1022586282.db2.gz DHZNQWCQCYURPW-LBPRGKRZSA-N 1 1 348.374 3.944 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184224050 1022586292 /nfs/dbraw/zinc/58/62/92/1022586292.db2.gz DHZNQWCQCYURPW-LBPRGKRZSA-N 1 1 348.374 3.944 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCOCC2)ccc1Oc1ccc(F)cc1 ZINC000510516698 1022631350 /nfs/dbraw/zinc/63/13/50/1022631350.db2.gz DSERTENQLNIBLQ-UHFFFAOYSA-N 1 1 346.358 3.749 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCOCC2)ccc1Oc1ccc(F)cc1 ZINC000510516698 1022631359 /nfs/dbraw/zinc/63/13/59/1022631359.db2.gz DSERTENQLNIBLQ-UHFFFAOYSA-N 1 1 346.358 3.749 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])cc1F ZINC000550208973 1022735882 /nfs/dbraw/zinc/73/58/82/1022735882.db2.gz DMIINWVJRNDZDV-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])cc1F ZINC000550208973 1022735892 /nfs/dbraw/zinc/73/58/92/1022735892.db2.gz DMIINWVJRNDZDV-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)o1 ZINC000510677328 1022875253 /nfs/dbraw/zinc/87/52/53/1022875253.db2.gz BVADQUVWMHZBIY-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)o1 ZINC000510677328 1022875271 /nfs/dbraw/zinc/87/52/71/1022875271.db2.gz BVADQUVWMHZBIY-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(C)C ZINC000341685544 1023014499 /nfs/dbraw/zinc/01/44/99/1023014499.db2.gz SCPLAGMUKYVKJK-MRXNPFEDSA-N 1 1 342.399 3.870 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(O)c1 ZINC000178376381 1023133316 /nfs/dbraw/zinc/13/33/16/1023133316.db2.gz PTONWCDCIXORGK-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](CCO)C2)s1 ZINC000093106415 1023151886 /nfs/dbraw/zinc/15/18/86/1023151886.db2.gz IZSLTAUWJUCDKF-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000507178792 1023165402 /nfs/dbraw/zinc/16/54/02/1023165402.db2.gz IYODXWPTBAAAJQ-MRXNPFEDSA-N 1 1 326.396 3.772 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441489000 1023208481 /nfs/dbraw/zinc/20/84/81/1023208481.db2.gz INDGGQUCWCADKQ-UONOGXRCSA-N 1 1 336.432 3.881 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232496 /nfs/dbraw/zinc/23/24/96/1023232496.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 1 1 345.487 3.724 20 5 EHBDMO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])C(C)C ZINC000602806233 1033180484 /nfs/dbraw/zinc/18/04/84/1033180484.db2.gz PTJUMTWBFCZSBU-INIZCTEOSA-N 1 1 342.399 3.870 20 5 EHBDMO COc1ccccc1C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000522269015 1024127267 /nfs/dbraw/zinc/12/72/67/1024127267.db2.gz OXUAKONHZBDXAO-UHFFFAOYSA-N 1 1 326.396 3.811 20 5 EHBDMO CC(=O)c1cc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232317 1024497668 /nfs/dbraw/zinc/49/76/68/1024497668.db2.gz YCYNPBUTAGAKOU-CQSZACIVSA-N 1 1 341.411 3.730 20 5 EHBDMO CC(C)C[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000474233402 1024614343 /nfs/dbraw/zinc/61/43/43/1024614343.db2.gz PKZNSOZWHDVZAB-UHFFFAOYSA-N 1 1 335.448 3.562 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCOC[C@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000430131414 1024663308 /nfs/dbraw/zinc/66/33/08/1024663308.db2.gz LVYZMJDPWZVBKU-QGZVFWFLSA-N 1 1 332.444 3.967 20 5 EHBDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000508042005 1024868053 /nfs/dbraw/zinc/86/80/53/1024868053.db2.gz QUYKRFXKIVUNQK-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000508042005 1024868071 /nfs/dbraw/zinc/86/80/71/1024868071.db2.gz QUYKRFXKIVUNQK-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC[NH2+]CC1 ZINC000435383965 1024869225 /nfs/dbraw/zinc/86/92/25/1024869225.db2.gz KSKSPWDTYZYZQG-UHFFFAOYSA-N 1 1 331.441 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889922 1033245040 /nfs/dbraw/zinc/24/50/40/1033245040.db2.gz XAMPVCFOVPVQEF-MRXNPFEDSA-N 1 1 334.379 3.528 20 5 EHBDMO CO[C@H]1CC[C@@H](C)[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926394 1024980286 /nfs/dbraw/zinc/98/02/86/1024980286.db2.gz DPJJLVOSBGUPNN-WBMJQRKESA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@H]1CC[C@@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926394 1024980297 /nfs/dbraw/zinc/98/02/97/1024980297.db2.gz DPJJLVOSBGUPNN-WBMJQRKESA-N 1 1 347.440 3.718 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](CCO)c1ccc(Cl)c(F)c1 ZINC000602926765 1033256257 /nfs/dbraw/zinc/25/62/57/1033256257.db2.gz XLYZVBJIYKOMRQ-OAHLLOKOSA-N 1 1 338.766 3.601 20 5 EHBDMO CCn1nc(C)c(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926404 1033256888 /nfs/dbraw/zinc/25/68/88/1033256888.db2.gz PQTKFDPOKHYZCQ-AWEZNQCLSA-N 1 1 330.432 3.929 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926404 1033256897 /nfs/dbraw/zinc/25/68/97/1033256897.db2.gz PQTKFDPOKHYZCQ-AWEZNQCLSA-N 1 1 330.432 3.929 20 5 EHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000435770334 1025130292 /nfs/dbraw/zinc/13/02/92/1025130292.db2.gz OOTRCWJKKQQPSE-QGZVFWFLSA-N 1 1 346.431 3.513 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000515501430 1025292390 /nfs/dbraw/zinc/29/23/90/1025292390.db2.gz GLEHBXTWFYPSJK-INIZCTEOSA-N 1 1 330.359 3.950 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240798 1025489481 /nfs/dbraw/zinc/48/94/81/1025489481.db2.gz RFGPMOAFHOPEDG-JSGCOSHPSA-N 1 1 333.432 3.741 20 5 EHBDMO C[C@@H]1[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000310399065 1025494124 /nfs/dbraw/zinc/49/41/24/1025494124.db2.gz UBVDILRTWNRYBB-WBMJQRKESA-N 1 1 346.818 3.718 20 5 EHBDMO COCC[N@H+](CCCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505788413 1025551742 /nfs/dbraw/zinc/55/17/42/1025551742.db2.gz BFKWYRGXXBEYNC-UHFFFAOYSA-N 1 1 346.402 3.815 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505788413 1025551754 /nfs/dbraw/zinc/55/17/54/1025551754.db2.gz BFKWYRGXXBEYNC-UHFFFAOYSA-N 1 1 346.402 3.815 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCN3CCCCCC3)o2)cc1 ZINC000521820419 1025708661 /nfs/dbraw/zinc/70/86/61/1025708661.db2.gz UWBCVYJCVNVYIV-UHFFFAOYSA-N 1 1 343.427 3.820 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451354536 1025861034 /nfs/dbraw/zinc/86/10/34/1025861034.db2.gz RZDMZDBNCRMFSJ-WQCNXYOZSA-N 1 1 332.444 3.980 20 5 EHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730870 1025915807 /nfs/dbraw/zinc/91/58/07/1025915807.db2.gz QXGRHFSAPVHZKC-SUMWQHHRSA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000451544741 1026091786 /nfs/dbraw/zinc/09/17/86/1026091786.db2.gz FPIIBRHRPQTHED-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ncc(C4CC4)o3)C2)cc1 ZINC000451544741 1026091803 /nfs/dbraw/zinc/09/18/03/1026091803.db2.gz FPIIBRHRPQTHED-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO Cc1nccn1CCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552123 1026105898 /nfs/dbraw/zinc/10/58/98/1026105898.db2.gz VQYRHQSTVZTRPE-SFHVURJKSA-N 1 1 342.443 3.760 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1(C)C ZINC000451554870 1026108503 /nfs/dbraw/zinc/10/85/03/1026108503.db2.gz QLNOZRVZDCMHRB-KRWDZBQOSA-N 1 1 336.432 3.629 20 5 EHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501150417 1027099934 /nfs/dbraw/zinc/09/99/34/1027099934.db2.gz MPIVSGKYQNWVTE-AWEZNQCLSA-N 1 1 333.432 3.824 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000237095794 1027522126 /nfs/dbraw/zinc/52/21/26/1027522126.db2.gz DOKIZWFZECSRKJ-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCCOC4)o2)c1 ZINC000342836341 1027550830 /nfs/dbraw/zinc/55/08/30/1027550830.db2.gz JIGKTGMJYWKXFW-IBGZPJMESA-N 1 1 342.395 3.857 20 5 EHBDMO Cc1cc(NCCCC[N@H+](C)C2CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000413348071 1027571054 /nfs/dbraw/zinc/57/10/54/1027571054.db2.gz NCPVFTKPGJVFFC-UHFFFAOYSA-N 1 1 328.416 3.738 20 5 EHBDMO Cc1ccc(N2CCC(Nc3ccc(F)cc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000078305551 1027656730 /nfs/dbraw/zinc/65/67/30/1027656730.db2.gz RGCUXKQCUJFCIQ-UHFFFAOYSA-N 1 1 330.363 3.518 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503656013 1028007456 /nfs/dbraw/zinc/00/74/56/1028007456.db2.gz YMIGEBYZTAMROD-CQSZACIVSA-N 1 1 330.359 3.602 20 5 EHBDMO CC(C)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001167634019 1028143540 /nfs/dbraw/zinc/14/35/40/1028143540.db2.gz HKVNCCISQIXSKY-AWEZNQCLSA-N 1 1 333.432 3.680 20 5 EHBDMO C[C@H](N[C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144924 1028206066 /nfs/dbraw/zinc/20/60/66/1028206066.db2.gz IITODWJQSXXXPY-UCLAIMLFSA-N 1 1 325.412 3.739 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](CN)C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263496 1028302388 /nfs/dbraw/zinc/30/23/88/1028302388.db2.gz ONIYCTQSCNLKDS-CZUORRHYSA-N 1 1 335.448 3.552 20 5 EHBDMO CCOc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289693 1028325626 /nfs/dbraw/zinc/32/56/26/1028325626.db2.gz BONIFYZXZZEDHF-KGLIPLIRSA-N 1 1 343.427 3.864 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(F)cc1N(C)C ZINC000178730149 1028378419 /nfs/dbraw/zinc/37/84/19/1028378419.db2.gz GHAKCIYIYWUKLJ-GFCCVEGCSA-N 1 1 347.390 3.659 20 5 EHBDMO CCc1ccc([C@@H](N[C@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438986 1028447060 /nfs/dbraw/zinc/44/70/60/1028447060.db2.gz RWWVTGUBHYVZOG-KUHUBIRLSA-N 1 1 345.443 3.947 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000523701624 1028553682 /nfs/dbraw/zinc/55/36/82/1028553682.db2.gz MEWIXCOFALJUKY-QGZVFWFLSA-N 1 1 326.396 3.593 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000347376204 1028804604 /nfs/dbraw/zinc/80/46/04/1028804604.db2.gz ZXLMWYKYWMGKIP-DKGMDFAASA-N 1 1 326.400 3.601 20 5 EHBDMO Cc1cc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cn2cc[nH+]c12 ZINC000503022032 1028979600 /nfs/dbraw/zinc/97/96/00/1028979600.db2.gz DRJDTEGMGJURAZ-UHFFFAOYSA-N 1 1 338.367 3.728 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926341 1029071134 /nfs/dbraw/zinc/07/11/34/1029071134.db2.gz IFXOJFJNEITEKA-PMPSAXMXSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926341 1029071154 /nfs/dbraw/zinc/07/11/54/1029071154.db2.gz IFXOJFJNEITEKA-PMPSAXMXSA-N 1 1 349.475 3.765 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285229 1029573509 /nfs/dbraw/zinc/57/35/09/1029573509.db2.gz XUAKTXAIKNBLPT-JSGCOSHPSA-N 1 1 333.432 3.741 20 5 EHBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890941 1029842962 /nfs/dbraw/zinc/84/29/62/1029842962.db2.gz RKEAYSJBNSWOIL-FUKPKEADSA-N 1 1 346.427 3.519 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2ccccc2)CC1 ZINC000441215841 1030009635 /nfs/dbraw/zinc/00/96/35/1030009635.db2.gz GBDNGXBYHKZIFV-INIZCTEOSA-N 1 1 325.412 3.868 20 5 EHBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000583546967 1030088578 /nfs/dbraw/zinc/08/85/78/1030088578.db2.gz YYFMGQSTVJUIQA-AEFFLSMTSA-N 1 1 330.428 3.684 20 5 EHBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980948 1030128906 /nfs/dbraw/zinc/12/89/06/1030128906.db2.gz XVBMJJKQEKDPQY-GXTWGEPZSA-N 1 1 330.359 3.818 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@H+]1C1CC1 ZINC000583666504 1030395861 /nfs/dbraw/zinc/39/58/61/1030395861.db2.gz BXUPSIHINWMCBK-OCCSQVGLSA-N 1 1 333.432 3.809 20 5 EHBDMO CC(C)(C)OC(=O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000343412209 1030765677 /nfs/dbraw/zinc/76/56/77/1030765677.db2.gz GEVBIOWQVJDLJY-UHFFFAOYSA-N 1 1 334.416 3.681 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360665 1030986112 /nfs/dbraw/zinc/98/61/12/1030986112.db2.gz CORVCHKFCXLNDS-YOEHRIQHSA-N 1 1 344.411 3.980 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000533928270 1031285058 /nfs/dbraw/zinc/28/50/58/1031285058.db2.gz OQJXQIZTHKQKBU-AWEZNQCLSA-N 1 1 345.443 3.908 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000533928270 1031285066 /nfs/dbraw/zinc/28/50/66/1031285066.db2.gz OQJXQIZTHKQKBU-AWEZNQCLSA-N 1 1 345.443 3.908 20 5 EHBDMO O=[N+]([O-])c1ccccc1CCNC1CC[NH+](C2CCCCC2)CC1 ZINC000483717754 1031296216 /nfs/dbraw/zinc/29/62/16/1031296216.db2.gz YJMBCMWMGFQGJG-UHFFFAOYSA-N 1 1 331.460 3.524 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737962 1031703022 /nfs/dbraw/zinc/70/30/22/1031703022.db2.gz HERGFMCDWSRMQA-AGIUHOORSA-N 1 1 330.388 3.511 20 5 EHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312500 1031770972 /nfs/dbraw/zinc/77/09/72/1031770972.db2.gz DXUSMCVFXVQFBC-SFHVURJKSA-N 1 1 329.400 3.539 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000593589670 1033362616 /nfs/dbraw/zinc/36/26/16/1033362616.db2.gz UNZBZYDCDWJYEJ-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580856 1033571231 /nfs/dbraw/zinc/57/12/31/1033571231.db2.gz XCLZTCPNWBWQJB-HIFRSBDPSA-N 1 1 331.441 3.836 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\CN[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594977986 1033579746 /nfs/dbraw/zinc/57/97/46/1033579746.db2.gz PGAQYJMMUXDPCX-QLBOMPFWSA-N 1 1 329.444 3.605 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCN(C2CCCCC2)C1 ZINC000594977986 1033579750 /nfs/dbraw/zinc/57/97/50/1033579750.db2.gz PGAQYJMMUXDPCX-QLBOMPFWSA-N 1 1 329.444 3.605 20 5 EHBDMO CC(C)c1ncc2c(n1)CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000598935426 1033590604 /nfs/dbraw/zinc/59/06/04/1033590604.db2.gz GNROCAQUEBZDOB-FNORWQNLSA-N 1 1 338.411 3.580 20 5 EHBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014749 1033606680 /nfs/dbraw/zinc/60/66/80/1033606680.db2.gz HXFCFAPLELLJLG-LLVKDONJSA-N 1 1 333.388 3.567 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H](C)C2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595068078 1033643419 /nfs/dbraw/zinc/64/34/19/1033643419.db2.gz OENAGXLRBYZZQQ-SCLBCKFNSA-N 1 1 344.411 3.590 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327727 1033730858 /nfs/dbraw/zinc/73/08/58/1033730858.db2.gz RHQZDZMLUCNZRI-HOTGVXAUSA-N 1 1 329.400 3.968 20 5 EHBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595411000 1033790215 /nfs/dbraw/zinc/79/02/15/1033790215.db2.gz KZEOFRPQLJYDQL-AWEZNQCLSA-N 1 1 332.375 3.507 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595436474 1033803551 /nfs/dbraw/zinc/80/35/51/1033803551.db2.gz CPYSRLBXTKLQJA-ZDUSSCGKSA-N 1 1 349.431 3.674 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000595449938 1033814918 /nfs/dbraw/zinc/81/49/18/1033814918.db2.gz QYKMEYSAHCEEGQ-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000595449938 1033814938 /nfs/dbraw/zinc/81/49/38/1033814938.db2.gz QYKMEYSAHCEEGQ-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO CC[N@@H+](CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C(C)C ZINC000593705193 1033816493 /nfs/dbraw/zinc/81/64/93/1033816493.db2.gz QWBZAWUNNFAVHP-AWEZNQCLSA-N 1 1 333.354 3.518 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000595466833 1033819935 /nfs/dbraw/zinc/81/99/35/1033819935.db2.gz NLYBEIFXJCTCMP-UHFFFAOYSA-N 1 1 335.791 3.924 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]1CCO ZINC000595696270 1033950667 /nfs/dbraw/zinc/95/06/67/1033950667.db2.gz KAVRNQYCQWUPBP-IAQYHMDHSA-N 1 1 346.349 3.597 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1cccc([N+](=O)[O-])c1C ZINC000603846526 1033969671 /nfs/dbraw/zinc/96/96/71/1033969671.db2.gz HWCQIJHIJFOXRB-UHFFFAOYSA-N 1 1 328.368 3.654 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599570027 1034003680 /nfs/dbraw/zinc/00/36/80/1034003680.db2.gz SHGRIVHVLZJEJS-SFHVURJKSA-N 1 1 327.384 3.629 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](CC3CCCCC3)CC2)cs1 ZINC000603937362 1034054574 /nfs/dbraw/zinc/05/45/74/1034054574.db2.gz DYFAXWZSEGQGCN-UHFFFAOYSA-N 1 1 337.489 3.744 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092475 1034077709 /nfs/dbraw/zinc/07/77/09/1034077709.db2.gz ANXVASDKIBDLBR-OXJNMPFZSA-N 1 1 343.471 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092475 1034077725 /nfs/dbraw/zinc/07/77/25/1034077725.db2.gz ANXVASDKIBDLBR-OXJNMPFZSA-N 1 1 343.471 3.684 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000596161784 1034114108 /nfs/dbraw/zinc/11/41/08/1034114108.db2.gz KGXYYXJDIGYTGH-LBPRGKRZSA-N 1 1 327.375 3.922 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688048 1034115480 /nfs/dbraw/zinc/11/54/80/1034115480.db2.gz BNGUZGQGSJRJAW-SFAKSCPVSA-N 1 1 342.399 3.823 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604011991 1034136398 /nfs/dbraw/zinc/13/63/98/1034136398.db2.gz BPXQITFDVWVABJ-UHFFFAOYSA-N 1 1 344.411 3.894 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3CCC[N@@H+](CC4CC4)C3)c2c1 ZINC000596570367 1034292958 /nfs/dbraw/zinc/29/29/58/1034292958.db2.gz IQQLELYAFRUDDQ-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484187 1034389418 /nfs/dbraw/zinc/38/94/18/1034389418.db2.gz CNHSJGNVLHAVGU-SFHVURJKSA-N 1 1 328.368 3.516 20 5 EHBDMO COC[C@@H](C)Oc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000596978693 1034476719 /nfs/dbraw/zinc/47/67/19/1034476719.db2.gz APENYRMMQSYATD-OAHLLOKOSA-N 1 1 344.411 3.641 20 5 EHBDMO COC[C@@H](C)Oc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000596978693 1034476729 /nfs/dbraw/zinc/47/67/29/1034476729.db2.gz APENYRMMQSYATD-OAHLLOKOSA-N 1 1 344.411 3.641 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172176272 1034857769 /nfs/dbraw/zinc/85/77/69/1034857769.db2.gz QUVKNGKKQVMHRL-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO CC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CCC1 ZINC000230313572 1034862432 /nfs/dbraw/zinc/86/24/32/1034862432.db2.gz JOOXSXGIIRRQNA-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccco2)n1 ZINC000548936706 1035004612 /nfs/dbraw/zinc/00/46/12/1035004612.db2.gz ZOTFKFBMBDMGEX-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccco2)n1 ZINC000548936706 1035004619 /nfs/dbraw/zinc/00/46/19/1035004619.db2.gz ZOTFKFBMBDMGEX-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927682 1035077869 /nfs/dbraw/zinc/07/78/69/1035077869.db2.gz SQCFBAMUSNDDLZ-WBVHZDCISA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927682 1035077875 /nfs/dbraw/zinc/07/78/75/1035077875.db2.gz SQCFBAMUSNDDLZ-WBVHZDCISA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927679 1035077912 /nfs/dbraw/zinc/07/79/12/1035077912.db2.gz SQCFBAMUSNDDLZ-NVXWUHKLSA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927679 1035077920 /nfs/dbraw/zinc/07/79/20/1035077920.db2.gz SQCFBAMUSNDDLZ-NVXWUHKLSA-N 1 1 332.787 3.556 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573354 1035539976 /nfs/dbraw/zinc/53/99/76/1035539976.db2.gz RJBZRLUDQCVAFT-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO CN1CC[C@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573354 1035539993 /nfs/dbraw/zinc/53/99/93/1035539993.db2.gz RJBZRLUDQCVAFT-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO CCOc1ccccc1OCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000173471127 1035627903 /nfs/dbraw/zinc/62/79/03/1035627903.db2.gz KFKMKTRYFBDBTD-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CCOc1ccccc1OCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000173471127 1035627913 /nfs/dbraw/zinc/62/79/13/1035627913.db2.gz KFKMKTRYFBDBTD-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[N@H+](C)C(C)C ZINC000582247922 1035721189 /nfs/dbraw/zinc/72/11/89/1035721189.db2.gz UQKFBVMCOFIKME-GJZGRUSLSA-N 1 1 339.505 3.784 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[N@@H+](C)C(C)C ZINC000582247922 1035721205 /nfs/dbraw/zinc/72/12/05/1035721205.db2.gz UQKFBVMCOFIKME-GJZGRUSLSA-N 1 1 339.505 3.784 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1 ZINC000540906906 1035786528 /nfs/dbraw/zinc/78/65/28/1035786528.db2.gz AJWCMXNXBDGEAW-JKSUJKDBSA-N 1 1 347.459 3.694 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC000549409168 1035927835 /nfs/dbraw/zinc/92/78/35/1035927835.db2.gz WVSKQRFTFIDHCI-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@H]1CCCCO1 ZINC000492531542 1035934087 /nfs/dbraw/zinc/93/40/87/1035934087.db2.gz FZLVYITZVFEUIC-MRXNPFEDSA-N 1 1 336.432 3.775 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000780396957 1035995303 /nfs/dbraw/zinc/99/53/03/1035995303.db2.gz GRGGMFHENBNMTN-KALAYHLKSA-N 1 1 338.407 3.806 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc3cncn3c2)c2cc([N+](=O)[O-])ccc21 ZINC000414200618 1036023587 /nfs/dbraw/zinc/02/35/87/1036023587.db2.gz ZZPJZBGQCBASDN-GOSISDBHSA-N 1 1 336.395 3.755 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccccc1F ZINC000026224713 1036393372 /nfs/dbraw/zinc/39/33/72/1036393372.db2.gz YQOBKHIMGKUOMQ-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000026224411 1036394465 /nfs/dbraw/zinc/39/44/65/1036394465.db2.gz NHNMQCKWEMSMAV-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601501 1036966048 /nfs/dbraw/zinc/96/60/48/1036966048.db2.gz CMFLOQUQYJZZCG-CZUORRHYSA-N 1 1 328.416 3.515 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000152857435 1037000594 /nfs/dbraw/zinc/00/05/94/1037000594.db2.gz OXMLZPNPKKFNHV-GJZGRUSLSA-N 1 1 335.448 3.519 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3noc4c3CCCC4)C2)cc1 ZINC000590757332 1037027252 /nfs/dbraw/zinc/02/72/52/1037027252.db2.gz SOUKDKVUWYAJFS-HNNXBMFYSA-N 1 1 341.411 3.841 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000542247173 1037211958 /nfs/dbraw/zinc/21/19/58/1037211958.db2.gz OPSJXTAFLYANIJ-ZDUSSCGKSA-N 1 1 333.432 3.600 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@H](C)OC ZINC000462827492 1037431133 /nfs/dbraw/zinc/43/11/33/1037431133.db2.gz PSTDSGDXFSGPJV-ZDUSSCGKSA-N 1 1 348.399 3.720 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCOC1 ZINC000462868931 1037491755 /nfs/dbraw/zinc/49/17/55/1037491755.db2.gz TXBVBJIMKLOOOK-MRXNPFEDSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC(C)(C)C1 ZINC000412037209 1037573669 /nfs/dbraw/zinc/57/36/69/1037573669.db2.gz NFXMJBVKIQLUAI-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000592745935 1038120092 /nfs/dbraw/zinc/12/00/92/1038120092.db2.gz MKTZNGQIHJBFKI-CYBMUJFWSA-N 1 1 330.388 3.560 20 5 EHBDMO COc1ccc2oc(C[NH2+]Cc3cc([N+](=O)[O-])ccc3OC)cc2c1 ZINC000124996913 1038262696 /nfs/dbraw/zinc/26/26/96/1038262696.db2.gz BVWMFGIDFKIBPO-UHFFFAOYSA-N 1 1 342.351 3.648 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000470172231 1038447500 /nfs/dbraw/zinc/44/75/00/1038447500.db2.gz UCIFHHKMJDBRRU-GYTMMYARSA-N 1 1 330.428 3.747 20 5 EHBDMO Cc1ccncc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339145998 1038455397 /nfs/dbraw/zinc/45/53/97/1038455397.db2.gz SNTVUWQAJWZJNN-UHFFFAOYSA-N 1 1 339.317 3.949 20 5 EHBDMO Cc1ccncc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339145998 1038455403 /nfs/dbraw/zinc/45/54/03/1038455403.db2.gz SNTVUWQAJWZJNN-UHFFFAOYSA-N 1 1 339.317 3.949 20 5 EHBDMO CCn1cc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000538728633 1038496410 /nfs/dbraw/zinc/49/64/10/1038496410.db2.gz MOPCTYSNIFPFQV-UHFFFAOYSA-N 1 1 340.383 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ZINC000485746885 1039508650 /nfs/dbraw/zinc/50/86/50/1039508650.db2.gz UAKVXJKHBQEZGV-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000485769515 1039524565 /nfs/dbraw/zinc/52/45/65/1039524565.db2.gz YIKNZJGCPMBQNF-GOEBONIOSA-N 1 1 342.395 3.736 20 5 EHBDMO CCC[N@@H+]1CC[C@H](CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309056 1039663691 /nfs/dbraw/zinc/66/36/91/1039663691.db2.gz DFKABBOVOIVWRR-DNVCBOLYSA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309056 1039663697 /nfs/dbraw/zinc/66/36/97/1039663697.db2.gz DFKABBOVOIVWRR-DNVCBOLYSA-N 1 1 331.460 3.684 20 5 EHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349284 1039701552 /nfs/dbraw/zinc/70/15/52/1039701552.db2.gz KOAYLJNKVCKFEV-GUYCJALGSA-N 1 1 328.416 3.930 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(CCCC3)C2)c2c(c1)COCO2 ZINC000408415639 1039735366 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3.647 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000512673672 1040486608 /nfs/dbraw/zinc/48/66/08/1040486608.db2.gz PZNITONOQYNHGN-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(O)cc(F)c2)cc(C(F)(F)F)c1 ZINC000487183917 1040755936 /nfs/dbraw/zinc/75/59/36/1040755936.db2.gz XLQOHRUPQXPZEC-UHFFFAOYSA-N 1 1 344.264 3.748 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000555721207 1041058424 /nfs/dbraw/zinc/05/84/24/1041058424.db2.gz IRYKRCZGHRZCSG-WBVHZDCISA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC[C@@H](C)C1 ZINC000481604702 1041146155 /nfs/dbraw/zinc/14/61/55/1041146155.db2.gz ZYHVPOVZUUZLIJ-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@@H](C)C1 ZINC000481604702 1041146160 /nfs/dbraw/zinc/14/61/60/1041146160.db2.gz ZYHVPOVZUUZLIJ-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCCO1 ZINC000511662218 1041372776 /nfs/dbraw/zinc/37/27/76/1041372776.db2.gz ANWYRJLWUGDZLD-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000066869374 1041979338 /nfs/dbraw/zinc/97/93/38/1041979338.db2.gz RRMKPCLDIAJKNO-ZDUSSCGKSA-N 1 1 346.818 3.526 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112656376 1042416632 /nfs/dbraw/zinc/41/66/32/1042416632.db2.gz GLZVVTHSZLYJMZ-WFASDCNBSA-N 1 1 346.818 3.891 20 5 EHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000112699033 1042419709 /nfs/dbraw/zinc/41/97/09/1042419709.db2.gz MUTWLYNAGRUPBV-SFHVURJKSA-N 1 1 341.411 3.523 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(NC[C@H]3CCCC[N@H+]3C3CC3)sc2c1 ZINC000764940157 1127552488 /nfs/dbraw/zinc/55/24/88/1127552488.db2.gz FXUAOWQRKVNPTB-CYBMUJFWSA-N 1 1 332.429 3.633 20 5 EHBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@H]1CCCC[N@H+]1C ZINC000765525276 1127640271 /nfs/dbraw/zinc/64/02/71/1127640271.db2.gz CJZPAOZZUGFURQ-IAGOWNOFSA-N 1 1 348.443 3.581 20 5 EHBDMO C[C@@H]1CCN(C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225229 1127723132 /nfs/dbraw/zinc/72/31/32/1127723132.db2.gz DXQIURAFJTZACS-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@@H]1CC[N@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225229 1127723135 /nfs/dbraw/zinc/72/31/35/1127723135.db2.gz DXQIURAFJTZACS-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225229 1127723136 /nfs/dbraw/zinc/72/31/36/1127723136.db2.gz DXQIURAFJTZACS-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)c(OC)c1 ZINC000153590643 1128488331 /nfs/dbraw/zinc/48/83/31/1128488331.db2.gz NXXRGGUWVSZCAS-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301602404 1128515809 /nfs/dbraw/zinc/51/58/09/1128515809.db2.gz WHTMXMGDPLJALI-DOTOQJQBSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000273790047 1128667675 /nfs/dbraw/zinc/66/76/75/1128667675.db2.gz YLOYFHMQAKAWQL-GFCCVEGCSA-N 1 1 330.388 3.513 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326334686 1121648826 /nfs/dbraw/zinc/64/88/26/1121648826.db2.gz IJIYDXWYDQBPOJ-CQSZACIVSA-N 1 1 328.416 3.594 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326334686 1121648830 /nfs/dbraw/zinc/64/88/30/1121648830.db2.gz IJIYDXWYDQBPOJ-CQSZACIVSA-N 1 1 328.416 3.594 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000301104696 1121920347 /nfs/dbraw/zinc/92/03/47/1121920347.db2.gz VMIAJXLYRFLMSP-STQMWFEESA-N 1 1 329.322 3.652 20 5 EHBDMO COc1ccc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)cc1[N+](=O)[O-] ZINC000076904606 1122092309 /nfs/dbraw/zinc/09/23/09/1122092309.db2.gz KMCMKMWZYFDOEF-UHFFFAOYSA-N 1 1 335.429 3.702 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032791933 1122104017 /nfs/dbraw/zinc/10/40/17/1122104017.db2.gz WWFFJNWMEIPLFF-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCC[C@@H]1O ZINC000497264040 1122428542 /nfs/dbraw/zinc/42/85/42/1122428542.db2.gz VZSCOOCIXQXDGY-KDOFPFPSSA-N 1 1 344.411 3.838 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)c(F)c1 ZINC000917390988 1122595308 /nfs/dbraw/zinc/59/53/08/1122595308.db2.gz IBUCEYWQSAVOKH-UHFFFAOYSA-N 1 1 335.423 3.826 20 5 EHBDMO C[C@@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063479 1122800644 /nfs/dbraw/zinc/80/06/44/1122800644.db2.gz HAYGKLLVMPHCNK-KXBFYZLASA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)[C@@H]1CCc2ccccc2C1 ZINC000919951297 1123243691 /nfs/dbraw/zinc/24/36/91/1123243691.db2.gz QNXXOHVUDFGCKE-GOSISDBHSA-N 1 1 342.443 3.635 20 5 EHBDMO CCC1CCC([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000921046748 1123458733 /nfs/dbraw/zinc/45/87/33/1123458733.db2.gz QCWXEVOAXCWODT-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301813938 1129126715 /nfs/dbraw/zinc/12/67/15/1129126715.db2.gz FYRQELMIOCZRCF-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000609965249 1123699016 /nfs/dbraw/zinc/69/90/16/1123699016.db2.gz QIKWJEWOCVMAPF-UHFFFAOYSA-N 1 1 331.441 3.541 20 5 EHBDMO CCCN1CCC([NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652632 1123727391 /nfs/dbraw/zinc/72/73/91/1123727391.db2.gz MSVNPZWOQGSMKV-AWEZNQCLSA-N 1 1 335.448 3.519 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836013 1123884036 /nfs/dbraw/zinc/88/40/36/1123884036.db2.gz HCDDJXOIXIMFDU-DNXIFWLFSA-N 1 1 326.400 3.601 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](CCO)CCc1ccccc1 ZINC000615835598 1123884469 /nfs/dbraw/zinc/88/44/69/1123884469.db2.gz UPKAFMCRTKIXJU-VKAVYKQESA-N 1 1 340.423 3.535 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539655 1129160234 /nfs/dbraw/zinc/16/02/34/1129160234.db2.gz DNJUPBFKECSJOH-DOMZBBRYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837154 1129174878 /nfs/dbraw/zinc/17/48/78/1129174878.db2.gz MKASNDFHOUXTGE-HIFRSBDPSA-N 1 1 332.791 3.501 20 5 EHBDMO Cn1nccc1[C@@H]1CCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000619612791 1125369884 /nfs/dbraw/zinc/36/98/84/1125369884.db2.gz KHUZSWLKXFXYMR-POZKEBTKSA-N 1 1 326.400 3.569 20 5 EHBDMO Cn1nccc1[C@@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000619612791 1125369891 /nfs/dbraw/zinc/36/98/91/1125369891.db2.gz KHUZSWLKXFXYMR-POZKEBTKSA-N 1 1 326.400 3.569 20 5 EHBDMO CO[C@@H](C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808754 1125410565 /nfs/dbraw/zinc/41/05/65/1125410565.db2.gz ZIJBKBQBJGCBEK-IBGZPJMESA-N 1 1 326.396 3.947 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1cccc(F)c1[N+](=O)[O-] ZINC000301860640 1129227285 /nfs/dbraw/zinc/22/72/85/1129227285.db2.gz CEZUCYITICJFCC-OAHLLOKOSA-N 1 1 343.402 3.835 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000117342442 1129434997 /nfs/dbraw/zinc/43/49/97/1129434997.db2.gz XSLIRELBMMPVBM-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481054 1129590564 /nfs/dbraw/zinc/59/05/64/1129590564.db2.gz ZDFLICLIUBYECU-LLVKDONJSA-N 1 1 338.791 3.711 20 5 EHBDMO C[C@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000389949197 1129597642 /nfs/dbraw/zinc/59/76/42/1129597642.db2.gz WCBJVJQWFUAGMS-HNNXBMFYSA-N 1 1 336.395 3.690 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cn1 ZINC000390854223 1129638515 /nfs/dbraw/zinc/63/85/15/1129638515.db2.gz JYEDTCOEDPAEOZ-QGZVFWFLSA-N 1 1 340.427 3.702 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034608 1129764646 /nfs/dbraw/zinc/76/46/46/1129764646.db2.gz JMIDJNIIKMRSAU-GJZGRUSLSA-N 1 1 335.423 3.825 20 5 EHBDMO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302045566 1129764659 /nfs/dbraw/zinc/76/46/59/1129764659.db2.gz KILYNVKOMMVPCN-VXGBXAGGSA-N 1 1 338.839 3.708 20 5 EHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302061813 1129765664 /nfs/dbraw/zinc/76/56/64/1129765664.db2.gz UCGFKJRVXKVLCK-OLZOCXBDSA-N 1 1 348.403 3.568 20 5 EHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302061814 1129765817 /nfs/dbraw/zinc/76/58/17/1129765817.db2.gz UCGFKJRVXKVLCK-QWHCGFSZSA-N 1 1 348.403 3.568 20 5 EHBDMO Cc1cc(NCCc2cn3c([nH+]2)CCCC3)c(Cl)cc1[N+](=O)[O-] ZINC000302710003 1129787308 /nfs/dbraw/zinc/78/73/08/1129787308.db2.gz ZEYJJMADUQPAKV-UHFFFAOYSA-N 1 1 334.807 3.744 20 5 EHBDMO CC(C)[C@]1(CO)CC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC001117680572 1129790281 /nfs/dbraw/zinc/79/02/81/1129790281.db2.gz JCYSKWNVAFSPAV-OAHLLOKOSA-N 1 1 347.242 3.742 20 5 EHBDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC001117680572 1129790284 /nfs/dbraw/zinc/79/02/84/1129790284.db2.gz JCYSKWNVAFSPAV-OAHLLOKOSA-N 1 1 347.242 3.742 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)c2c(c1)COCO2 ZINC000055927961 1129790565 /nfs/dbraw/zinc/79/05/65/1129790565.db2.gz UBOVJDFPKCQGGJ-QGZVFWFLSA-N 1 1 332.400 3.616 20 5 EHBDMO Cc1n[nH]cc1C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601161376 1129867093 /nfs/dbraw/zinc/86/70/93/1129867093.db2.gz HWJFJQWXOOTBFP-UHFFFAOYSA-N 1 1 337.383 3.559 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000429157472 1129900403 /nfs/dbraw/zinc/90/04/03/1129900403.db2.gz VHIZCHYLFJJIGK-MGPLVRAMSA-N 1 1 336.388 3.588 20 5 EHBDMO CC[N@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907093 1130330173 /nfs/dbraw/zinc/33/01/73/1130330173.db2.gz FJFVBIMQLOFCHF-OXJNMPFZSA-N 1 1 339.439 3.616 20 5 EHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000175119273 1130408214 /nfs/dbraw/zinc/40/82/14/1130408214.db2.gz WIISSNNKKXXUSZ-INIZCTEOSA-N 1 1 329.400 3.539 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892967 1130858179 /nfs/dbraw/zinc/85/81/79/1130858179.db2.gz LTSYSDOPIUKWIP-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892967 1130858186 /nfs/dbraw/zinc/85/81/86/1130858186.db2.gz LTSYSDOPIUKWIP-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021845 1131570832 /nfs/dbraw/zinc/57/08/32/1131570832.db2.gz QGCGTCIVXUNFRA-TUAOUCFPSA-N 1 1 340.807 3.553 20 5 EHBDMO O=[N+]([O-])c1cn(C[N@@H+](C2CC2)C2CCCCC2)nc1-c1ccncc1 ZINC000742145069 1131690623 /nfs/dbraw/zinc/69/06/23/1131690623.db2.gz LLKGKIKNLFHMBN-UHFFFAOYSA-N 1 1 341.415 3.608 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172908610 1131887149 /nfs/dbraw/zinc/88/71/49/1131887149.db2.gz DYLSZBTYYCEWMO-SFHVURJKSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3ccsc3C1)CC2 ZINC001172914605 1131902760 /nfs/dbraw/zinc/90/27/60/1131902760.db2.gz IFCFVGBJZLZNSZ-MRXNPFEDSA-N 1 1 328.437 3.962 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](c3cccnc3)C1)CC2 ZINC001172915537 1131903176 /nfs/dbraw/zinc/90/31/76/1131903176.db2.gz OPGPJTKXIRCVRN-RTBURBONSA-N 1 1 337.423 3.727 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2Cl)COC1 ZINC001173220871 1132004426 /nfs/dbraw/zinc/00/44/26/1132004426.db2.gz HKLDQHGWBSXSAT-ZDUSSCGKSA-N 1 1 346.814 3.695 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231190 1132009555 /nfs/dbraw/zinc/00/95/55/1132009555.db2.gz KJQBWOIBRVURHN-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C(=O)c2ccccc2)C1 ZINC001173233807 1132010842 /nfs/dbraw/zinc/01/08/42/1132010842.db2.gz YYWJXLCQEINBSN-MAUKXSAKSA-N 1 1 338.407 3.731 20 5 EHBDMO CC(C)C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C1CCCC1 ZINC000746056276 1132358787 /nfs/dbraw/zinc/35/87/87/1132358787.db2.gz XKLXTCFBBCUFKV-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055412 1132644483 /nfs/dbraw/zinc/64/44/83/1132644483.db2.gz PXDFNMORLFYEOR-ZOWXZIJZSA-N 1 1 341.249 3.887 20 5 EHBDMO C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057912 1132646495 /nfs/dbraw/zinc/64/64/95/1132646495.db2.gz YXKXZQDVZAAALQ-HIFRSBDPSA-N 1 1 330.350 3.625 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1ccc(O)cc1 ZINC001169543041 1132782836 /nfs/dbraw/zinc/78/28/36/1132782836.db2.gz OCXSFCBTMIUTTK-ZDUSSCGKSA-N 1 1 341.411 3.504 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1ccc(O)cc1 ZINC001169543041 1132782843 /nfs/dbraw/zinc/78/28/43/1132782843.db2.gz OCXSFCBTMIUTTK-ZDUSSCGKSA-N 1 1 341.411 3.504 20 5 EHBDMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C1CCCC1 ZINC001176153308 1132865027 /nfs/dbraw/zinc/86/50/27/1132865027.db2.gz DMOSAILYOOOUEK-CYBMUJFWSA-N 1 1 337.851 3.697 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769856147 1133351738 /nfs/dbraw/zinc/35/17/38/1133351738.db2.gz SXOKDDOVEZFGCV-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1F)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769856147 1133351744 /nfs/dbraw/zinc/35/17/44/1133351744.db2.gz SXOKDDOVEZFGCV-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1c(Cl)cccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001180447316 1133371681 /nfs/dbraw/zinc/37/16/81/1133371681.db2.gz ZVLFNCGXWOWJSY-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000770379220 1133416891 /nfs/dbraw/zinc/41/68/91/1133416891.db2.gz JLSXFGQNDZCPCI-UHFFFAOYSA-N 1 1 338.407 3.707 20 5 EHBDMO CCOC(=O)CC(C)(C)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181878410 1133545760 /nfs/dbraw/zinc/54/57/60/1133545760.db2.gz ACGUVXYIXMWTOM-INIZCTEOSA-N 1 1 348.443 3.754 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C(=O)C1CC1 ZINC001182668278 1133713759 /nfs/dbraw/zinc/71/37/59/1133713759.db2.gz JWUKMEHZZRGSAW-UHFFFAOYSA-N 1 1 347.418 3.680 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC001185263139 1134059019 /nfs/dbraw/zinc/05/90/19/1134059019.db2.gz LXVIANAKTNOSBS-GOSISDBHSA-N 1 1 339.439 3.880 20 5 EHBDMO CC1(C)CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CCS1 ZINC000788377394 1134119165 /nfs/dbraw/zinc/11/91/65/1134119165.db2.gz UJYQGRSCLIUNIA-UHFFFAOYSA-N 1 1 346.456 3.633 20 5 EHBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788614601 1134151829 /nfs/dbraw/zinc/15/18/29/1134151829.db2.gz SWHALRKVKXFSRF-MNOVXSKESA-N 1 1 333.363 3.737 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(CC(F)(F)F)CC2)c1 ZINC000789528065 1134290799 /nfs/dbraw/zinc/29/07/99/1134290799.db2.gz NWNHNGYEFCFGJY-UHFFFAOYSA-N 1 1 342.321 3.566 20 5 EHBDMO CCC[N@@H+](CC)CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000218973051 1134460043 /nfs/dbraw/zinc/46/00/43/1134460043.db2.gz OBKULAALCCIUID-UHFFFAOYSA-N 1 1 330.226 3.501 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170336494 1134752258 /nfs/dbraw/zinc/75/22/58/1134752258.db2.gz XVYRRFBXXGNDET-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348452 1134759666 /nfs/dbraw/zinc/75/96/66/1134759666.db2.gz XBUUVKXJTJUNPW-LBPRGKRZSA-N 1 1 332.425 3.654 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@H+](CC1CCC1)CC2 ZINC000792895682 1134815707 /nfs/dbraw/zinc/81/57/07/1134815707.db2.gz ADQRIMKGFVVWTQ-UHFFFAOYSA-N 1 1 325.206 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@@H+](CC1CCC1)CC2 ZINC000792895682 1134815709 /nfs/dbraw/zinc/81/57/09/1134815709.db2.gz ADQRIMKGFVVWTQ-UHFFFAOYSA-N 1 1 325.206 3.516 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cccc1[N+](=O)[O-] ZINC000792912187 1134823341 /nfs/dbraw/zinc/82/33/41/1134823341.db2.gz YXFLRGCSLQBZJY-KGLIPLIRSA-N 1 1 329.227 3.919 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001192358023 1135005655 /nfs/dbraw/zinc/00/56/55/1135005655.db2.gz CRDROILHPYCFCX-CYBMUJFWSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477552 1135276470 /nfs/dbraw/zinc/27/64/70/1135276470.db2.gz MLIQADZJDBLRQC-SCTDSRPQSA-N 1 1 345.487 3.752 20 5 EHBDMO CC[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC001130585056 1135422885 /nfs/dbraw/zinc/42/28/85/1135422885.db2.gz CHIXFMLGMZTGFD-UHFFFAOYSA-N 1 1 347.459 3.678 20 5 EHBDMO CC(C)(C)OC(=O)C[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195798125 1135471571 /nfs/dbraw/zinc/47/15/71/1135471571.db2.gz MZVOZUXUHXOGHP-QGZVFWFLSA-N 1 1 348.443 3.724 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1C1CCC1 ZINC001195825507 1135477956 /nfs/dbraw/zinc/47/79/56/1135477956.db2.gz KKSXDCRYMKXAHS-GOSISDBHSA-N 1 1 345.443 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H](C4CC4)C3)c2)cc1 ZINC000808231188 1135633746 /nfs/dbraw/zinc/63/37/46/1135633746.db2.gz ZLZYIVXLDLZYJV-INIZCTEOSA-N 1 1 326.400 3.538 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2C[C@@H]3CC=CC[C@@H]3C2)c1 ZINC001197021457 1135642283 /nfs/dbraw/zinc/64/22/83/1135642283.db2.gz WPAADDHERQPZQC-TXEJJXNPSA-N 1 1 337.217 3.755 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563866 1135830914 /nfs/dbraw/zinc/83/09/14/1135830914.db2.gz TXPOPYPMTOLTCL-GJZGRUSLSA-N 1 1 338.835 3.887 20 5 EHBDMO Cc1cc(C)c2c(c1)CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC001198852312 1135860794 /nfs/dbraw/zinc/86/07/94/1135860794.db2.gz POVMRHGFOFDETH-UHFFFAOYSA-N 1 1 326.396 3.649 20 5 EHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812854327 1136262588 /nfs/dbraw/zinc/26/25/88/1136262588.db2.gz XEZHGCFAYGZBHH-SCLBCKFNSA-N 1 1 332.375 3.678 20 5 EHBDMO CCC(C)(C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173285 1136297714 /nfs/dbraw/zinc/29/77/14/1136297714.db2.gz XNXRABICOSEMOJ-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO CCC(C)(C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173285 1136297716 /nfs/dbraw/zinc/29/77/16/1136297716.db2.gz XNXRABICOSEMOJ-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+](C2CCC2)C1 ZINC000813630982 1136354517 /nfs/dbraw/zinc/35/45/17/1136354517.db2.gz UBNPOWRDABKORH-LBPRGKRZSA-N 1 1 346.456 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583103 1136441800 /nfs/dbraw/zinc/44/18/00/1136441800.db2.gz WJNYXEAIAMOZGM-MAUKXSAKSA-N 1 1 346.814 3.771 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585262 1136442466 /nfs/dbraw/zinc/44/24/66/1136442466.db2.gz SOJQKJJBLLGUMZ-LSBZLQRGSA-N 1 1 326.396 3.506 20 5 EHBDMO CC(C)C[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579184 1136444096 /nfs/dbraw/zinc/44/40/96/1136444096.db2.gz LKWMDGMXOMIGBJ-IBGZPJMESA-N 1 1 328.412 3.786 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000852426871 1136455454 /nfs/dbraw/zinc/45/54/54/1136455454.db2.gz PURCLXDHKAYYCH-FUHWJXTLSA-N 1 1 342.395 3.839 20 5 EHBDMO Cc1ccc2c(c1)C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C2 ZINC000815185516 1136563656 /nfs/dbraw/zinc/56/36/56/1136563656.db2.gz ILCMZTIFDIOSAL-LJQANCHMSA-N 1 1 340.423 3.774 20 5 EHBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774783 1136661298 /nfs/dbraw/zinc/66/12/98/1136661298.db2.gz OKJBUSBDADPSKT-KZNAEPCWSA-N 1 1 340.427 3.715 20 5 EHBDMO 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332.425 3.670 20 5 EHBDMO CCCC[N@@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000593705096 1033010887 /nfs/dbraw/zinc/01/08/87/1033010887.db2.gz LPTGQNQKRDPJOF-CQSZACIVSA-N 1 1 333.354 3.520 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)o1 ZINC000449684733 1033040171 /nfs/dbraw/zinc/04/01/71/1033040171.db2.gz MEWRTBIWXSOELE-IBGZPJMESA-N 1 1 342.395 3.857 20 5 EHBDMO CC(C)N(C)c1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000438347716 1022584317 /nfs/dbraw/zinc/58/43/17/1022584317.db2.gz UWIQQWFJRDIGMS-UHFFFAOYSA-N 1 1 331.391 3.868 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)[C@@H](C)O1 ZINC000438346895 1022585563 /nfs/dbraw/zinc/58/55/63/1022585563.db2.gz FEYCVKWXBZHJQK-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)[C@@H](C)O1 ZINC000438346895 1022585568 /nfs/dbraw/zinc/58/55/68/1022585568.db2.gz FEYCVKWXBZHJQK-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675771 1033078735 /nfs/dbraw/zinc/07/87/35/1033078735.db2.gz NEQNHMIFNNKDIG-VHSXEESVSA-N 1 1 343.305 3.899 20 5 EHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675771 1033078743 /nfs/dbraw/zinc/07/87/43/1033078743.db2.gz NEQNHMIFNNKDIG-VHSXEESVSA-N 1 1 343.305 3.899 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000441452440 1022867484 /nfs/dbraw/zinc/86/74/84/1022867484.db2.gz XFOQKKOKZYVICG-KRWDZBQOSA-N 1 1 334.416 3.527 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947339 1022970933 /nfs/dbraw/zinc/97/09/33/1022970933.db2.gz KSHWCMUUFSKSCW-CHWSQXEVSA-N 1 1 331.441 3.553 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378895 1023038795 /nfs/dbraw/zinc/03/87/95/1023038795.db2.gz GMQFXNJPEAGILE-OAHLLOKOSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378895 1023038803 /nfs/dbraw/zinc/03/88/03/1023038803.db2.gz GMQFXNJPEAGILE-OAHLLOKOSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000507178936 1023166028 /nfs/dbraw/zinc/16/60/28/1023166028.db2.gz JJZYWVALRDBIQE-MRXNPFEDSA-N 1 1 326.396 3.772 20 5 EHBDMO CC[N@@H+](CCc1ccccc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000507173326 1023173631 /nfs/dbraw/zinc/17/36/31/1023173631.db2.gz LTGCBQRJTGQROI-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(-n3cccn3)c2)C2CC2)c1 ZINC000507174507 1023174657 /nfs/dbraw/zinc/17/46/57/1023174657.db2.gz RPWCJMXEDXMRRM-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383496980 1023290465 /nfs/dbraw/zinc/29/04/65/1023290465.db2.gz XLPYTXDNYJDTMB-HNNXBMFYSA-N 1 1 329.375 3.668 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000610738801 1023403882 /nfs/dbraw/zinc/40/38/82/1023403882.db2.gz FCHCRIZXUHYMRX-UHFFFAOYSA-N 1 1 342.370 3.755 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000063258402 1033135411 /nfs/dbraw/zinc/13/54/11/1033135411.db2.gz DSDPXQBMLRJUJC-UHFFFAOYSA-N 1 1 331.441 3.677 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)ccc1[N+](=O)[O-] ZINC000276960202 1023478490 /nfs/dbraw/zinc/47/84/90/1023478490.db2.gz VIOOYRKPWKFGGN-MRXNPFEDSA-N 1 1 344.415 3.671 20 5 EHBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000449757498 1033147779 /nfs/dbraw/zinc/14/77/79/1033147779.db2.gz SFGTUMVRHRCMFA-QAQDUYKDSA-N 1 1 326.396 3.981 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000522269026 1024127249 /nfs/dbraw/zinc/12/72/49/1024127249.db2.gz SDJGWZVSTAVXFO-LJQANCHMSA-N 1 1 326.396 3.983 20 5 EHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000514639508 1024627286 /nfs/dbraw/zinc/62/72/86/1024627286.db2.gz DITRPYPHUCXOFY-JTQLQIEISA-N 1 1 334.342 3.541 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605728 1024629759 /nfs/dbraw/zinc/62/97/59/1024629759.db2.gz DIKYQIMJCRIMRE-DZGCQCFKSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605728 1024629762 /nfs/dbraw/zinc/62/97/62/1024629762.db2.gz DIKYQIMJCRIMRE-DZGCQCFKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)CO1 ZINC000508017257 1024847395 /nfs/dbraw/zinc/84/73/95/1024847395.db2.gz SYVNJKOIOGYZML-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)CO1 ZINC000508017257 1024847416 /nfs/dbraw/zinc/84/74/16/1024847416.db2.gz SYVNJKOIOGYZML-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]([C@@H]4CCCO4)C3)o2)c1 ZINC000895842265 1024888408 /nfs/dbraw/zinc/88/84/08/1024888408.db2.gz CXSNEHVLSPXVNY-QAPCUYQASA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602889969 1033244146 /nfs/dbraw/zinc/24/41/46/1033244146.db2.gz XROGWXZLYJIYCE-OAHLLOKOSA-N 1 1 334.379 3.528 20 5 EHBDMO Cc1ccc(CNC[C@H]2CCC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000435750526 1025111546 /nfs/dbraw/zinc/11/15/46/1025111546.db2.gz YGDOFEJPIDZJTG-GOSISDBHSA-N 1 1 331.460 3.790 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000521417680 1025378567 /nfs/dbraw/zinc/37/85/67/1025378567.db2.gz FYYUBURWWCJPLT-UHFFFAOYSA-N 1 1 347.459 3.746 20 5 EHBDMO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000436311466 1025594539 /nfs/dbraw/zinc/59/45/39/1025594539.db2.gz XVIUJYGWTNQQBW-GHMZBOCLSA-N 1 1 346.353 3.683 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@H](O)c2ccccc2)CC1 ZINC000051531703 1025639069 /nfs/dbraw/zinc/63/90/69/1025639069.db2.gz XIQJTHBBBIZIGS-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)c(F)c1 ZINC000505838245 1025807220 /nfs/dbraw/zinc/80/72/20/1025807220.db2.gz HOOFGXBYCIZNGD-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)c(F)c1 ZINC000505838245 1025807232 /nfs/dbraw/zinc/80/72/32/1025807232.db2.gz HOOFGXBYCIZNGD-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844010 1025859914 /nfs/dbraw/zinc/85/99/14/1025859914.db2.gz CSUXFGUWZZDHHW-INIZCTEOSA-N 1 1 326.396 3.804 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000451355438 1025860248 /nfs/dbraw/zinc/86/02/48/1025860248.db2.gz VCNMCLQGFCRNPC-JFIYKMOQSA-N 1 1 348.443 3.509 20 5 EHBDMO CCc1nc(C)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543464 1026091033 /nfs/dbraw/zinc/09/10/33/1026091033.db2.gz BWBWRMHGOSQJMI-HNNXBMFYSA-N 1 1 329.400 3.833 20 5 EHBDMO CCO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000451544965 1026093068 /nfs/dbraw/zinc/09/30/68/1026093068.db2.gz QMCOVEKPGLMZDI-IAQYHMDHSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000451544965 1026093089 /nfs/dbraw/zinc/09/30/89/1026093089.db2.gz QMCOVEKPGLMZDI-IAQYHMDHSA-N 1 1 346.349 3.861 20 5 EHBDMO COCC[C@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124144 1026257348 /nfs/dbraw/zinc/25/73/48/1026257348.db2.gz KPOXRQNHZLVJDH-GOSISDBHSA-N 1 1 328.412 3.847 20 5 EHBDMO CC(C)N(C)c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000338956852 1026302282 /nfs/dbraw/zinc/30/22/82/1026302282.db2.gz BHLQMAYJMWHTOP-UHFFFAOYSA-N 1 1 342.443 3.509 20 5 EHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000158336462 1026327615 /nfs/dbraw/zinc/32/76/15/1026327615.db2.gz TXXKQGWCVPKRLV-UHFFFAOYSA-N 1 1 339.395 3.819 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451977993 1026417840 /nfs/dbraw/zinc/41/78/40/1026417840.db2.gz NZLALFPAGJGDMW-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO CC1CCC([N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000339221913 1026433637 /nfs/dbraw/zinc/43/36/37/1026433637.db2.gz OBUXLCBKMZSARU-UHFFFAOYSA-N 1 1 345.443 3.601 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000543907457 1027301930 /nfs/dbraw/zinc/30/19/30/1027301930.db2.gz PVBSDAWFUDAVAI-QILLFSRXSA-N 1 1 345.443 3.742 20 5 EHBDMO Cc1ccc(NC(=O)NCCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000501576294 1027377606 /nfs/dbraw/zinc/37/76/06/1027377606.db2.gz DYEBIJSQTRFSCB-UHFFFAOYSA-N 1 1 348.447 3.679 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000548761147 1027408488 /nfs/dbraw/zinc/40/84/88/1027408488.db2.gz GJBLRZRYKSEPTP-VYDXJSESSA-N 1 1 345.443 3.824 20 5 EHBDMO O=[N+]([O-])c1cc(CNc2cc[nH+]cc2Cl)cc(C(F)(F)F)c1 ZINC000503569421 1027907860 /nfs/dbraw/zinc/90/78/60/1027907860.db2.gz RPUDXDRTVAPRMZ-UHFFFAOYSA-N 1 1 331.681 3.696 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H](CCO)CC2)c1 ZINC000421018119 1028005046 /nfs/dbraw/zinc/00/50/46/1028005046.db2.gz OAYHLIVULFVGMO-LBPRGKRZSA-N 1 1 346.349 3.598 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444592103 1028053673 /nfs/dbraw/zinc/05/36/73/1028053673.db2.gz FBERMGZIDYPEDL-LBPRGKRZSA-N 1 1 340.383 3.673 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444592103 1028053689 /nfs/dbraw/zinc/05/36/89/1028053689.db2.gz FBERMGZIDYPEDL-LBPRGKRZSA-N 1 1 340.383 3.673 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCC[C@H]1C ZINC000444679067 1028148317 /nfs/dbraw/zinc/14/83/17/1028148317.db2.gz SYBJJNCKUPWGIM-CXAGYDPISA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681885 1028150456 /nfs/dbraw/zinc/15/04/56/1028150456.db2.gz RULKDUNXTZRSIV-PBHICJAKSA-N 1 1 333.432 3.742 20 5 EHBDMO CCOc1cc(C[N@H+](C)Cc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000444707575 1028185858 /nfs/dbraw/zinc/18/58/58/1028185858.db2.gz YOUZVUGASXMHAC-UHFFFAOYSA-N 1 1 336.338 3.904 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2cc(F)cc(F)c2)ccc1[N+](=O)[O-] ZINC000444707575 1028185863 /nfs/dbraw/zinc/18/58/63/1028185863.db2.gz YOUZVUGASXMHAC-UHFFFAOYSA-N 1 1 336.338 3.904 20 5 EHBDMO Cc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444736116 1028202352 /nfs/dbraw/zinc/20/23/52/1028202352.db2.gz MWYDLYQEIJQNRZ-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444736116 1028202376 /nfs/dbraw/zinc/20/23/76/1028202376.db2.gz MWYDLYQEIJQNRZ-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](CN)C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263497 1028301299 /nfs/dbraw/zinc/30/12/99/1028301299.db2.gz ONIYCTQSCNLKDS-XJKSGUPXSA-N 1 1 335.448 3.552 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1OC ZINC000178730323 1028453260 /nfs/dbraw/zinc/45/32/60/1028453260.db2.gz POBRZNRBKPYOTG-INIZCTEOSA-N 1 1 330.384 3.853 20 5 EHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1OC ZINC000237228758 1028472987 /nfs/dbraw/zinc/47/29/87/1028472987.db2.gz DMXBNCBAKWOSAM-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701363 1028553091 /nfs/dbraw/zinc/55/30/91/1028553091.db2.gz HTEVDUCHWQXBMV-IBGZPJMESA-N 1 1 340.423 3.853 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569539 1028702862 /nfs/dbraw/zinc/70/28/62/1028702862.db2.gz GGUGPPOWGDJJQL-OPNNQBFTSA-N 1 1 332.444 3.746 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066368 1029235188 /nfs/dbraw/zinc/23/51/88/1029235188.db2.gz WSJVREGQZGKCNL-GUYCJALGSA-N 1 1 334.416 3.862 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000524757221 1029489089 /nfs/dbraw/zinc/48/90/89/1029489089.db2.gz PLEHPLUSESAAIB-HNAYVOBHSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000524757221 1029489091 /nfs/dbraw/zinc/48/90/91/1029489091.db2.gz PLEHPLUSESAAIB-HNAYVOBHSA-N 1 1 326.396 3.865 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCOc1ccc(F)cc1)C2 ZINC000536004244 1029716522 /nfs/dbraw/zinc/71/65/22/1029716522.db2.gz PRFKUMLQESBJPU-UHFFFAOYSA-N 1 1 330.359 3.561 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000441262923 1030195301 /nfs/dbraw/zinc/19/53/01/1030195301.db2.gz WHECYKCPMBSGIG-UHFFFAOYSA-N 1 1 348.424 3.708 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1COc3ccc(F)cc31)CCC2 ZINC000447595751 1030332167 /nfs/dbraw/zinc/33/21/67/1030332167.db2.gz AOTLUSMQTYFAKJ-SJORKVTESA-N 1 1 328.343 3.835 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCc1nccs1)C(C)C ZINC000159767738 1030357040 /nfs/dbraw/zinc/35/70/40/1030357040.db2.gz MHJHDIBVOIIUTO-UHFFFAOYSA-N 1 1 335.429 3.513 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1C[C@@H](C)O ZINC000447836900 1030526087 /nfs/dbraw/zinc/52/60/87/1030526087.db2.gz YOVHCEZXVBRMQT-GDBMZVCRSA-N 1 1 336.432 3.507 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H](CO)C(C)(C)C ZINC000537658515 1030902085 /nfs/dbraw/zinc/90/20/85/1030902085.db2.gz JXOKMNLDEWKRNP-QGZVFWFLSA-N 1 1 332.400 3.694 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093475797 1031289474 /nfs/dbraw/zinc/28/94/74/1031289474.db2.gz HBFHWFYARSAWTN-UHFFFAOYSA-N 1 1 348.321 3.529 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccnc2N2CCCC2)c(Cl)c1 ZINC000594955772 1033596066 /nfs/dbraw/zinc/59/60/66/1033596066.db2.gz ARUZSLCWBBMSPD-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)cc1OC ZINC000598972732 1033621943 /nfs/dbraw/zinc/62/19/43/1033621943.db2.gz DLZFSRJIFGGJMF-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2COC(C)(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595048327 1033665174 /nfs/dbraw/zinc/66/51/74/1033665174.db2.gz KBHAWPMYIGRHMV-RDTXWAMCSA-N 1 1 344.411 3.997 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3CC[N@H+]3C3CCCC3)c2c1 ZINC000599165282 1033782620 /nfs/dbraw/zinc/78/26/20/1033782620.db2.gz QFCQSKPNYLQMHL-INIZCTEOSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484678 1033809750 /nfs/dbraw/zinc/80/97/50/1033809750.db2.gz MVSZBDSABIJPGH-GOSISDBHSA-N 1 1 329.400 3.835 20 5 EHBDMO COc1cc(C[NH+]2CCC(c3ccco3)CC2)c([N+](=O)[O-])cc1F ZINC000595617599 1033902878 /nfs/dbraw/zinc/90/28/78/1033902878.db2.gz WZQXTWIVHKBDKB-UHFFFAOYSA-N 1 1 334.347 3.715 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094823 1033932460 /nfs/dbraw/zinc/93/24/60/1033932460.db2.gz IJGQHBOYITZDCI-ZDUSSCGKSA-N 1 1 337.379 3.898 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000550730490 1033957024 /nfs/dbraw/zinc/95/70/24/1033957024.db2.gz SZNIRWXUIWDTDV-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855153 1033980432 /nfs/dbraw/zinc/98/04/32/1033980432.db2.gz KBBUYBQMLBOHNP-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855153 1033980446 /nfs/dbraw/zinc/98/04/46/1033980446.db2.gz KBBUYBQMLBOHNP-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1F ZINC000599674990 1034079782 /nfs/dbraw/zinc/07/97/82/1034079782.db2.gz FXPLRERLSRGUKH-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc(C[N@H+](C)C2CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000179305950 1034116130 /nfs/dbraw/zinc/11/61/30/1034116130.db2.gz RIACTCSVMXVOCN-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000179305950 1034116144 /nfs/dbraw/zinc/11/61/44/1034116144.db2.gz RIACTCSVMXVOCN-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1ccc(C[NH2+]CC(C)(C)N2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604417943 1034370002 /nfs/dbraw/zinc/37/00/02/1034370002.db2.gz SUAASUWSEFVDLY-GJZGRUSLSA-N 1 1 333.476 3.749 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccnn3CC3CC3)C2)cc1 ZINC000597136927 1034557337 /nfs/dbraw/zinc/55/73/37/1034557337.db2.gz CBQCJWARMIQSDH-KRWDZBQOSA-N 1 1 340.427 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4COC[C@@H]4C3)s2)cc1 ZINC000597229663 1034611415 /nfs/dbraw/zinc/61/14/15/1034611415.db2.gz ICPRMVOVVVCWCA-CABCVRRESA-N 1 1 344.436 3.792 20 5 EHBDMO CCC[C@H](NCc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593321508 1034646531 /nfs/dbraw/zinc/64/65/31/1034646531.db2.gz YEYIMXJKOHVLSZ-SFHVURJKSA-N 1 1 331.391 3.824 20 5 EHBDMO C[C@H](c1ccco1)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411385616 1034879603 /nfs/dbraw/zinc/87/96/03/1034879603.db2.gz HCAUZYDAYGYABW-CYBMUJFWSA-N 1 1 343.383 3.742 20 5 EHBDMO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472440667 1035049976 /nfs/dbraw/zinc/04/99/76/1035049976.db2.gz RKIXTIRDPHMKCG-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000588072496 1035700255 /nfs/dbraw/zinc/70/02/55/1035700255.db2.gz RGCMIFZMAOVAAN-GOSISDBHSA-N 1 1 343.452 3.759 20 5 EHBDMO C[C@]12C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000582401932 1035751287 /nfs/dbraw/zinc/75/12/87/1035751287.db2.gz PVUKRJFHFOXQEH-AZGFTEDZSA-N 1 1 327.384 3.604 20 5 EHBDMO CC(C)CCO[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541069954 1035967685 /nfs/dbraw/zinc/96/76/85/1035967685.db2.gz OHAVJFRFDXQXFB-HNNXBMFYSA-N 1 1 326.824 3.885 20 5 EHBDMO CC(C)CCO[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541069954 1035967694 /nfs/dbraw/zinc/96/76/94/1035967694.db2.gz OHAVJFRFDXQXFB-HNNXBMFYSA-N 1 1 326.824 3.885 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CSCCc2ccccc21 ZINC000122439877 1036344678 /nfs/dbraw/zinc/34/46/78/1036344678.db2.gz SJDMMXCOMDYKBL-QGZVFWFLSA-N 1 1 344.436 3.724 20 5 EHBDMO C[C@H]1CSCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549612481 1036602957 /nfs/dbraw/zinc/60/29/57/1036602957.db2.gz RXBVVLFMTHXOSO-SNVBAGLBSA-N 1 1 334.363 3.799 20 5 EHBDMO C[C@H]1CSCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549612481 1036602971 /nfs/dbraw/zinc/60/29/71/1036602971.db2.gz RXBVVLFMTHXOSO-SNVBAGLBSA-N 1 1 334.363 3.799 20 5 EHBDMO CC[C@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777046 1036768078 /nfs/dbraw/zinc/76/80/78/1036768078.db2.gz OMTNRTNBKAGCSV-KBXCAEBGSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130238590 1037038553 /nfs/dbraw/zinc/03/85/53/1037038553.db2.gz PPBILQSUFGLROC-HNNXBMFYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829601 1037254305 /nfs/dbraw/zinc/25/43/05/1037254305.db2.gz REKKBSJDDNWHES-XJKSGUPXSA-N 1 1 328.416 3.616 20 5 EHBDMO CCOc1cc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992813 1037430441 /nfs/dbraw/zinc/43/04/41/1037430441.db2.gz FZIHWPDOENKNNF-UXLLHSPISA-N 1 1 347.459 3.835 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC4(CCC4)C3)o2)cc1 ZINC000130510281 1037462830 /nfs/dbraw/zinc/46/28/30/1037462830.db2.gz GFOYECALYFTIDL-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC4(CCC4)C3)o2)cc1 ZINC000130510281 1037462838 /nfs/dbraw/zinc/46/28/38/1037462838.db2.gz GFOYECALYFTIDL-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786894 1037533763 /nfs/dbraw/zinc/53/37/63/1037533763.db2.gz GTABYMUDLFIOSS-QWQRMKEZSA-N 1 1 344.411 3.836 20 5 EHBDMO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021676 1037673111 /nfs/dbraw/zinc/67/31/11/1037673111.db2.gz FOXUNYQISOMGJG-TUAOUCFPSA-N 1 1 340.807 3.553 20 5 EHBDMO C[N@@H+](CCc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1)C1CC1 ZINC000341294161 1037884584 /nfs/dbraw/zinc/88/45/84/1037884584.db2.gz RTUVCJPTVSYNNY-UHFFFAOYSA-N 1 1 345.424 3.545 20 5 EHBDMO COc1cc(C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000058452153 1037918549 /nfs/dbraw/zinc/91/85/49/1037918549.db2.gz DRRSURSTSGYQBE-PHIMTYICSA-N 1 1 344.358 3.683 20 5 EHBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214058 1038696909 /nfs/dbraw/zinc/69/69/09/1038696909.db2.gz QRXPFWSASVQAFD-IBGZPJMESA-N 1 1 344.411 3.839 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876360 1038822282 /nfs/dbraw/zinc/82/22/82/1038822282.db2.gz NLKHUBZNBCDYHC-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876360 1038822308 /nfs/dbraw/zinc/82/23/08/1038822308.db2.gz NLKHUBZNBCDYHC-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585137 1038912836 /nfs/dbraw/zinc/91/28/36/1038912836.db2.gz GHVULNVRYMBPBZ-OLZOCXBDSA-N 1 1 330.388 3.513 20 5 EHBDMO COC[C@H]1CC[N@@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000552314404 1039197890 /nfs/dbraw/zinc/19/78/90/1039197890.db2.gz OOWVRRJLOQOWPC-QGZVFWFLSA-N 1 1 341.411 3.583 20 5 EHBDMO COC[C@H]1CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000552314404 1039197899 /nfs/dbraw/zinc/19/78/99/1039197899.db2.gz OOWVRRJLOQOWPC-QGZVFWFLSA-N 1 1 341.411 3.583 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000485817963 1039596634 /nfs/dbraw/zinc/59/66/34/1039596634.db2.gz REFYEIXWUHCCOH-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO Cc1cc(C[C@H](C)[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000417312938 1039669569 /nfs/dbraw/zinc/66/95/69/1039669569.db2.gz UCXDSOJUPVPIEI-SGTLLEGYSA-N 1 1 328.416 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417325525 1039682949 /nfs/dbraw/zinc/68/29/49/1039682949.db2.gz QUPYHZKXGOECOY-IBGZPJMESA-N 1 1 329.444 3.579 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(Cl)cc1Cl ZINC000554848964 1039830125 /nfs/dbraw/zinc/83/01/25/1039830125.db2.gz UNLMHYDFXRDNQP-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(Cl)cc1Cl ZINC000554848964 1039830150 /nfs/dbraw/zinc/83/01/50/1039830150.db2.gz UNLMHYDFXRDNQP-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCS1 ZINC000555461283 1040617854 /nfs/dbraw/zinc/61/78/54/1040617854.db2.gz ZLMNXLRLYKCTMA-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCS1 ZINC000555461283 1040617877 /nfs/dbraw/zinc/61/78/77/1040617877.db2.gz ZLMNXLRLYKCTMA-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001167750761 1040798819 /nfs/dbraw/zinc/79/88/19/1040798819.db2.gz BJCOJKPGPVIOBD-AWEZNQCLSA-N 1 1 332.448 3.545 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCCO1 ZINC000511657386 1040862302 /nfs/dbraw/zinc/86/23/02/1040862302.db2.gz QOJASFGGEHBTHB-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@@H]21 ZINC000555721464 1041059480 /nfs/dbraw/zinc/05/94/80/1041059480.db2.gz REJPPJATMIELLI-GJZGRUSLSA-N 1 1 342.399 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC000110596610 1041220058 /nfs/dbraw/zinc/22/00/58/1041220058.db2.gz USGAAKUFDUYBQM-ALOPSCKCSA-N 1 1 338.411 3.597 20 5 EHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(Cl)c1OC ZINC000106366989 1041685855 /nfs/dbraw/zinc/68/58/55/1041685855.db2.gz CCEWTYNNGVWERB-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000111176768 1042237979 /nfs/dbraw/zinc/23/79/79/1042237979.db2.gz UIXOZWUKQZRWHJ-OAHLLOKOSA-N 1 1 334.807 3.666 20 5 EHBDMO C[C@@H]1C[N@H+](CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000432325860 1042906373 /nfs/dbraw/zinc/90/63/73/1042906373.db2.gz NCEADUSMRASLKE-BETUJISGSA-N 1 1 341.839 3.550 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3ccc(F)cn3)o2)c1 ZINC000344894578 1044661861 /nfs/dbraw/zinc/66/18/61/1044661861.db2.gz WZGHUTDTPJXYAE-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000083128712 1127209954 /nfs/dbraw/zinc/20/99/54/1127209954.db2.gz RSBKEYUJVWAOID-UHFFFAOYSA-N 1 1 329.331 3.897 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000083128712 1127209959 /nfs/dbraw/zinc/20/99/59/1127209959.db2.gz RSBKEYUJVWAOID-UHFFFAOYSA-N 1 1 329.331 3.897 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ncc([N+](=O)[O-])cc1Cl ZINC000301283643 1127729670 /nfs/dbraw/zinc/72/96/70/1127729670.db2.gz PLKPZHMCJXXQEG-GFCCVEGCSA-N 1 1 326.828 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1OC(F)F ZINC000301390934 1127741774 /nfs/dbraw/zinc/74/17/74/1127741774.db2.gz GSUPZOMURGVWEL-GFCCVEGCSA-N 1 1 341.358 3.625 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000301428410 1127887506 /nfs/dbraw/zinc/88/75/06/1127887506.db2.gz HTUCVKUPYFYMKO-INIZCTEOSA-N 1 1 343.402 3.692 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000301435201 1127889518 /nfs/dbraw/zinc/88/95/18/1127889518.db2.gz KDMKXLRTHHVLHO-QGZVFWFLSA-N 1 1 325.412 3.553 20 5 EHBDMO CN(c1c(Cl)cc(Cl)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000553296302 1128407027 /nfs/dbraw/zinc/40/70/27/1128407027.db2.gz VXOOPQBIHNSKRP-FOSCPWQOSA-N 1 1 344.242 3.963 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301472322 1128466885 /nfs/dbraw/zinc/46/68/85/1128466885.db2.gz KQTGRDLHRXZFOZ-ZDUSSCGKSA-N 1 1 325.840 3.725 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000301599732 1128505787 /nfs/dbraw/zinc/50/57/87/1128505787.db2.gz UOTNMZGRCSCEEB-WBVHZDCISA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000301602883 1128516420 /nfs/dbraw/zinc/51/64/20/1128516420.db2.gz WQSNJLKTWAHSHV-CRAIPNDOSA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549256 /nfs/dbraw/zinc/54/92/56/1128549256.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 1 1 345.487 3.990 20 5 EHBDMO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@@H+](C)C1CC1 ZINC000057707644 1128661864 /nfs/dbraw/zinc/66/18/64/1128661864.db2.gz FAIMQMJLLYBQMJ-CQSZACIVSA-N 1 1 333.435 3.601 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000554945285 1128916452 /nfs/dbraw/zinc/91/64/52/1128916452.db2.gz GQADKLUSSFVRDP-NVXWUHKLSA-N 1 1 337.423 3.793 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCOCc1ccccc1)C2 ZINC000542514233 1120871039 /nfs/dbraw/zinc/87/10/39/1120871039.db2.gz CXYOHEWRBJKGNL-UHFFFAOYSA-N 1 1 326.396 3.560 20 5 EHBDMO Cc1cc(NC[C@@H](C)[N@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301067608 1121302089 /nfs/dbraw/zinc/30/20/89/1121302089.db2.gz CEKKBOPPARSNQY-CYBMUJFWSA-N 1 1 331.441 3.823 20 5 EHBDMO Cc1ncsc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113337618 1129002674 /nfs/dbraw/zinc/00/26/74/1129002674.db2.gz QTUZSWDAZANEIN-UHFFFAOYSA-N 1 1 346.437 3.773 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000390706933 1129016572 /nfs/dbraw/zinc/01/65/72/1129016572.db2.gz RDPSPGULIVSNFY-INIZCTEOSA-N 1 1 341.411 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c(F)c1 ZINC000390707006 1129017597 /nfs/dbraw/zinc/01/75/97/1129017597.db2.gz RQSNQXTXBUBVME-MRXNPFEDSA-N 1 1 329.375 3.810 20 5 EHBDMO CC(=O)c1ccc(NC[C@@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000301756541 1129034334 /nfs/dbraw/zinc/03/43/34/1129034334.db2.gz DUNGRMNQYNWTBF-HNNXBMFYSA-N 1 1 333.432 3.577 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154306458 1122548438 /nfs/dbraw/zinc/54/84/38/1122548438.db2.gz UJZHNCHPUPMABP-LJHODMEESA-N 1 1 326.396 3.506 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000497474755 1122560031 /nfs/dbraw/zinc/56/00/31/1122560031.db2.gz ZJCJTPDLASCRPW-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566112 1122777408 /nfs/dbraw/zinc/77/74/08/1122777408.db2.gz FAARRBCIBVTZCQ-GFCCVEGCSA-N 1 1 348.424 3.801 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(F)cc1 ZINC000064350114 1123574304 /nfs/dbraw/zinc/57/43/04/1123574304.db2.gz XAKXQKQRFXCMFC-SFHVURJKSA-N 1 1 332.375 3.678 20 5 EHBDMO CC1(C)CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000078516976 1129154518 /nfs/dbraw/zinc/15/45/18/1129154518.db2.gz OHCKWLWQRCIUEZ-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000198205282 1125404662 /nfs/dbraw/zinc/40/46/62/1125404662.db2.gz PBVUACLAOMVZKJ-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000198205282 1125404665 /nfs/dbraw/zinc/40/46/65/1125404665.db2.gz PBVUACLAOMVZKJ-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000069063742 1129419403 /nfs/dbraw/zinc/41/94/03/1129419403.db2.gz GXZHICVHUDNBNK-RYUDHWBXSA-N 1 1 347.802 3.926 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@H](C)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403203 1129462868 /nfs/dbraw/zinc/46/28/68/1129462868.db2.gz QIEYXIBTHAGXJS-XVGQJIODSA-N 1 1 346.427 3.836 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)s2)cc1 ZINC000543413223 1129473308 /nfs/dbraw/zinc/47/33/08/1129473308.db2.gz ZUKMGJDZOAPXOS-IAOVAPTHSA-N 1 1 344.436 3.526 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000126523307 1129751709 /nfs/dbraw/zinc/75/17/09/1129751709.db2.gz VWYXLPHKLIKWFS-ZDUSSCGKSA-N 1 1 349.456 3.866 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032642 1129764292 /nfs/dbraw/zinc/76/42/92/1129764292.db2.gz SPQUPQLHOYTZMS-DZGCQCFKSA-N 1 1 331.441 3.979 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000509159043 1129870879 /nfs/dbraw/zinc/87/08/79/1129870879.db2.gz YVMLOWMERMPHKF-OAHLLOKOSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831167 1130386240 /nfs/dbraw/zinc/38/62/40/1130386240.db2.gz PDIBPQNVRMVQPY-LBPRGKRZSA-N 1 1 334.807 3.670 20 5 EHBDMO CCOC(=O)CC[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532328 1130390523 /nfs/dbraw/zinc/39/05/23/1130390523.db2.gz CNUYOTNLQMSFMT-CABCVRRESA-N 1 1 334.416 3.711 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208668 1130779611 /nfs/dbraw/zinc/77/96/11/1130779611.db2.gz CSRIBIGJRIOEQO-NWDGAFQWSA-N 1 1 334.445 3.737 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000733992027 1131180650 /nfs/dbraw/zinc/18/06/50/1131180650.db2.gz LNCZXIRPJQYIKR-GOSISDBHSA-N 1 1 326.400 3.724 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000736628311 1131428270 /nfs/dbraw/zinc/42/82/70/1131428270.db2.gz IWCKXCLQPKAKMK-AWEZNQCLSA-N 1 1 332.350 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@@H]3CC(F)(F)C[C@@H]3C1)CC2 ZINC001172902716 1131885301 /nfs/dbraw/zinc/88/53/01/1131885301.db2.gz BTKULUXRZGJUQM-XHSDSOJGSA-N 1 1 336.382 3.819 20 5 EHBDMO COCC[C@@H]1CCCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914778 1131902813 /nfs/dbraw/zinc/90/28/13/1131902813.db2.gz ISFWITFZGABKJF-ZWKOTPCHSA-N 1 1 332.444 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+](C1CCC1)C1CCOCC1)CC2 ZINC001172914070 1131903009 /nfs/dbraw/zinc/90/30/09/1131903009.db2.gz YUEKXQNUXRVOMN-GOSISDBHSA-N 1 1 344.455 3.876 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380843 1131907405 /nfs/dbraw/zinc/90/74/05/1131907405.db2.gz SZYDYGVHTNKFKH-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@H]1c2cccn2CC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912468 1131918165 /nfs/dbraw/zinc/91/81/65/1131918165.db2.gz ABVUQZXLILPUHF-YOEHRIQHSA-N 1 1 325.412 3.721 20 5 EHBDMO C[C@H]1c2cccn2CC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912468 1131918173 /nfs/dbraw/zinc/91/81/73/1131918173.db2.gz ABVUQZXLILPUHF-YOEHRIQHSA-N 1 1 325.412 3.721 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000743856556 1131988547 /nfs/dbraw/zinc/98/85/47/1131988547.db2.gz KPQWMLZLCFOBON-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001173189251 1131995016 /nfs/dbraw/zinc/99/50/16/1131995016.db2.gz JXACYPBALGSAIC-WDEREUQCSA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](CCN(C)C)Cc1ccccc1 ZINC001173226150 1132006470 /nfs/dbraw/zinc/00/64/70/1132006470.db2.gz LDXOOCLNIHAOTD-KRWDZBQOSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(CC[NH+](C)C)Cc1ccccc1 ZINC001173226150 1132006474 /nfs/dbraw/zinc/00/64/74/1132006474.db2.gz LDXOOCLNIHAOTD-KRWDZBQOSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001173225509 1132007083 /nfs/dbraw/zinc/00/70/83/1132007083.db2.gz CTAUERXGTCDXFH-YOEHRIQHSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001173225509 1132007088 /nfs/dbraw/zinc/00/70/88/1132007088.db2.gz CTAUERXGTCDXFH-YOEHRIQHSA-N 1 1 348.443 3.722 20 5 EHBDMO Cc1nn(C[N@H+](CCc2ccc(F)cc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000746065304 1132364247 /nfs/dbraw/zinc/36/42/47/1132364247.db2.gz CNQYLERQTYIPTG-UHFFFAOYSA-N 1 1 348.422 3.705 20 5 EHBDMO CC[N@@H+](Cc1cccc(Br)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035074 1132636600 /nfs/dbraw/zinc/63/66/00/1132636600.db2.gz ADLOSRCAFXEMDG-ZFWWWQNUSA-N 1 1 341.249 3.716 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040152 1132638486 /nfs/dbraw/zinc/63/84/86/1132638486.db2.gz YHTQTDVZJKYHRM-UKPHBRMFSA-N 1 1 338.835 3.629 20 5 EHBDMO C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057913 1132646680 /nfs/dbraw/zinc/64/66/80/1132646680.db2.gz YXKXZQDVZAAALQ-UKRRQHHQSA-N 1 1 330.350 3.625 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1ccc(O)cc1 ZINC001169543040 1132782300 /nfs/dbraw/zinc/78/23/00/1132782300.db2.gz OCXSFCBTMIUTTK-CYBMUJFWSA-N 1 1 341.411 3.504 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1ccc(O)cc1 ZINC001169543040 1132782308 /nfs/dbraw/zinc/78/23/08/1132782308.db2.gz OCXSFCBTMIUTTK-CYBMUJFWSA-N 1 1 341.411 3.504 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cccnc2Cl)cc(C(F)(F)F)c1 ZINC000785522700 1133716983 /nfs/dbraw/zinc/71/69/83/1133716983.db2.gz SARIMTBMUQJBPR-UHFFFAOYSA-N 1 1 345.708 3.952 20 5 EHBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746672722 1133990485 /nfs/dbraw/zinc/99/04/85/1133990485.db2.gz HSXDKTQVCXWUDS-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746672722 1133990489 /nfs/dbraw/zinc/99/04/89/1133990489.db2.gz HSXDKTQVCXWUDS-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@H+]1CCCC[C@H]1C ZINC001184856822 1133998888 /nfs/dbraw/zinc/99/88/88/1133998888.db2.gz MTYGYMMSRLNJFS-KGLIPLIRSA-N 1 1 328.416 3.818 20 5 EHBDMO C[N@H+](CCOc1ccc(F)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788466070 1134127926 /nfs/dbraw/zinc/12/79/26/1134127926.db2.gz SMFPMQORIVWBCU-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccc(F)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788466070 1134127930 /nfs/dbraw/zinc/12/79/30/1134127930.db2.gz SMFPMQORIVWBCU-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CN(c1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788486961 1134131336 /nfs/dbraw/zinc/13/13/36/1134131336.db2.gz AJSKCFNXKBIGIW-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788671867 1134159933 /nfs/dbraw/zinc/15/99/33/1134159933.db2.gz ZPGRCALWYYPVTI-XPTSAGLGSA-N 1 1 333.775 3.615 20 5 EHBDMO CC1(C)CCC[N@@H+](CCNc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001186266803 1134190694 /nfs/dbraw/zinc/19/06/94/1134190694.db2.gz HSWUMONCDXUBSS-UHFFFAOYSA-N 1 1 328.416 3.677 20 5 EHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000775060037 1134273258 /nfs/dbraw/zinc/27/32/58/1134273258.db2.gz FSMQOYGZFUHCSW-HNNXBMFYSA-N 1 1 341.367 3.801 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508203 1134287832 /nfs/dbraw/zinc/28/78/32/1134287832.db2.gz ZUZYNILOULPDBO-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513472 1134289236 /nfs/dbraw/zinc/28/92/36/1134289236.db2.gz JZJGWRUGQURPFT-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO CCn1ccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)c1 ZINC000790446070 1134419356 /nfs/dbraw/zinc/41/93/56/1134419356.db2.gz DUHYPRKDUMKLGO-UHFFFAOYSA-N 1 1 346.412 3.783 20 5 EHBDMO CCn1ccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)c1 ZINC000790446070 1134419361 /nfs/dbraw/zinc/41/93/61/1134419361.db2.gz DUHYPRKDUMKLGO-UHFFFAOYSA-N 1 1 346.412 3.783 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606107 1134582554 /nfs/dbraw/zinc/58/25/54/1134582554.db2.gz QMDFJUOFNRJTQX-XLIONFOSSA-N 1 1 340.423 3.735 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170327227 1134748463 /nfs/dbraw/zinc/74/84/63/1134748463.db2.gz GAWUIBVZNFDMTF-HNNXBMFYSA-N 1 1 328.412 3.709 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352869 1134754413 /nfs/dbraw/zinc/75/44/13/1134754413.db2.gz SIFBYIAYZFONLV-CYBMUJFWSA-N 1 1 330.384 3.792 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170343520 1134758851 /nfs/dbraw/zinc/75/88/51/1134758851.db2.gz PYKSLRZDNFEHHG-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170351627 1134760586 /nfs/dbraw/zinc/76/05/86/1134760586.db2.gz GMDKTUSCAZPJBM-NSHDSACASA-N 1 1 328.359 3.512 20 5 EHBDMO CN(CC[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC001190895190 1134764586 /nfs/dbraw/zinc/76/45/86/1134764586.db2.gz OGJSSZARYFNSIK-UHFFFAOYSA-N 1 1 333.819 3.816 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191039251 1134782168 /nfs/dbraw/zinc/78/21/68/1134782168.db2.gz NTZNQKRCEIBVHP-LJQANCHMSA-N 1 1 326.396 3.983 20 5 EHBDMO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])o1 ZINC001191258263 1134826611 /nfs/dbraw/zinc/82/66/11/1134826611.db2.gz LSCZMNCPGUKWSX-CJNGLKHVSA-N 1 1 346.431 3.728 20 5 EHBDMO CC(C)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191538677 1134881256 /nfs/dbraw/zinc/88/12/56/1134881256.db2.gz CKZWOWSYDQYTQY-NSHDSACASA-N 1 1 327.222 3.835 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199945 1134978727 /nfs/dbraw/zinc/97/87/27/1134978727.db2.gz PXVCSAZDSWHBLK-CVEARBPZSA-N 1 1 347.459 3.988 20 5 EHBDMO C[C@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000804606403 1135136093 /nfs/dbraw/zinc/13/60/93/1135136093.db2.gz LPUBJPMEHXKOHB-QWHCGFSZSA-N 1 1 348.403 3.568 20 5 EHBDMO CC(C)(C)OC(=O)CC[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233623 1135389876 /nfs/dbraw/zinc/38/98/76/1135389876.db2.gz KDHWGDORZBMWJR-OAHLLOKOSA-N 1 1 348.443 3.929 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H](C4CC4)C3)c2)cc1 ZINC000808231189 1135634043 /nfs/dbraw/zinc/63/40/43/1135634043.db2.gz ZLZYIVXLDLZYJV-MRXNPFEDSA-N 1 1 326.400 3.538 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001197256214 1135666706 /nfs/dbraw/zinc/66/67/06/1135666706.db2.gz OSWLZZRJLMRRFY-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001197256214 1135666708 /nfs/dbraw/zinc/66/67/08/1135666708.db2.gz OSWLZZRJLMRRFY-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](CCCCCn1cccn1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000104663745 1135854837 /nfs/dbraw/zinc/85/48/37/1135854837.db2.gz UPUHSQYWLUQJDB-UHFFFAOYSA-N 1 1 336.823 3.747 20 5 EHBDMO C[N@@H+](CCC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000809712966 1135876470 /nfs/dbraw/zinc/87/64/70/1135876470.db2.gz BDWGXUMZSHHFII-UHFFFAOYSA-N 1 1 326.827 3.954 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH+]1CCC2(CCOC2)CC1 ZINC000809967846 1135904348 /nfs/dbraw/zinc/90/43/48/1135904348.db2.gz JEPNPACWNGDWJB-UHFFFAOYSA-N 1 1 345.226 3.904 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000809973121 1135907426 /nfs/dbraw/zinc/90/74/26/1135907426.db2.gz ITOOKFSZXQFMKL-YGRLFVJLSA-N 1 1 347.242 3.885 20 5 EHBDMO Cc1c(C[NH2+]Cc2ccnc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000811495468 1136094150 /nfs/dbraw/zinc/09/41/50/1136094150.db2.gz MAAYHPGCBUOSGQ-UHFFFAOYSA-N 1 1 326.183 3.895 20 5 EHBDMO C[C@H](C1CC1)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271955 1136124333 /nfs/dbraw/zinc/12/43/33/1136124333.db2.gz PIGGULWUPYBOBQ-QRWLVFNGSA-N 1 1 340.423 3.929 20 5 EHBDMO CC(C)[N@H+](Cc1cccc(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277988 1136126094 /nfs/dbraw/zinc/12/60/94/1136126094.db2.gz RZBKEVLKAMIXNQ-GOSISDBHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276668 1136131074 /nfs/dbraw/zinc/13/10/74/1136131074.db2.gz IRXVKSUNGNNAQF-WOJBJXKFSA-N 1 1 340.423 3.884 20 5 EHBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000776278077 1136131195 /nfs/dbraw/zinc/13/11/95/1136131195.db2.gz RPDXKWXPEPXDDR-YSGRDPCXSA-N 1 1 340.423 3.754 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000776278234 1136133809 /nfs/dbraw/zinc/13/38/09/1136133809.db2.gz SNLZEMVLZFQEEO-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000776278234 1136133811 /nfs/dbraw/zinc/13/38/11/1136133811.db2.gz SNLZEMVLZFQEEO-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851219 1136261228 /nfs/dbraw/zinc/26/12/28/1136261228.db2.gz QOSAXEJOFLIJFB-BEFAXECRSA-N 1 1 328.412 3.847 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000851907519 1136418359 /nfs/dbraw/zinc/41/83/59/1136418359.db2.gz UTMUXDKQVPLFQL-NSHDSACASA-N 1 1 333.319 3.801 20 5 EHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000852066246 1136430960 /nfs/dbraw/zinc/43/09/60/1136430960.db2.gz MXBDBMKSLIXGSA-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000776583342 1136441577 /nfs/dbraw/zinc/44/15/77/1136441577.db2.gz DNXJTSNBXZBCOU-DLBZAZTESA-N 1 1 330.384 3.839 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587821 1136447004 /nfs/dbraw/zinc/44/70/04/1136447004.db2.gz OVMJBAXDFKHCDC-AUUYWEPGSA-N 1 1 326.396 3.854 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589397 1136450560 /nfs/dbraw/zinc/45/05/60/1136450560.db2.gz RXSUDWBTYMYSEA-MJGOQNOKSA-N 1 1 328.412 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000852758897 1136483871 /nfs/dbraw/zinc/48/38/71/1136483871.db2.gz GRWAGTSSGVTUPN-CALCHBBNSA-N 1 1 336.819 3.641 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccccc2)[C@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000112659816 1136644102 /nfs/dbraw/zinc/64/41/02/1136644102.db2.gz IHGPFIAUVSJTLB-HXUWFJFHSA-N 1 1 342.439 3.922 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001170858998 1136792600 /nfs/dbraw/zinc/79/26/00/1136792600.db2.gz CRDOCZLZBWESRQ-SJORKVTESA-N 1 1 341.411 3.668 20 5 EHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001170858998 1136792602 /nfs/dbraw/zinc/79/26/02/1136792602.db2.gz CRDOCZLZBWESRQ-SJORKVTESA-N 1 1 341.411 3.668 20 5 EHBDMO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821146 1137153764 /nfs/dbraw/zinc/15/37/64/1137153764.db2.gz VCRIQEPDUPMWOL-CQSZACIVSA-N 1 1 348.834 3.670 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000794620133 1137221333 /nfs/dbraw/zinc/22/13/33/1137221333.db2.gz HXERPRMIJOFHMQ-CQSZACIVSA-N 1 1 345.399 3.505 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000872019139 1137564911 /nfs/dbraw/zinc/56/49/11/1137564911.db2.gz TZPMUGNVTGSGPD-NEPJUHHUSA-N 1 1 346.358 3.917 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC[C@H]1C=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000872107694 1137571412 /nfs/dbraw/zinc/57/14/12/1137571412.db2.gz QYEDLAMGXLZEBR-YJBOKZPZSA-N 1 1 340.427 3.754 20 5 EHBDMO Cc1ccc2c(c1)nc(C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)n2C ZINC000877399625 1137675351 /nfs/dbraw/zinc/67/53/51/1137675351.db2.gz NMYKSCYTNFVKEX-UHFFFAOYSA-N 1 1 338.411 3.697 20 5 EHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399660 1137714395 /nfs/dbraw/zinc/71/43/95/1137714395.db2.gz PNGCDXXNPJEVBO-SCLBCKFNSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399658 1137714448 /nfs/dbraw/zinc/71/44/48/1137714448.db2.gz PNGCDXXNPJEVBO-ACJLOTCBSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497113 1137718034 /nfs/dbraw/zinc/71/80/34/1137718034.db2.gz QTVGNSHLRMFMIN-UPJWGTAASA-N 1 1 330.388 3.511 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000879964640 1137763637 /nfs/dbraw/zinc/76/36/37/1137763637.db2.gz MCVAZSJUWHJWBE-GFCCVEGCSA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055379 1137766777 /nfs/dbraw/zinc/76/67/77/1137766777.db2.gz XCOWUPZUBYOBNT-GYSYKLTISA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055379 1137766778 /nfs/dbraw/zinc/76/67/78/1137766778.db2.gz XCOWUPZUBYOBNT-GYSYKLTISA-N 1 1 332.322 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](c4nccs4)C3)c2c1 ZINC000882855645 1137835841 /nfs/dbraw/zinc/83/58/41/1137835841.db2.gz POGNQCTZRXHSGM-LLVKDONJSA-N 1 1 326.381 3.593 20 5 EHBDMO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@H]1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883376761 1137858016 /nfs/dbraw/zinc/85/80/16/1137858016.db2.gz SJGFSBXFASNPQY-POHZPAGDSA-N 1 1 329.375 3.853 20 5 EHBDMO CN(C)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865591 1137889787 /nfs/dbraw/zinc/88/97/87/1137889787.db2.gz QQTBWHXXMDYZOK-KRWDZBQOSA-N 1 1 333.819 3.641 20 5 EHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000331948612 1137926575 /nfs/dbraw/zinc/92/65/75/1137926575.db2.gz PAGXPESNAQDAPZ-ZFKCKOODSA-N 1 1 332.444 3.665 20 5 EHBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885932864 1138026035 /nfs/dbraw/zinc/02/60/35/1138026035.db2.gz CSGFQVACGXEBJO-QGZVFWFLSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885932864 1138026037 /nfs/dbraw/zinc/02/60/37/1138026037.db2.gz CSGFQVACGXEBJO-QGZVFWFLSA-N 1 1 327.384 3.726 20 5 EHBDMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCC1 ZINC000068449345 1138085057 /nfs/dbraw/zinc/08/50/57/1138085057.db2.gz UEGWBRNIVWIWKB-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO CN(Cc1csc([N+](=O)[O-])c1)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110088 1138129804 /nfs/dbraw/zinc/12/98/04/1138129804.db2.gz GYVUIPKWNISAAR-INIZCTEOSA-N 1 1 345.468 3.610 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000886818578 1138148782 /nfs/dbraw/zinc/14/87/82/1138148782.db2.gz HEXBYZWSLIVAKH-HZMBPMFUSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000886818578 1138148785 /nfs/dbraw/zinc/14/87/85/1138148785.db2.gz HEXBYZWSLIVAKH-HZMBPMFUSA-N 1 1 345.226 3.903 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000085635951 1138184862 /nfs/dbraw/zinc/18/48/62/1138184862.db2.gz NNLOHHJBPYDXRP-OAHLLOKOSA-N 1 1 348.447 3.550 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000091957895 1138223365 /nfs/dbraw/zinc/22/33/65/1138223365.db2.gz VRBOJDGOILLOBB-RIGVPDNZSA-N 1 1 342.395 3.789 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCOC1 ZINC000093839944 1138241795 /nfs/dbraw/zinc/24/17/95/1138241795.db2.gz WSMCEKHWCKXBSW-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122416677 1138257872 /nfs/dbraw/zinc/25/78/72/1138257872.db2.gz KOEMNPQDFRSINL-LBPRGKRZSA-N 1 1 345.355 3.671 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000265474061 1138914454 /nfs/dbraw/zinc/91/44/54/1138914454.db2.gz MBDLXIBKIZNUHI-LLVKDONJSA-N 1 1 347.440 3.790 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102180 1139735078 /nfs/dbraw/zinc/73/50/78/1139735078.db2.gz VGSZZPLDRXVUBH-PBHICJAKSA-N 1 1 337.419 3.682 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CC2)C1 ZINC000186994834 1140231110 /nfs/dbraw/zinc/23/11/10/1140231110.db2.gz ILOUAYYCHRRKGB-LBPRGKRZSA-N 1 1 328.372 3.582 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCCC4(CC4)C3)o2)c1 ZINC000187002288 1140232038 /nfs/dbraw/zinc/23/20/38/1140232038.db2.gz UOSRWLWURRCQNJ-UHFFFAOYSA-N 1 1 327.384 3.668 20 5 EHBDMO COCC1=CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000187618244 1140264450 /nfs/dbraw/zinc/26/44/50/1140264450.db2.gz WVUPPDAYHIYTFI-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cnn(C(C)(C)C)c1C ZINC000191266500 1140449452 /nfs/dbraw/zinc/44/94/52/1140449452.db2.gz MJNHUMNCDSBRHQ-LBPRGKRZSA-N 1 1 346.431 3.714 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000192184975 1140509153 /nfs/dbraw/zinc/50/91/53/1140509153.db2.gz HMXQZDDVVWSQDP-LBPRGKRZSA-N 1 1 333.413 3.577 20 5 EHBDMO CO[C@H](C)c1nc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cs1 ZINC000267644698 1140815224 /nfs/dbraw/zinc/81/52/24/1140815224.db2.gz SBIDBBPHNJHEMY-HOSRBBHYSA-N 1 1 333.413 3.562 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC4(C3)CCOCC4)o2)cc1 ZINC000271238030 1141331314 /nfs/dbraw/zinc/33/13/14/1141331314.db2.gz XLIXYMJGIQZHMX-UHFFFAOYSA-N 1 1 342.395 3.857 20 5 EHBDMO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000271650809 1141412875 /nfs/dbraw/zinc/41/28/75/1141412875.db2.gz VBIJGUSTKBHLAS-OLZOCXBDSA-N 1 1 345.374 3.720 20 5 EHBDMO COc1ccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000349063075 1141631867 /nfs/dbraw/zinc/63/18/67/1141631867.db2.gz OVADXXSCOVPYGV-UHFFFAOYSA-N 1 1 342.395 3.721 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000072034411 201172740 /nfs/dbraw/zinc/17/27/40/201172740.db2.gz XBQQFZVHZKDYTI-KRWDZBQOSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000072034411 201172745 /nfs/dbraw/zinc/17/27/45/201172745.db2.gz XBQQFZVHZKDYTI-KRWDZBQOSA-N 1 1 339.395 3.506 20 5 EHBDMO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282937 1015780902 /nfs/dbraw/zinc/78/09/02/1015780902.db2.gz GVQPOCQIIJDSIS-AAEUAGOBSA-N 1 1 328.372 3.604 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001167116516 1016102039 /nfs/dbraw/zinc/10/20/39/1016102039.db2.gz QYNSDXARGSFRTK-UHFFFAOYSA-N 1 1 349.450 3.822 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000340018468 1016119935 /nfs/dbraw/zinc/11/99/35/1016119935.db2.gz QTRMNOHAUGPYBI-VIFPVBQESA-N 1 1 341.198 3.773 20 5 EHBDMO CC1(C)C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@H]1O ZINC000275435423 1016772025 /nfs/dbraw/zinc/77/20/25/1016772025.db2.gz JPPADSZWJPZAOK-GOSISDBHSA-N 1 1 337.419 3.539 20 5 EHBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000461032275 1032230359 /nfs/dbraw/zinc/23/03/59/1032230359.db2.gz ZWCRIUDTDLUMMR-OAHLLOKOSA-N 1 1 335.451 3.847 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000485143983 1032331786 /nfs/dbraw/zinc/33/17/86/1032331786.db2.gz JZTLDMVVWJAZMX-HNNXBMFYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000157752315 1032339879 /nfs/dbraw/zinc/33/98/79/1032339879.db2.gz ONEQPCIIYNRGOT-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO COc1ccc(C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)nc1 ZINC000593042041 1032677650 /nfs/dbraw/zinc/67/76/50/1032677650.db2.gz WOCRIHCZRDOBDQ-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn4ccccc4n3)C2)cc1 ZINC000449506666 1032688982 /nfs/dbraw/zinc/68/89/82/1032688982.db2.gz ZHOSJJLLWJDMSK-INIZCTEOSA-N 1 1 336.395 3.622 20 5 EHBDMO [NH3+]CCC[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000415050589 1017459837 /nfs/dbraw/zinc/45/98/37/1017459837.db2.gz ISGMFVANTPTVAR-QGZVFWFLSA-N 1 1 333.819 3.818 20 5 EHBDMO C[C@H]1CCN(c2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610284395 1017685048 /nfs/dbraw/zinc/68/50/48/1017685048.db2.gz YCRPVESVRYBZPC-AWEZNQCLSA-N 1 1 331.441 3.757 20 5 EHBDMO C[C@@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294690 1017900066 /nfs/dbraw/zinc/90/00/66/1017900066.db2.gz WYRGYSNRZZTMSP-QAPCUYQASA-N 1 1 336.395 3.883 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610002119 1017983376 /nfs/dbraw/zinc/98/33/76/1017983376.db2.gz DTJXHZWCKXIZBQ-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610002119 1017983391 /nfs/dbraw/zinc/98/33/91/1017983391.db2.gz DTJXHZWCKXIZBQ-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010021 1018197055 /nfs/dbraw/zinc/19/70/55/1018197055.db2.gz BSXIIFICMOXOGP-RHSMWYFYSA-N 1 1 340.427 3.678 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275626 1019495411 /nfs/dbraw/zinc/49/54/11/1019495411.db2.gz HYSAHOFXEUBUCS-KDOFPFPSSA-N 1 1 339.395 3.616 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275626 1019495427 /nfs/dbraw/zinc/49/54/27/1019495427.db2.gz HYSAHOFXEUBUCS-KDOFPFPSSA-N 1 1 339.395 3.616 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000182970085 1019859320 /nfs/dbraw/zinc/85/93/20/1019859320.db2.gz QJIXSGDGBJIGTC-JKSUJKDBSA-N 1 1 342.443 3.652 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855560 1020214201 /nfs/dbraw/zinc/21/42/01/1020214201.db2.gz DDLCOMAYZDYNNC-LLVKDONJSA-N 1 1 327.812 3.555 20 5 EHBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922880 1020242730 /nfs/dbraw/zinc/24/27/30/1020242730.db2.gz GDFGLRSNFKFCJM-CABCVRRESA-N 1 1 344.411 3.838 20 5 EHBDMO CC1=C(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000280723852 1020612170 /nfs/dbraw/zinc/61/21/70/1020612170.db2.gz KKRWUTYAQZGSCP-UHFFFAOYSA-N 1 1 327.384 3.834 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCOCC(F)(F)F)C1CC1 ZINC000135231747 1020919560 /nfs/dbraw/zinc/91/95/60/1020919560.db2.gz CYZSJTUEBAGYLP-UHFFFAOYSA-N 1 1 332.322 3.528 20 5 EHBDMO COc1cc(C[N@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC ZINC000157827223 1021076223 /nfs/dbraw/zinc/07/62/23/1021076223.db2.gz QUXDKMBNDMTEGY-NSHDSACASA-N 1 1 336.413 3.867 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC ZINC000157827223 1021076231 /nfs/dbraw/zinc/07/62/31/1021076231.db2.gz QUXDKMBNDMTEGY-NSHDSACASA-N 1 1 336.413 3.867 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507667347 1021424766 /nfs/dbraw/zinc/42/47/66/1021424766.db2.gz URZYPFCWOPBDPA-KRWDZBQOSA-N 1 1 326.396 3.668 20 5 EHBDMO COc1ccc2c(c1)CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000439778846 1021704008 /nfs/dbraw/zinc/70/40/08/1021704008.db2.gz BEZYZEYXWCHLBG-GQCTYLIASA-N 1 1 338.407 3.717 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@](O)(C3CC3)C2)s1 ZINC000426524795 1021810658 /nfs/dbraw/zinc/81/06/58/1021810658.db2.gz PNBDIWNELVQKLY-GOSISDBHSA-N 1 1 344.436 3.670 20 5 EHBDMO CCCC[N@@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000593705095 1033010317 /nfs/dbraw/zinc/01/03/17/1033010317.db2.gz LPTGQNQKRDPJOF-AWEZNQCLSA-N 1 1 333.354 3.520 20 5 EHBDMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989791 1022591975 /nfs/dbraw/zinc/59/19/75/1022591975.db2.gz UPMAWLYMMKCBOQ-OCCSQVGLSA-N 1 1 332.425 3.526 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CCCOCC2)cc1[N+](=O)[O-] ZINC000510517890 1022632011 /nfs/dbraw/zinc/63/20/11/1022632011.db2.gz NATRLODPSDSAKS-UHFFFAOYSA-N 1 1 341.411 3.585 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCCOCC2)cc1[N+](=O)[O-] ZINC000510517890 1022632019 /nfs/dbraw/zinc/63/20/19/1022632019.db2.gz NATRLODPSDSAKS-UHFFFAOYSA-N 1 1 341.411 3.585 20 5 EHBDMO CC(C)[C@@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498570 1022727782 /nfs/dbraw/zinc/72/77/82/1022727782.db2.gz YFWBLTLOKRLXGT-GXTWGEPZSA-N 1 1 330.388 3.684 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761042716 1033102168 /nfs/dbraw/zinc/10/21/68/1033102168.db2.gz QLMINZSUNUBBBN-LBPRGKRZSA-N 1 1 332.322 3.766 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761042716 1033102183 /nfs/dbraw/zinc/10/21/83/1033102183.db2.gz QLMINZSUNUBBBN-LBPRGKRZSA-N 1 1 332.322 3.766 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@@H]21 ZINC000248417902 1023260493 /nfs/dbraw/zinc/26/04/93/1023260493.db2.gz JXUAFBHIIUQWAD-DAXOMENPSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2ccccc2C1 ZINC000520748293 1024608572 /nfs/dbraw/zinc/60/85/72/1024608572.db2.gz KBAWLNSBGNDMRQ-ZDUSSCGKSA-N 1 1 329.375 3.593 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001167958632 1024772524 /nfs/dbraw/zinc/77/25/24/1024772524.db2.gz KQMBHQGZCRUYLR-LBPRGKRZSA-N 1 1 339.823 3.699 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H]4CSC[C@@H]4C3)cs2)c1 ZINC000895779163 1024826271 /nfs/dbraw/zinc/82/62/71/1024826271.db2.gz MBVCVLZGVCPHFG-BETUJISGSA-N 1 1 347.465 3.513 20 5 EHBDMO COc1cc(NC[C@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435585073 1025019045 /nfs/dbraw/zinc/01/90/45/1025019045.db2.gz RUDJUSZQOQCMOI-MRXNPFEDSA-N 1 1 333.432 3.812 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1cccc([N+](=O)[O-])c1C ZINC000051377086 1025034489 /nfs/dbraw/zinc/03/44/89/1025034489.db2.gz CTOMYTWZLMJWNR-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@H+]2C2CCCCC2)c(F)c1 ZINC000435746950 1025122206 /nfs/dbraw/zinc/12/22/06/1025122206.db2.gz CDXJZUPXBCSLFB-KRWDZBQOSA-N 1 1 335.423 3.621 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072014222 1025147152 /nfs/dbraw/zinc/14/71/52/1025147152.db2.gz QJSNPXRVPFHJKM-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO CSC[C@H]1CCC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425428646 1025261236 /nfs/dbraw/zinc/26/12/36/1025261236.db2.gz WMQSUYXOLIAWES-GFCCVEGCSA-N 1 1 345.262 3.685 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425428646 1025261243 /nfs/dbraw/zinc/26/12/43/1025261243.db2.gz WMQSUYXOLIAWES-GFCCVEGCSA-N 1 1 345.262 3.685 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2cccs2)n1 ZINC000511073425 1025271990 /nfs/dbraw/zinc/27/19/90/1025271990.db2.gz PQQOJFIMBLVNCE-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2cccs2)n1 ZINC000511073425 1025271997 /nfs/dbraw/zinc/27/19/97/1025271997.db2.gz PQQOJFIMBLVNCE-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[C@@H](COCc1ccccc1)C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001167548825 1025315883 /nfs/dbraw/zinc/31/58/83/1025315883.db2.gz IAPUYMLHMVFIFB-OAHLLOKOSA-N 1 1 326.396 3.763 20 5 EHBDMO C[C@@H](COCc1ccccc1)C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001167548825 1025315896 /nfs/dbraw/zinc/31/58/96/1025315896.db2.gz IAPUYMLHMVFIFB-OAHLLOKOSA-N 1 1 326.396 3.763 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)(F)CC1 ZINC000602992681 1033290773 /nfs/dbraw/zinc/29/07/73/1033290773.db2.gz CJYXVPYKMWRLSL-LLVKDONJSA-N 1 1 334.351 3.530 20 5 EHBDMO Cc1ccccc1[C@@H]([C@H](C)NCc1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000443004427 1025654884 /nfs/dbraw/zinc/65/48/84/1025654884.db2.gz DCUCOYVGOFRNTM-OXJNMPFZSA-N 1 1 341.455 3.993 20 5 EHBDMO Cc1ccccc1[C@@H]([C@H](C)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000443008632 1025659354 /nfs/dbraw/zinc/65/93/54/1025659354.db2.gz GZNMZXXGYBGRAL-HNAYVOBHSA-N 1 1 327.428 3.684 20 5 EHBDMO Cc1noc(C)c1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549168 1026101526 /nfs/dbraw/zinc/10/15/26/1026101526.db2.gz PBXUIDSHUPSOQH-INIZCTEOSA-N 1 1 329.400 3.622 20 5 EHBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475114618 1026211325 /nfs/dbraw/zinc/21/13/25/1026211325.db2.gz AHHGJOGXMCHIHL-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(OC(C)(C)C)n1 ZINC000511123542 1026245950 /nfs/dbraw/zinc/24/59/50/1026245950.db2.gz KLEDJUKUNPUJHK-UHFFFAOYSA-N 1 1 343.427 3.842 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C2CC2)O1 ZINC000475291885 1026436812 /nfs/dbraw/zinc/43/68/12/1026436812.db2.gz QJWQXMRRUCFXRF-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C2CC2)O1 ZINC000475291885 1026436818 /nfs/dbraw/zinc/43/68/18/1026436818.db2.gz QJWQXMRRUCFXRF-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2)o1 ZINC000511141355 1026448046 /nfs/dbraw/zinc/44/80/46/1026448046.db2.gz VYHWSQMTKDEVSB-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2)o1 ZINC000511141355 1026448051 /nfs/dbraw/zinc/44/80/51/1026448051.db2.gz VYHWSQMTKDEVSB-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000340012696 1026795222 /nfs/dbraw/zinc/79/52/22/1026795222.db2.gz AMKKKODNZMQLKD-UHFFFAOYSA-N 1 1 329.187 3.909 20 5 EHBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000342784006 1027032012 /nfs/dbraw/zinc/03/20/12/1027032012.db2.gz REOUDPZQZNTFTO-LBPRGKRZSA-N 1 1 349.460 3.522 20 5 EHBDMO Cc1ccc(C(=O)C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000054295200 1027888280 /nfs/dbraw/zinc/88/82/80/1027888280.db2.gz JEBFPKDIYUAIDY-UHFFFAOYSA-N 1 1 338.407 3.998 20 5 EHBDMO [NH3+][C@@H]1C[C@@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036616 1028144722 /nfs/dbraw/zinc/14/47/22/1028144722.db2.gz ATJNWJJHZIOVDD-HZPDHXFCSA-N 1 1 331.803 3.525 20 5 EHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680972 1028150697 /nfs/dbraw/zinc/15/06/97/1028150697.db2.gz XWJDRIGGGIGOOL-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000444699513 1028173484 /nfs/dbraw/zinc/17/34/84/1028173484.db2.gz DOPRXNWAIMMODX-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000444699513 1028173486 /nfs/dbraw/zinc/17/34/86/1028173486.db2.gz DOPRXNWAIMMODX-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO CCOc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289692 1028327387 /nfs/dbraw/zinc/32/73/87/1028327387.db2.gz BONIFYZXZZEDHF-KBPBESRZSA-N 1 1 343.427 3.864 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CO[NH+]=C(N)C1CCCCC1 ZINC000729674932 1028350786 /nfs/dbraw/zinc/35/07/86/1028350786.db2.gz WEEVLKLRFIXYIY-UHFFFAOYSA-N 1 1 335.404 3.961 20 5 EHBDMO CCc1ccc([C@H](N[C@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438984 1028446633 /nfs/dbraw/zinc/44/66/33/1028446633.db2.gz RWWVTGUBHYVZOG-AUUYWEPGSA-N 1 1 345.443 3.947 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701364 1028553473 /nfs/dbraw/zinc/55/34/73/1028553473.db2.gz HTEVDUCHWQXBMV-LJQANCHMSA-N 1 1 340.423 3.853 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739813 1029047825 /nfs/dbraw/zinc/04/78/25/1029047825.db2.gz JHNRTGOLNAWXPN-NWDGAFQWSA-N 1 1 336.823 3.606 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000504906028 1029051081 /nfs/dbraw/zinc/05/10/81/1029051081.db2.gz RQQSDTYTUNCIDO-CRAIPNDOSA-N 1 1 349.475 3.765 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532966848 1029111981 /nfs/dbraw/zinc/11/19/81/1029111981.db2.gz XCABTIZWRCEVMX-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1OC ZINC000524425121 1029158908 /nfs/dbraw/zinc/15/89/08/1029158908.db2.gz HAECNZWBKQJYLP-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000524757220 1029488755 /nfs/dbraw/zinc/48/87/55/1029488755.db2.gz PLEHPLUSESAAIB-DNVCBOLYSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000524757220 1029488759 /nfs/dbraw/zinc/48/87/59/1029488759.db2.gz PLEHPLUSESAAIB-DNVCBOLYSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262048 1029542261 /nfs/dbraw/zinc/54/22/61/1029542261.db2.gz WTPZFAQEKCRRIG-CABCVRRESA-N 1 1 341.411 3.657 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(OCC(F)F)cc1)C2 ZINC000537625229 1029916698 /nfs/dbraw/zinc/91/66/98/1029916698.db2.gz UMSTZWGWQCKYQI-UHFFFAOYSA-N 1 1 348.349 3.797 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(OCC(F)F)cc1)C2 ZINC000537625229 1029916705 /nfs/dbraw/zinc/91/67/05/1029916705.db2.gz UMSTZWGWQCKYQI-UHFFFAOYSA-N 1 1 348.349 3.797 20 5 EHBDMO CCCC[N@H+](CCOC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000537628407 1029962857 /nfs/dbraw/zinc/96/28/57/1029962857.db2.gz IJOHGDPPZIMYBI-UHFFFAOYSA-N 1 1 349.456 3.967 20 5 EHBDMO CCCC[N@@H+](CCOC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000537628407 1029962875 /nfs/dbraw/zinc/96/28/75/1029962875.db2.gz IJOHGDPPZIMYBI-UHFFFAOYSA-N 1 1 349.456 3.967 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Cl)c1 ZINC000447304301 1030102218 /nfs/dbraw/zinc/10/22/18/1030102218.db2.gz IJMARUCNNRCIBM-CQSZACIVSA-N 1 1 346.818 3.638 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000159448407 1030201966 /nfs/dbraw/zinc/20/19/66/1030201966.db2.gz FAZQYTPBLRUVKC-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000160082745 1030525107 /nfs/dbraw/zinc/52/51/07/1030525107.db2.gz ISJMEQPLZLDLHT-GOSISDBHSA-N 1 1 327.384 3.514 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000532351999 1030576805 /nfs/dbraw/zinc/57/68/05/1030576805.db2.gz PPNTUSQOZHUDSB-KXBFYZLASA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000532351999 1030576812 /nfs/dbraw/zinc/57/68/12/1030576812.db2.gz PPNTUSQOZHUDSB-KXBFYZLASA-N 1 1 326.396 3.903 20 5 EHBDMO CC1(C)CC(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC(C)(C)[NH2+]1 ZINC000192613501 1030767048 /nfs/dbraw/zinc/76/70/48/1030767048.db2.gz CWPLJUAUSIJMLX-QGZVFWFLSA-N 1 1 331.460 3.871 20 5 EHBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361712 1030984274 /nfs/dbraw/zinc/98/42/74/1030984274.db2.gz YCOTULQTZAPZBW-GOEBONIOSA-N 1 1 344.411 3.980 20 5 EHBDMO CCC(CC)C[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000782477190 1031746964 /nfs/dbraw/zinc/74/69/64/1031746964.db2.gz JADHXMHMHOZHMT-UHFFFAOYSA-N 1 1 339.411 3.821 20 5 EHBDMO COc1cc(OC)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000593628983 1033509402 /nfs/dbraw/zinc/50/94/02/1033509402.db2.gz IHFGVJGWMKDUOH-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293224 1033575217 /nfs/dbraw/zinc/57/52/17/1033575217.db2.gz TUIYLQZGPKCQBV-ZFWWWQNUSA-N 1 1 348.472 3.816 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000595040486 1033659971 /nfs/dbraw/zinc/65/99/71/1033659971.db2.gz LJURFBSCEGBZMU-MEDUHNTESA-N 1 1 346.358 3.917 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CCCC[N@H+]2C2CC2)ccc2cnccc21 ZINC000599072321 1033714669 /nfs/dbraw/zinc/71/46/69/1033714669.db2.gz BVQCUCOPMPAYTG-OAHLLOKOSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000595430831 1033797547 /nfs/dbraw/zinc/79/75/47/1033797547.db2.gz ORJRDLRWMDTXPK-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000595430831 1033797562 /nfs/dbraw/zinc/79/75/62/1033797562.db2.gz ORJRDLRWMDTXPK-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO COc1ccc(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)nc1 ZINC000595565263 1033844508 /nfs/dbraw/zinc/84/45/08/1033844508.db2.gz ASJYHMACMZJSFS-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO Cc1noc(C[N@@H+]2CCCC[C@@H]2Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595556707 1033862651 /nfs/dbraw/zinc/86/26/51/1033862651.db2.gz BQOWCVMUBUDGPE-CQSZACIVSA-N 1 1 333.363 3.628 20 5 EHBDMO Cc1noc(C[N@H+]2CCCC[C@@H]2Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595556707 1033862660 /nfs/dbraw/zinc/86/26/60/1033862660.db2.gz BQOWCVMUBUDGPE-CQSZACIVSA-N 1 1 333.363 3.628 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000595716260 1033960965 /nfs/dbraw/zinc/96/09/65/1033960965.db2.gz GIBASVMNTFOGGD-QGZVFWFLSA-N 1 1 328.368 3.542 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000595716260 1033960969 /nfs/dbraw/zinc/96/09/69/1033960969.db2.gz GIBASVMNTFOGGD-QGZVFWFLSA-N 1 1 328.368 3.542 20 5 EHBDMO Cc1cccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)c1C ZINC000603837320 1033963144 /nfs/dbraw/zinc/96/31/44/1033963144.db2.gz JITRVCAJYPVXEZ-UHFFFAOYSA-N 1 1 339.439 3.842 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603868410 1033994038 /nfs/dbraw/zinc/99/40/38/1033994038.db2.gz LOSRLTIUPDCWJX-SFHVURJKSA-N 1 1 326.396 3.811 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CO)c1ccc(F)cc1F ZINC000595867415 1034012438 /nfs/dbraw/zinc/01/24/38/1034012438.db2.gz MVPSVXFMKDUUEL-DIFFPNOSSA-N 1 1 336.338 3.566 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690698 1034096310 /nfs/dbraw/zinc/09/63/10/1034096310.db2.gz PGUAFRYWOSCHOY-BAABZTOOSA-N 1 1 342.399 3.823 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000596168107 1034116607 /nfs/dbraw/zinc/11/66/07/1034116607.db2.gz KREUFOZHKROQKL-RISCZKNCSA-N 1 1 343.349 3.534 20 5 EHBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000596590226 1034307899 /nfs/dbraw/zinc/30/78/99/1034307899.db2.gz DPJUAROYPPDUPF-GOSISDBHSA-N 1 1 341.411 3.842 20 5 EHBDMO COC[C@H](C)Oc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000596978692 1034477000 /nfs/dbraw/zinc/47/70/00/1034477000.db2.gz APENYRMMQSYATD-HNNXBMFYSA-N 1 1 344.411 3.641 20 5 EHBDMO COC[C@H](C)Oc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000596978692 1034477005 /nfs/dbraw/zinc/47/70/05/1034477005.db2.gz APENYRMMQSYATD-HNNXBMFYSA-N 1 1 344.411 3.641 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000364082274 1034536785 /nfs/dbraw/zinc/53/67/85/1034536785.db2.gz FJABFKWGMOSRIJ-WDEREUQCSA-N 1 1 329.322 3.652 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(C(F)(F)F)c1 ZINC000364082273 1034537305 /nfs/dbraw/zinc/53/73/05/1034537305.db2.gz FJABFKWGMOSRIJ-QWRGUYRKSA-N 1 1 329.322 3.652 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007155 1035025926 /nfs/dbraw/zinc/02/59/26/1035025926.db2.gz SQDBNSHQAHRVLN-KRWDZBQOSA-N 1 1 341.411 3.768 20 5 EHBDMO C[C@@H](c1cccc(Nc2ccc(F)cc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000511461311 1035471777 /nfs/dbraw/zinc/47/17/77/1035471777.db2.gz KCSQDWWCPGCPOS-ZDUSSCGKSA-N 1 1 345.374 3.871 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000588072497 1035699894 /nfs/dbraw/zinc/69/98/94/1035699894.db2.gz RGCMIFZMAOVAAN-SFHVURJKSA-N 1 1 343.452 3.759 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000492374093 1035703075 /nfs/dbraw/zinc/70/30/75/1035703075.db2.gz GKLVQWFTZVMMJI-GUYCJALGSA-N 1 1 349.862 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000173979854 1035823475 /nfs/dbraw/zinc/82/34/75/1035823475.db2.gz DUPVWJQMFCRYBR-IBGZPJMESA-N 1 1 340.423 3.676 20 5 EHBDMO CC[C@@H](Nc1[nH+]c2cccc(F)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000443520647 1036229589 /nfs/dbraw/zinc/22/95/89/1036229589.db2.gz GFHBHUHKMSEPPD-CQSZACIVSA-N 1 1 328.347 3.606 20 5 EHBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000589210516 1036312993 /nfs/dbraw/zinc/31/29/93/1036312993.db2.gz NKEJLVKCYGJOBZ-LJQANCHMSA-N 1 1 344.411 3.839 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CC2(O)CCCCCC2)ccc1[N+](=O)[O-] ZINC000492819560 1036320931 /nfs/dbraw/zinc/32/09/31/1036320931.db2.gz SOYUMLVQBRQPDC-UHFFFAOYSA-N 1 1 336.432 3.511 20 5 EHBDMO COC(=O)c1oc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000180399936 1036755483 /nfs/dbraw/zinc/75/54/83/1036755483.db2.gz JFKKXJUJVGFOLR-RYUDHWBXSA-N 1 1 332.356 3.695 20 5 EHBDMO CC(C)([NH2+]Cc1nccn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000191296285 1036910874 /nfs/dbraw/zinc/91/08/74/1036910874.db2.gz DUOHDHYVXUPYEE-UHFFFAOYSA-N 1 1 336.395 3.805 20 5 EHBDMO CC[N@H+](Cc1occc1C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000412028798 1036951694 /nfs/dbraw/zinc/95/16/94/1036951694.db2.gz SQNPHEZZYWMHTH-CQSZACIVSA-N 1 1 345.399 3.654 20 5 EHBDMO CC[N@@H+](Cc1occc1C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000412028798 1036951700 /nfs/dbraw/zinc/95/17/00/1036951700.db2.gz SQNPHEZZYWMHTH-CQSZACIVSA-N 1 1 345.399 3.654 20 5 EHBDMO C[C@@H]1C[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233795 1036957843 /nfs/dbraw/zinc/95/78/43/1036957843.db2.gz UYHZXTBHFAACFG-MOXGXCLJSA-N 1 1 339.439 3.757 20 5 EHBDMO CC(C)Oc1ncccc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761514579 1037093823 /nfs/dbraw/zinc/09/38/23/1037093823.db2.gz DLZCWIRAEUSKKF-UHFFFAOYSA-N 1 1 335.791 3.720 20 5 EHBDMO Cc1sc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1C ZINC000271763068 1037160833 /nfs/dbraw/zinc/16/08/33/1037160833.db2.gz PFZLKVJGCXFFEI-GFCCVEGCSA-N 1 1 347.440 3.871 20 5 EHBDMO CC[N@@H+](CCC(=O)OC)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000511510487 1037234170 /nfs/dbraw/zinc/23/41/70/1037234170.db2.gz VSMMVAWMEHDMBD-UHFFFAOYSA-N 1 1 348.424 3.708 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000181221583 1037464701 /nfs/dbraw/zinc/46/47/01/1037464701.db2.gz IJKPXZPNEPKPAR-KDOFPFPSSA-N 1 1 344.386 3.991 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@@H]2CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000493714458 1037575819 /nfs/dbraw/zinc/57/58/19/1037575819.db2.gz YUZRIMURXWZZDK-GOEBONIOSA-N 1 1 336.432 3.631 20 5 EHBDMO C[C@@H](CO)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000549945976 1037768580 /nfs/dbraw/zinc/76/85/80/1037768580.db2.gz PASRZLPNQNQXOW-NSHDSACASA-N 1 1 346.349 3.739 20 5 EHBDMO CC[C@@]1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000443862923 1037795104 /nfs/dbraw/zinc/79/51/04/1037795104.db2.gz PLZZXPBDFRVQJM-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000443862923 1037795118 /nfs/dbraw/zinc/79/51/18/1037795118.db2.gz PLZZXPBDFRVQJM-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(OC(F)F)c2)c(Cl)c1 ZINC000341263544 1037855648 /nfs/dbraw/zinc/85/56/48/1037855648.db2.gz IGJYAJOXMHAPFT-UHFFFAOYSA-N 1 1 343.717 3.534 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC2CC2)cn1 ZINC000592146051 1037874102 /nfs/dbraw/zinc/87/41/02/1037874102.db2.gz LYNPOJPHPOEEQY-UHFFFAOYSA-N 1 1 329.375 3.850 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC2CC2)cn1 ZINC000592146051 1037874124 /nfs/dbraw/zinc/87/41/24/1037874124.db2.gz LYNPOJPHPOEEQY-UHFFFAOYSA-N 1 1 329.375 3.850 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000104661185 1038439779 /nfs/dbraw/zinc/43/97/79/1038439779.db2.gz APBPMSFOQSNWBG-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541390324 1038582912 /nfs/dbraw/zinc/58/29/12/1038582912.db2.gz POVAFUWKWGWJNL-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541390324 1038582921 /nfs/dbraw/zinc/58/29/21/1038582921.db2.gz POVAFUWKWGWJNL-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500472089 1038783343 /nfs/dbraw/zinc/78/33/43/1038783343.db2.gz WFEDEZURFOXBCL-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000488361800 1039124278 /nfs/dbraw/zinc/12/42/78/1039124278.db2.gz FDIDOUPILMGPAC-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000488361800 1039124292 /nfs/dbraw/zinc/12/42/92/1039124292.db2.gz FDIDOUPILMGPAC-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668094 1039386144 /nfs/dbraw/zinc/38/61/44/1039386144.db2.gz ICUGJSLWRZBFEK-IUODEOHRSA-N 1 1 346.818 3.891 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000728918109 1039390823 /nfs/dbraw/zinc/39/08/23/1039390823.db2.gz JEJBMXZAZXGMCD-RTBURBONSA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000480676578 1039874622 /nfs/dbraw/zinc/87/46/22/1039874622.db2.gz NWTOVLDFKKJMNZ-LLVKDONJSA-N 1 1 344.802 3.986 20 5 EHBDMO CC(C)(C)Oc1cc(NCc2c[nH+]c3n2CCCC3)ccc1[N+](=O)[O-] ZINC000553253796 1039915561 /nfs/dbraw/zinc/91/55/61/1039915561.db2.gz AFKTXPITBWLYCM-UHFFFAOYSA-N 1 1 344.415 3.917 20 5 EHBDMO CCc1ccc([C@@H](COC)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000573741487 1040213958 /nfs/dbraw/zinc/21/39/58/1040213958.db2.gz IXNNUZQCZWBIEN-JKSUJKDBSA-N 1 1 330.384 3.715 20 5 EHBDMO CN(C)[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130766 1040365213 /nfs/dbraw/zinc/36/52/13/1040365213.db2.gz OJAKAUPAAHNFTQ-WOJBJXKFSA-N 1 1 339.439 3.614 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075411 1040434496 /nfs/dbraw/zinc/43/44/96/1040434496.db2.gz PLUASMGBLMDSKW-FMKPAKJESA-N 1 1 331.416 3.576 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490340288 1040501215 /nfs/dbraw/zinc/50/12/15/1040501215.db2.gz MHFKEPDJOAERMK-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCCO1 ZINC000511657385 1040863030 /nfs/dbraw/zinc/86/30/30/1040863030.db2.gz QOJASFGGEHBTHB-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC001167754017 1040871717 /nfs/dbraw/zinc/87/17/17/1040871717.db2.gz SSFCPPMXTIGVCN-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO CN(C)c1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc[nH+]1 ZINC000500410663 1041391479 /nfs/dbraw/zinc/39/14/79/1041391479.db2.gz OCXRRWHFBBIBCD-UHFFFAOYSA-N 1 1 342.399 3.606 20 5 EHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000511668796 1041456854 /nfs/dbraw/zinc/45/68/54/1041456854.db2.gz VSILLLZNSGRWBA-AQDCRGGLSA-N 1 1 338.407 3.854 20 5 EHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875323 1041787629 /nfs/dbraw/zinc/78/76/29/1041787629.db2.gz NLRAZLQZLISFTF-LBPRGKRZSA-N 1 1 335.429 3.740 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C(C)(C)c1ccccc1 ZINC000585754347 1043024567 /nfs/dbraw/zinc/02/45/67/1043024567.db2.gz IWRZBHOWAQTWLU-UHFFFAOYSA-N 1 1 341.411 3.709 20 5 EHBDMO C[C@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1C ZINC000090095025 1043367696 /nfs/dbraw/zinc/36/76/96/1043367696.db2.gz WVBSFPKPIMBFMF-GOEBONIOSA-N 1 1 340.427 3.576 20 5 EHBDMO CC1CCC([N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898041 1043671540 /nfs/dbraw/zinc/67/15/40/1043671540.db2.gz UKLYQRRQWLLJAJ-UHFFFAOYSA-N 1 1 328.416 3.926 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259845 1044430797 /nfs/dbraw/zinc/43/07/97/1044430797.db2.gz LSLACFRFNZNJRL-AWEZNQCLSA-N 1 1 339.395 3.759 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259845 1044430800 /nfs/dbraw/zinc/43/08/00/1044430800.db2.gz LSLACFRFNZNJRL-AWEZNQCLSA-N 1 1 339.395 3.759 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000512339692 1044794385 /nfs/dbraw/zinc/79/43/85/1044794385.db2.gz YWJJPHKOHTULBF-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000072965825 1126953838 /nfs/dbraw/zinc/95/38/38/1126953838.db2.gz YSPVVGMTBGPNRQ-LSDHHAIUSA-N 1 1 337.489 3.743 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000131207239 1126969127 /nfs/dbraw/zinc/96/91/27/1126969127.db2.gz SJZNSVZRHQAOCW-KRWDZBQOSA-N 1 1 346.383 3.550 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083133643 1127210117 /nfs/dbraw/zinc/21/01/17/1127210117.db2.gz QBADQBMDHWRKHA-GFCCVEGCSA-N 1 1 341.367 3.938 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083133643 1127210120 /nfs/dbraw/zinc/21/01/20/1127210120.db2.gz QBADQBMDHWRKHA-GFCCVEGCSA-N 1 1 341.367 3.938 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000301467876 1128439221 /nfs/dbraw/zinc/43/92/21/1128439221.db2.gz YNQPOBNNAXVEAV-KRWDZBQOSA-N 1 1 325.412 3.553 20 5 EHBDMO Cc1ccnc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000301562902 1128498221 /nfs/dbraw/zinc/49/82/21/1128498221.db2.gz IWOZSXXQNCVHOU-RDJZCZTQSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO)c1ccccc1 ZINC000554279721 1128633875 /nfs/dbraw/zinc/63/38/75/1128633875.db2.gz PLTSFXBABGRSOZ-CVEARBPZSA-N 1 1 328.412 3.581 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000609194194 1120542824 /nfs/dbraw/zinc/54/28/24/1120542824.db2.gz CPNSPOKUBMDRJO-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CCC[N@H+](C2CCCC2)CC1 ZINC000254988975 1128976648 /nfs/dbraw/zinc/97/66/48/1128976648.db2.gz GXUIOFDNLLGDTH-YVMONPNESA-N 1 1 329.444 3.558 20 5 EHBDMO CC(=O)c1ccc(NC[C@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000301756542 1129033868 /nfs/dbraw/zinc/03/38/68/1129033868.db2.gz DUNGRMNQYNWTBF-OAHLLOKOSA-N 1 1 333.432 3.577 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000917088533 1122486209 /nfs/dbraw/zinc/48/62/09/1122486209.db2.gz KLVMEGJVIJJIEH-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000917842519 1122692149 /nfs/dbraw/zinc/69/21/49/1122692149.db2.gz WLQDMYCYTTUZAL-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000917842519 1122692151 /nfs/dbraw/zinc/69/21/51/1122692151.db2.gz WLQDMYCYTTUZAL-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000556130204 1122832856 /nfs/dbraw/zinc/83/28/56/1122832856.db2.gz KDCIWZQDGQJNCM-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000609800859 1123665307 /nfs/dbraw/zinc/66/53/07/1123665307.db2.gz UEWFCXMFKFFGKZ-SFHVURJKSA-N 1 1 344.436 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916597 1123691715 /nfs/dbraw/zinc/69/17/15/1123691715.db2.gz ZRTSHNMBEUJKNB-QGZVFWFLSA-N 1 1 328.387 3.841 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610004495 1123712215 /nfs/dbraw/zinc/71/22/15/1123712215.db2.gz MQCRJUGNLRCLKG-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610004495 1123712217 /nfs/dbraw/zinc/71/22/17/1123712217.db2.gz MQCRJUGNLRCLKG-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610133496 1123739073 /nfs/dbraw/zinc/73/90/73/1123739073.db2.gz TXKNXJHAQJDJTI-JCURWCKSSA-N 1 1 336.407 3.759 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000446843443 1125334983 /nfs/dbraw/zinc/33/49/83/1125334983.db2.gz NNLUWKOSCRDPHK-GSPCDJLXSA-N 1 1 340.427 3.611 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)nc1-c1ccccc1 ZINC000301880118 1129252206 /nfs/dbraw/zinc/25/22/06/1129252206.db2.gz PCZQYXPTVMVTRD-HOTGVXAUSA-N 1 1 338.411 3.696 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)nc1-c1ccccc1 ZINC000301880123 1129252625 /nfs/dbraw/zinc/25/26/25/1129252625.db2.gz PCZQYXPTVMVTRD-JKSUJKDBSA-N 1 1 338.411 3.696 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1cc(C)nc2c1cccc2[N+](=O)[O-] ZINC000301982063 1129471004 /nfs/dbraw/zinc/47/10/04/1129471004.db2.gz BGSLMWNPCLGOKV-UHFFFAOYSA-N 1 1 339.399 3.849 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301995347 1129505654 /nfs/dbraw/zinc/50/56/54/1129505654.db2.gz SJRFABWFGQUODO-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO CC(C)c1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531609 /nfs/dbraw/zinc/53/16/09/1129531609.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 1 1 331.460 3.634 20 5 EHBDMO COCC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)C ZINC000092563180 1129552535 /nfs/dbraw/zinc/55/25/35/1129552535.db2.gz BANDOEYOXUBBJC-UHFFFAOYSA-N 1 1 349.456 3.823 20 5 EHBDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955479 1129593328 /nfs/dbraw/zinc/59/33/28/1129593328.db2.gz YJLYJYGKEMUJSL-BMIGLBTASA-N 1 1 338.766 3.772 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ncccc1[N+](=O)[O-] ZINC000390863198 1129639110 /nfs/dbraw/zinc/63/91/10/1129639110.db2.gz NIFQJZBDHCSKTK-KRWDZBQOSA-N 1 1 340.427 3.702 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000096992916 1129753806 /nfs/dbraw/zinc/75/38/06/1129753806.db2.gz VVVDCXKMHBVGSS-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)c1cccs1 ZINC000096992916 1129753809 /nfs/dbraw/zinc/75/38/09/1129753809.db2.gz VVVDCXKMHBVGSS-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034607 1129764767 /nfs/dbraw/zinc/76/47/67/1129764767.db2.gz JMIDJNIIKMRSAU-CABCVRRESA-N 1 1 335.423 3.825 20 5 EHBDMO Cc1cc(NCC[N@@H+]2CC=C(C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302180457 1129772073 /nfs/dbraw/zinc/77/20/73/1129772073.db2.gz YFPFKEARWXHJAI-UHFFFAOYSA-N 1 1 326.400 3.515 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245561734 1130239336 /nfs/dbraw/zinc/23/93/36/1130239336.db2.gz OHBGQELCUQLXGE-KBXCAEBGSA-N 1 1 340.427 3.760 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539080 1130244876 /nfs/dbraw/zinc/24/48/76/1130244876.db2.gz UYEOZADGXIKQGN-GFCCVEGCSA-N 1 1 336.413 3.737 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+](CC3CC3)C3CCCCC3)c2c1 ZINC000727824931 1130597273 /nfs/dbraw/zinc/59/72/73/1130597273.db2.gz JAODJYGUWUODGT-UHFFFAOYSA-N 1 1 328.416 3.947 20 5 EHBDMO COC[C@@]12CCC[C@@H]1C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908555 1131887955 /nfs/dbraw/zinc/88/79/55/1131887955.db2.gz OGIIBAHHDYYEDP-GGPKGHCWSA-N 1 1 344.455 3.591 20 5 EHBDMO CO[C@@H]1CCC[C@@H]2C[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910550 1131916778 /nfs/dbraw/zinc/91/67/78/1131916778.db2.gz LVERWRJPTAWPSX-LCLWPZTBSA-N 1 1 344.455 3.589 20 5 EHBDMO Cc1cc([C@H]2CCC[N@H+]2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910418 1131916913 /nfs/dbraw/zinc/91/69/13/1131916913.db2.gz ZFIDFAGNRXRWQF-QFBILLFUSA-N 1 1 341.411 3.976 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@](C)(F)CC2)c1F ZINC001173178941 1131992237 /nfs/dbraw/zinc/99/22/37/1131992237.db2.gz CHZIUHQIWCWBSP-PXAZEXFGSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1F ZINC001173196495 1131996648 /nfs/dbraw/zinc/99/66/48/1131996648.db2.gz NAAHBAXLNOBTRT-YDHLFZDLSA-N 1 1 336.407 3.938 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2ccc(F)cc2)C1 ZINC001173227260 1132006888 /nfs/dbraw/zinc/00/68/88/1132006888.db2.gz PAWLSDDAARZWTF-AUUYWEPGSA-N 1 1 344.386 3.818 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231193 1132008709 /nfs/dbraw/zinc/00/87/09/1132008709.db2.gz KJQBWOIBRVURHN-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1CC(=O)OC(C)(C)C ZINC001173231924 1132009397 /nfs/dbraw/zinc/00/93/97/1132009397.db2.gz OXGXYWDDKSEECK-RHSMWYFYSA-N 1 1 348.443 3.722 20 5 EHBDMO CC[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001169495402 1132771696 /nfs/dbraw/zinc/77/16/96/1132771696.db2.gz RGIBIXISCNJULE-QWRGUYRKSA-N 1 1 327.222 3.978 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001176940889 1133012798 /nfs/dbraw/zinc/01/27/98/1133012798.db2.gz WFZHFZJHJRMLBI-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001176940889 1133012805 /nfs/dbraw/zinc/01/28/05/1133012805.db2.gz WFZHFZJHJRMLBI-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761318 1133048732 /nfs/dbraw/zinc/04/87/32/1133048732.db2.gz JXOLTSQMKMJXOL-INIZCTEOSA-N 1 1 343.431 3.856 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000768093616 1133091407 /nfs/dbraw/zinc/09/14/07/1133091407.db2.gz PABCGYAWAFGTPT-HUUCEWRRSA-N 1 1 335.448 3.519 20 5 EHBDMO CCCC[N@@H+]1CCCC[C@@H]1CNCc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741716 1133098407 /nfs/dbraw/zinc/09/84/07/1133098407.db2.gz CHZLCYBMGKNVBN-QGZVFWFLSA-N 1 1 333.476 3.956 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNCc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741716 1133098414 /nfs/dbraw/zinc/09/84/14/1133098414.db2.gz CHZLCYBMGKNVBN-QGZVFWFLSA-N 1 1 333.476 3.956 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C/C=C/c2cccc(F)c2)CC1 ZINC001180497199 1133385569 /nfs/dbraw/zinc/38/55/69/1133385569.db2.gz DUUVOHDZFBBWBG-GQCTYLIASA-N 1 1 341.386 3.569 20 5 EHBDMO COc1c(O)ccc(C[NH+]2CC([C@@H]3CCC[C@@H](C)C3)C2)c1[N+](=O)[O-] ZINC001183446435 1133807098 /nfs/dbraw/zinc/80/70/98/1133807098.db2.gz ZSCLUKOEYBCVIR-CHWSQXEVSA-N 1 1 334.416 3.567 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2ccc(Cl)cc2)C2CC2)c1 ZINC000774658067 1133835480 /nfs/dbraw/zinc/83/54/80/1133835480.db2.gz CXRWSTPDSCPAIL-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000746665462 1133981455 /nfs/dbraw/zinc/98/14/55/1133981455.db2.gz BHHMOAVZYJOYMX-GOSISDBHSA-N 1 1 346.814 3.994 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000746665462 1133981460 /nfs/dbraw/zinc/98/14/60/1133981460.db2.gz BHHMOAVZYJOYMX-GOSISDBHSA-N 1 1 346.814 3.994 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788479052 1134130004 /nfs/dbraw/zinc/13/00/04/1134130004.db2.gz MYRYPMQKSPDODD-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501753 1134286197 /nfs/dbraw/zinc/28/61/97/1134286197.db2.gz CZFJCCGIFIETIA-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO CC(C)c1cccc2c1CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549154 1134295408 /nfs/dbraw/zinc/29/54/08/1134295408.db2.gz PRMUAJJNYVRIFI-FQEVSTJZSA-N 1 1 340.423 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cccc(C(F)F)c3)CC2)cc1 ZINC000791441296 1134551252 /nfs/dbraw/zinc/55/12/52/1134551252.db2.gz LATFJALCPMWNDC-UHFFFAOYSA-N 1 1 347.365 3.855 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329026 1134749422 /nfs/dbraw/zinc/74/94/22/1134749422.db2.gz NGJAINQNLUDCDD-ABAIWWIYSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328777 1134749753 /nfs/dbraw/zinc/74/97/53/1134749753.db2.gz MHWFYAAUODDHSD-LBPRGKRZSA-N 1 1 328.359 3.656 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170354469 1134754118 /nfs/dbraw/zinc/75/41/18/1134754118.db2.gz LSFDCRUSIABEIC-CQSZACIVSA-N 1 1 346.402 3.848 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353613 1134754493 /nfs/dbraw/zinc/75/44/93/1134754493.db2.gz ZYEKHHYYLHORFU-SWLSCSKDSA-N 1 1 347.440 3.828 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353613 1134754498 /nfs/dbraw/zinc/75/44/98/1134754498.db2.gz ZYEKHHYYLHORFU-SWLSCSKDSA-N 1 1 347.440 3.828 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC001191021193 1134780008 /nfs/dbraw/zinc/78/00/08/1134780008.db2.gz DAZBLCHIECJCOV-OAHLLOKOSA-N 1 1 347.459 3.990 20 5 EHBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202044 1134814912 /nfs/dbraw/zinc/81/49/12/1134814912.db2.gz DVWWPENSWUUDDL-GOEBONIOSA-N 1 1 326.824 3.884 20 5 EHBDMO COc1ccc(C[C@H]2CC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001191498684 1134883262 /nfs/dbraw/zinc/88/32/62/1134883262.db2.gz YXEPVEHIUCWDGT-MRXNPFEDSA-N 1 1 330.359 3.560 20 5 EHBDMO COc1ccc(C[C@H]2CC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001191498684 1134883271 /nfs/dbraw/zinc/88/32/71/1134883271.db2.gz YXEPVEHIUCWDGT-MRXNPFEDSA-N 1 1 330.359 3.560 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC001193888283 1135193315 /nfs/dbraw/zinc/19/33/15/1135193315.db2.gz DPAVPZXSEIYAIJ-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000805840167 1135333590 /nfs/dbraw/zinc/33/35/90/1135333590.db2.gz MMTQTRMJJPTKFD-GDBMZVCRSA-N 1 1 332.425 3.773 20 5 EHBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCC1 ZINC001199027806 1135877080 /nfs/dbraw/zinc/87/70/80/1135877080.db2.gz JDYAVMIJBXPMSU-UHFFFAOYSA-N 1 1 343.427 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cc1Cl ZINC000809758409 1135887883 /nfs/dbraw/zinc/88/78/83/1135887883.db2.gz MFVUIQLNSTXQAX-HIFRSBDPSA-N 1 1 338.835 3.887 20 5 EHBDMO C[N@@H+](CCc1ccncc1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809968401 1135904877 /nfs/dbraw/zinc/90/48/77/1135904877.db2.gz AZNODEZFQKUVJJ-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@H+](Cc1csc2ccccc12)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277922 1136131119 /nfs/dbraw/zinc/13/11/19/1136131119.db2.gz QURRCFRMVAJQAM-KRWDZBQOSA-N 1 1 342.420 3.975 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCCO1 ZINC000338924312 1136180493 /nfs/dbraw/zinc/18/04/93/1136180493.db2.gz HCHNXCVGBPOZOT-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000850428326 1136257196 /nfs/dbraw/zinc/25/71/96/1136257196.db2.gz MVOUMJBOOFVYPX-NWDGAFQWSA-N 1 1 345.355 3.923 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000850464138 1136264223 /nfs/dbraw/zinc/26/42/23/1136264223.db2.gz BRUDUCRWUPUWQE-GFCCVEGCSA-N 1 1 345.355 3.671 20 5 EHBDMO CCC[N@@H+](CCc1cccc(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585582 1136448432 /nfs/dbraw/zinc/44/84/32/1136448432.db2.gz XDVCVSYQFOTDKI-LJQANCHMSA-N 1 1 346.402 3.722 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000776586827 1136449036 /nfs/dbraw/zinc/44/90/36/1136449036.db2.gz ISDGNUZBTPJYCA-PMACEKPBSA-N 1 1 338.407 3.780 20 5 EHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591981 1136452979 /nfs/dbraw/zinc/45/29/79/1136452979.db2.gz NPISFMFRSPXBHL-CCKFTAQKSA-N 1 1 326.396 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593021 1136453562 /nfs/dbraw/zinc/45/35/62/1136453562.db2.gz TUKXPSXDBHFJJB-DLBZAZTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593021 1136453566 /nfs/dbraw/zinc/45/35/66/1136453566.db2.gz TUKXPSXDBHFJJB-DLBZAZTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814641790 1136488549 /nfs/dbraw/zinc/48/85/49/1136488549.db2.gz LEGZXNDZYLDQDG-IEBWSBKVSA-N 1 1 326.396 3.508 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H](O)C12CCCC2 ZINC000814667996 1136492252 /nfs/dbraw/zinc/49/22/52/1136492252.db2.gz VJWYIAGCPYVDTE-CYBMUJFWSA-N 1 1 345.226 3.781 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@H](O)C12CCCC2 ZINC000814667996 1136492255 /nfs/dbraw/zinc/49/22/55/1136492255.db2.gz VJWYIAGCPYVDTE-CYBMUJFWSA-N 1 1 345.226 3.781 20 5 EHBDMO O=[N+]([O-])c1cn(C[N@@H+](C2CC2)C2CCCCC2)nc1-c1ccccn1 ZINC000853489226 1136537211 /nfs/dbraw/zinc/53/72/11/1136537211.db2.gz KQQAXVYKNIYATQ-UHFFFAOYSA-N 1 1 341.415 3.608 20 5 EHBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815617763 1136619546 /nfs/dbraw/zinc/61/95/46/1136619546.db2.gz VAKIUSLJICFBDO-LRDDRELGSA-N 1 1 343.431 3.683 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2C2CC2)cc1Cl ZINC000816656711 1136745254 /nfs/dbraw/zinc/74/52/54/1136745254.db2.gz BJKUDHNADSIPBZ-MRXNPFEDSA-N 1 1 336.819 3.639 20 5 EHBDMO C[C@H](CSc1ccccc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359985 1137215319 /nfs/dbraw/zinc/21/53/19/1137215319.db2.gz LXGJXYNJJPNODU-RDTXWAMCSA-N 1 1 346.452 3.741 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)cc1F ZINC000844382155 1137218267 /nfs/dbraw/zinc/21/82/67/1137218267.db2.gz ADAZEQOGTCFAOE-UHFFFAOYSA-N 1 1 336.260 3.600 20 5 EHBDMO COc1ccc([C@@H](CCO)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872042261 1137567183 /nfs/dbraw/zinc/56/71/83/1137567183.db2.gz AEJVGVKBXAIZBD-BLLLJJGKSA-N 1 1 348.374 3.517 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CO)c1ccsc1 ZINC000872064029 1137569217 /nfs/dbraw/zinc/56/92/17/1137569217.db2.gz VKWXWMRIEWGDGM-IINYFYTJSA-N 1 1 338.454 3.762 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nccnc2C)cc1[N+](=O)[O-] ZINC000872132422 1137573263 /nfs/dbraw/zinc/57/32/63/1137573263.db2.gz FUVGTGFHTSFFNE-DGCLKSJQSA-N 1 1 330.388 3.504 20 5 EHBDMO Cc1nc2c(s1)[C@@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000877182571 1137672439 /nfs/dbraw/zinc/67/24/39/1137672439.db2.gz OEQPBXZHTSWNIN-NSHDSACASA-N 1 1 344.396 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000877672559 1137685173 /nfs/dbraw/zinc/68/51/73/1137685173.db2.gz HGFVZQWDTFWLSU-YJBOKZPZSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000877672559 1137685174 /nfs/dbraw/zinc/68/51/74/1137685174.db2.gz HGFVZQWDTFWLSU-YJBOKZPZSA-N 1 1 346.814 3.946 20 5 EHBDMO CCC[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877953955 1137696871 /nfs/dbraw/zinc/69/68/71/1137696871.db2.gz TZNXUCODZPJGMD-SNVBAGLBSA-N 1 1 338.795 3.919 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135254 1137703987 /nfs/dbraw/zinc/70/39/87/1137703987.db2.gz VXWHCXYCNFINFV-IPYPFGDCSA-N 1 1 342.399 3.798 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc(F)cn3)CC2)cc1F ZINC000879005623 1137734969 /nfs/dbraw/zinc/73/49/69/1137734969.db2.gz RVFNZSDTMNGGSY-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(OC)c1OC ZINC000879466931 1137748539 /nfs/dbraw/zinc/74/85/39/1137748539.db2.gz XWOZDBKXIFYFES-OAHLLOKOSA-N 1 1 348.374 3.992 20 5 EHBDMO Cc1cncc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000879747630 1137757721 /nfs/dbraw/zinc/75/77/21/1137757721.db2.gz OIJNAAZFNUTKSR-MRXNPFEDSA-N 1 1 327.384 3.514 20 5 EHBDMO Cc1csc([C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880012044 1137765486 /nfs/dbraw/zinc/76/54/86/1137765486.db2.gz XOKDAKRRSGSBFS-AWEZNQCLSA-N 1 1 347.440 3.618 20 5 EHBDMO CCSc1ccc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])cc1 ZINC000883237244 1137850060 /nfs/dbraw/zinc/85/00/60/1137850060.db2.gz WJARGJHJFANZFZ-UHFFFAOYSA-N 1 1 348.424 3.711 20 5 EHBDMO CC(C)([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccs1 ZINC000348322688 1137952385 /nfs/dbraw/zinc/95/23/85/1137952385.db2.gz OLXNHCUBZTZRTL-UHFFFAOYSA-N 1 1 344.396 3.731 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ncccc1C)C(C)C ZINC000120833956 1137952749 /nfs/dbraw/zinc/95/27/49/1137952749.db2.gz SQLLADCHYPOGDD-KRWDZBQOSA-N 1 1 329.400 3.794 20 5 EHBDMO CC1CCC([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000072803691 1138107809 /nfs/dbraw/zinc/10/78/09/1138107809.db2.gz ONMLXQBKQMXDHM-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000089512146 1138200409 /nfs/dbraw/zinc/20/04/09/1138200409.db2.gz NUGJZXOQUFMVPV-LBPRGKRZSA-N 1 1 345.355 3.753 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000336928833 1138429358 /nfs/dbraw/zinc/42/93/58/1138429358.db2.gz NYNQEPGNVZYHIS-HNNXBMFYSA-N 1 1 340.427 3.820 20 5 EHBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371347 1139486540 /nfs/dbraw/zinc/48/65/40/1139486540.db2.gz LZBLLAWDHBWPAJ-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371347 1139486545 /nfs/dbraw/zinc/48/65/45/1139486545.db2.gz LZBLLAWDHBWPAJ-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384689 1139487632 /nfs/dbraw/zinc/48/76/32/1139487632.db2.gz KDLXXJFYCIOTSV-BSEYFRJRSA-N 1 1 346.452 3.568 20 5 EHBDMO Cc1cnc(CC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000179476056 1139759906 /nfs/dbraw/zinc/75/99/06/1139759906.db2.gz YSLOXHBVEYLCJX-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO Cc1cnc(CC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000179476056 1139759911 /nfs/dbraw/zinc/75/99/11/1139759911.db2.gz YSLOXHBVEYLCJX-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000182123004 1139952278 /nfs/dbraw/zinc/95/22/78/1139952278.db2.gz YVHBJBPYNJAJAC-LLVKDONJSA-N 1 1 335.791 3.893 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000182911818 1140000205 /nfs/dbraw/zinc/00/02/05/1140000205.db2.gz DJQBSAGIKSFGQZ-RLFYNMQTSA-N 1 1 328.416 3.744 20 5 EHBDMO CC(C)(C)OCc1cc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])no1 ZINC000186416100 1140202537 /nfs/dbraw/zinc/20/25/37/1140202537.db2.gz XYAGEXVZBFGQOD-SOFGYWHQSA-N 1 1 345.399 3.701 20 5 EHBDMO COCC1=CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000187620597 1140264974 /nfs/dbraw/zinc/26/49/74/1140264974.db2.gz JFEAFHOYFMHGBJ-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000189584391 1140352645 /nfs/dbraw/zinc/35/26/45/1140352645.db2.gz VYCSNSWOBVTEEO-MRXNPFEDSA-N 1 1 346.358 3.746 20 5 EHBDMO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000271665260 1141415448 /nfs/dbraw/zinc/41/54/48/1141415448.db2.gz ZCLBRJODALWYSM-CABCVRRESA-N 1 1 341.411 3.889 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCC[C@@H](C)C1 ZINC000195666957 241032514 /nfs/dbraw/zinc/03/25/14/241032514.db2.gz KYXJZOWUMBHMGD-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1ccc(F)c(F)c1 ZINC000430204946 1014911348 /nfs/dbraw/zinc/91/13/48/1014911348.db2.gz SRHRLYDWMBRMMD-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO CC(=O)Nc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000127058131 1015210203 /nfs/dbraw/zinc/21/02/03/1015210203.db2.gz GLLAIELXYSRBSZ-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000154463885 1015476506 /nfs/dbraw/zinc/47/65/06/1015476506.db2.gz PXMSAYPQZHTCKD-UHFFFAOYSA-N 1 1 330.432 3.839 20 5 EHBDMO COc1cc(C[N@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430282595 1015769445 /nfs/dbraw/zinc/76/94/45/1015769445.db2.gz FXSRBLUQZMKFJI-SNVBAGLBSA-N 1 1 342.342 3.603 20 5 EHBDMO COc1cc(C[N@@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430282595 1015769451 /nfs/dbraw/zinc/76/94/51/1015769451.db2.gz FXSRBLUQZMKFJI-SNVBAGLBSA-N 1 1 342.342 3.603 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000155291502 1016417896 /nfs/dbraw/zinc/41/78/96/1016417896.db2.gz KBVRERDOXBYPDY-SNVBAGLBSA-N 1 1 342.321 3.540 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000155291502 1016417902 /nfs/dbraw/zinc/41/79/02/1016417902.db2.gz KBVRERDOXBYPDY-SNVBAGLBSA-N 1 1 342.321 3.540 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000175716516 1016897626 /nfs/dbraw/zinc/89/76/26/1016897626.db2.gz MRCVOGZYVBWHRL-OAHLLOKOSA-N 1 1 345.443 3.805 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC(C)(C)C1 ZINC000459735211 1032438773 /nfs/dbraw/zinc/43/87/73/1032438773.db2.gz DMBOGYCVDTWJMM-UHFFFAOYSA-N 1 1 329.400 3.913 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000449453418 1032570419 /nfs/dbraw/zinc/57/04/19/1032570419.db2.gz MVZABNRCWVNIBJ-FJTFPGJYSA-N 1 1 330.428 3.624 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680410 1032655987 /nfs/dbraw/zinc/65/59/87/1032655987.db2.gz UYUQMSWONFHLRB-ZIAGYGMSSA-N 1 1 349.431 3.502 20 5 EHBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000593056156 1032687297 /nfs/dbraw/zinc/68/72/97/1032687297.db2.gz ZNPOXONHTCLPFL-QGZVFWFLSA-N 1 1 345.399 3.639 20 5 EHBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000593056156 1032687308 /nfs/dbraw/zinc/68/73/08/1032687308.db2.gz ZNPOXONHTCLPFL-QGZVFWFLSA-N 1 1 345.399 3.639 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000177392072 1017661340 /nfs/dbraw/zinc/66/13/40/1017661340.db2.gz HUSQSINEHIXVCK-OAHLLOKOSA-N 1 1 330.409 3.894 20 5 EHBDMO COc1cc(C[NH+]2CCCC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000101590290 1018371360 /nfs/dbraw/zinc/37/13/60/1018371360.db2.gz GQRYGULEECZISL-UHFFFAOYSA-N 1 1 342.395 3.778 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3[nH]cnc3C2)c2ccccc2)c1 ZINC000377799746 1018394525 /nfs/dbraw/zinc/39/45/25/1018394525.db2.gz YWSRMZCRZGKJLG-JXFKEZNVSA-N 1 1 348.406 3.554 20 5 EHBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)ccc1O ZINC000102175470 1018490111 /nfs/dbraw/zinc/49/01/11/1018490111.db2.gz LWHVDUAROPURGU-UHFFFAOYSA-N 1 1 342.395 3.782 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000545418693 1018534148 /nfs/dbraw/zinc/53/41/48/1018534148.db2.gz PVRXWCUZNLVWMK-ZDUSSCGKSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368003 1018535659 /nfs/dbraw/zinc/53/56/59/1018535659.db2.gz AQKGNPWQJAHLQC-UKRRQHHQSA-N 1 1 326.400 3.634 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000336970637 1018582566 /nfs/dbraw/zinc/58/25/66/1018582566.db2.gz OPXYFUMUXOSQLC-KRWDZBQOSA-N 1 1 339.395 3.761 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000064915940 1018715313 /nfs/dbraw/zinc/71/53/13/1018715313.db2.gz WLQJUULOZPGUBZ-UKRRQHHQSA-N 1 1 329.375 3.981 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000050231545 1019358214 /nfs/dbraw/zinc/35/82/14/1019358214.db2.gz ALOQIYDKRFAQBE-SFHVURJKSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(F)c1)C[C@@H]1CCCO1 ZINC000050231545 1019358234 /nfs/dbraw/zinc/35/82/34/1019358234.db2.gz ALOQIYDKRFAQBE-SFHVURJKSA-N 1 1 344.386 3.915 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182829997 1019758347 /nfs/dbraw/zinc/75/83/47/1019758347.db2.gz HJXJVCGQFUZNQS-KGLIPLIRSA-N 1 1 334.416 3.628 20 5 EHBDMO C[N@@H+](CCOc1ccccc1F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761253619 1032887398 /nfs/dbraw/zinc/88/73/98/1032887398.db2.gz NWIUGIDJIWTLGP-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CC[N@@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000126319639 1020570890 /nfs/dbraw/zinc/57/08/90/1020570890.db2.gz DQOVZSOHHXTUCI-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000360875589 1020846310 /nfs/dbraw/zinc/84/63/10/1020846310.db2.gz XDGKIXCRSZLXRC-YOEHRIQHSA-N 1 1 340.427 3.621 20 5 EHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000510422309 1020867329 /nfs/dbraw/zinc/86/73/29/1020867329.db2.gz SXVOWXNDAGCSFJ-LLVKDONJSA-N 1 1 338.791 3.975 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1c(F)cc([N+](=O)[O-])cc1F ZINC000439129360 1021169437 /nfs/dbraw/zinc/16/94/37/1021169437.db2.gz JTSVAWZPMLJZHX-UHFFFAOYSA-N 1 1 344.321 3.979 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+](C4CC4)CC3)s2)cc1 ZINC000506494842 1021181634 /nfs/dbraw/zinc/18/16/34/1021181634.db2.gz IQIBAEJNMYJCSX-UHFFFAOYSA-N 1 1 343.452 3.603 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000516295011 1021262234 /nfs/dbraw/zinc/26/22/34/1021262234.db2.gz VJEMKBDMTHUEJE-UHFFFAOYSA-N 1 1 344.411 3.893 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000518834870 1021604107 /nfs/dbraw/zinc/60/41/07/1021604107.db2.gz HYYNFMLYSOPLJW-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000518834870 1021604112 /nfs/dbraw/zinc/60/41/12/1021604112.db2.gz HYYNFMLYSOPLJW-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO O[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)CN1CCCC1 ZINC000051188021 1021624906 /nfs/dbraw/zinc/62/49/06/1021624906.db2.gz BLNJQFIGBPZFFT-LJQANCHMSA-N 1 1 334.463 3.539 20 5 EHBDMO O[C@H](CNCc1c2ccccc2cc2ccccc21)C[NH+]1CCCC1 ZINC000051188021 1021624919 /nfs/dbraw/zinc/62/49/19/1021624919.db2.gz BLNJQFIGBPZFFT-LJQANCHMSA-N 1 1 334.463 3.539 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H]4CCC[C@H]43)o2)c1 ZINC000426485342 1021689769 /nfs/dbraw/zinc/68/97/69/1021689769.db2.gz JDJHGYABTPFXGD-CZUORRHYSA-N 1 1 327.384 3.667 20 5 EHBDMO COCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000426540557 1021849137 /nfs/dbraw/zinc/84/91/37/1021849137.db2.gz RWAXLFYGBRAETC-ALCCZGGFSA-N 1 1 347.440 3.522 20 5 EHBDMO COCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000426540557 1021849153 /nfs/dbraw/zinc/84/91/53/1021849153.db2.gz RWAXLFYGBRAETC-ALCCZGGFSA-N 1 1 347.440 3.522 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468234 1033054505 /nfs/dbraw/zinc/05/45/05/1033054505.db2.gz UUHSYJINJVXCEZ-YPMHNXCESA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668128 1033064167 /nfs/dbraw/zinc/06/41/67/1033064167.db2.gz UCMCBYREOSOMFR-HNNXBMFYSA-N 1 1 346.349 3.741 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H](CCO)c3ccco3)o2)cc1 ZINC000184519170 1022574388 /nfs/dbraw/zinc/57/43/88/1022574388.db2.gz MAZUPHGCXBFYHO-MRXNPFEDSA-N 1 1 342.351 3.661 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)[C@H](C)O1 ZINC000438365677 1022594858 /nfs/dbraw/zinc/59/48/58/1022594858.db2.gz CUVSAQUJKCCMJB-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)[C@H](C)O1 ZINC000438365677 1022594866 /nfs/dbraw/zinc/59/48/66/1022594866.db2.gz CUVSAQUJKCCMJB-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)[C@@H](C)O1 ZINC000438365679 1022595876 /nfs/dbraw/zinc/59/58/76/1022595876.db2.gz CUVSAQUJKCCMJB-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)[C@@H](C)O1 ZINC000438365679 1022595886 /nfs/dbraw/zinc/59/58/86/1022595886.db2.gz CUVSAQUJKCCMJB-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3Cc3ccccc3)nc2c1 ZINC000610580807 1022779978 /nfs/dbraw/zinc/77/99/78/1022779978.db2.gz LJZUEXLAKUFOJG-OAHLLOKOSA-N 1 1 337.379 3.943 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000509574105 1023071988 /nfs/dbraw/zinc/07/19/88/1023071988.db2.gz IWPIYYLJBULQKD-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507154995 1023161517 /nfs/dbraw/zinc/16/15/17/1023161517.db2.gz MMNKLIZCAUVSKQ-UHFFFAOYSA-N 1 1 325.412 3.825 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1OCO2 ZINC000507176736 1023163943 /nfs/dbraw/zinc/16/39/43/1023163943.db2.gz ZBTFDXVDAYIYBX-UHFFFAOYSA-N 1 1 328.368 3.734 20 5 EHBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000507176082 1023175904 /nfs/dbraw/zinc/17/59/04/1023175904.db2.gz XGEKPJKEUHEIST-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1ccc(C(=O)C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000054295266 1023219511 /nfs/dbraw/zinc/21/95/11/1023219511.db2.gz SBZVITHXFZVKOM-UHFFFAOYSA-N 1 1 338.407 3.998 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2cc(F)ccc2OC)ccc1[N+](=O)[O-] ZINC000276880981 1023286512 /nfs/dbraw/zinc/28/65/12/1023286512.db2.gz ISZBMEBRGQHHOZ-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000602758788 1033131148 /nfs/dbraw/zinc/13/11/48/1033131148.db2.gz NQUTWOXSYPWKHH-LBPRGKRZSA-N 1 1 328.372 3.539 20 5 EHBDMO CCOc1cc(C[NH2+][C@](C)(CC)c2nccs2)ccc1[N+](=O)[O-] ZINC000276977771 1023524659 /nfs/dbraw/zinc/52/46/59/1023524659.db2.gz XVEHYDRPMQPRBS-MRXNPFEDSA-N 1 1 335.429 3.865 20 5 EHBDMO COC[C@H]1CCCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449760486 1033154124 /nfs/dbraw/zinc/15/41/24/1033154124.db2.gz PAPZCGQTWRXZKC-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO COC[C@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449760486 1033154130 /nfs/dbraw/zinc/15/41/30/1033154130.db2.gz PAPZCGQTWRXZKC-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CC(C4CCC4)C3)cs2)c1 ZINC000520660122 1024372858 /nfs/dbraw/zinc/37/28/58/1024372858.db2.gz FQTHGJLSVSKEGE-UHFFFAOYSA-N 1 1 329.425 3.950 20 5 EHBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)n1 ZINC000091832828 1024388963 /nfs/dbraw/zinc/38/89/63/1024388963.db2.gz AXDSJGADBYJSJJ-OAHLLOKOSA-N 1 1 344.415 3.789 20 5 EHBDMO Cc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000543975442 1024452660 /nfs/dbraw/zinc/45/26/60/1024452660.db2.gz OSPLZUGVRGNHDA-INIZCTEOSA-N 1 1 340.427 3.516 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccco1)C(C)C ZINC000346301073 1024592920 /nfs/dbraw/zinc/59/29/20/1024592920.db2.gz CJKNYBRLYFNEDU-UHFFFAOYSA-N 1 1 345.399 3.735 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605729 1024630248 /nfs/dbraw/zinc/63/02/48/1024630248.db2.gz DIKYQIMJCRIMRE-HIFRSBDPSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605729 1024630257 /nfs/dbraw/zinc/63/02/57/1024630257.db2.gz DIKYQIMJCRIMRE-HIFRSBDPSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505630724 1024699676 /nfs/dbraw/zinc/69/96/76/1024699676.db2.gz DWNSIQTXPLORTO-DZGCQCFKSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505630724 1024699680 /nfs/dbraw/zinc/69/96/80/1024699680.db2.gz DWNSIQTXPLORTO-DZGCQCFKSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425369263 1024887534 /nfs/dbraw/zinc/88/75/34/1024887534.db2.gz ZTDPSTUZWAJXGR-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425369263 1024887556 /nfs/dbraw/zinc/88/75/56/1024887556.db2.gz ZTDPSTUZWAJXGR-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO C[C@@H](c1ccccc1F)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000071952351 1024918250 /nfs/dbraw/zinc/91/82/50/1024918250.db2.gz OSWKJIHLXCOGLM-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310359404 1025131728 /nfs/dbraw/zinc/13/17/28/1025131728.db2.gz JMDZSCXHTSNBFJ-OAHLLOKOSA-N 1 1 329.375 3.668 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2s1 ZINC000511072437 1025245747 /nfs/dbraw/zinc/24/57/47/1025245747.db2.gz KXJOKLGJHQHYCO-UHFFFAOYSA-N 1 1 327.409 3.879 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2s1 ZINC000511072437 1025245755 /nfs/dbraw/zinc/24/57/55/1025245755.db2.gz KXJOKLGJHQHYCO-UHFFFAOYSA-N 1 1 327.409 3.879 20 5 EHBDMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053279181 1025725983 /nfs/dbraw/zinc/72/59/83/1025725983.db2.gz JEPCSVMXSAPOBQ-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053279181 1025725997 /nfs/dbraw/zinc/72/59/97/1025725997.db2.gz JEPCSVMXSAPOBQ-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO C[N@H+](CCSCc1cc(O)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000436474549 1025769731 /nfs/dbraw/zinc/76/97/31/1025769731.db2.gz KELLQAJYUNWBRF-UHFFFAOYSA-N 1 1 332.425 3.666 20 5 EHBDMO C[N@@H+](CCSCc1cc(O)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000436474549 1025769751 /nfs/dbraw/zinc/76/97/51/1025769751.db2.gz KELLQAJYUNWBRF-UHFFFAOYSA-N 1 1 332.425 3.666 20 5 EHBDMO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000120042185 1025771027 /nfs/dbraw/zinc/77/10/27/1025771027.db2.gz RUPMUICBQAFQMT-UHFFFAOYSA-N 1 1 338.367 3.667 20 5 EHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000120042185 1025771043 /nfs/dbraw/zinc/77/10/43/1025771043.db2.gz RUPMUICBQAFQMT-UHFFFAOYSA-N 1 1 338.367 3.667 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2CCSC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000530524381 1025981906 /nfs/dbraw/zinc/98/19/06/1025981906.db2.gz FKTNPMLQNMRWRB-SUMWQHHRSA-N 1 1 332.425 3.935 20 5 EHBDMO CC(=O)c1ccc(NC[C@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000023386311 1025994145 /nfs/dbraw/zinc/99/41/45/1025994145.db2.gz AYIFDILOIOMQJT-QGZVFWFLSA-N 1 1 343.383 3.639 20 5 EHBDMO C[N@H+]1CCC[C@H](c2nc(-c3ccc4ccc5cccnc5c4n3)no2)C1 ZINC001211877473 1026002950 /nfs/dbraw/zinc/00/29/50/1026002950.db2.gz QVKRQNLOQHJVGF-HNNXBMFYSA-N 1 1 345.406 3.642 20 5 EHBDMO CCOc1cccc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000516124723 1026014461 /nfs/dbraw/zinc/01/44/61/1026014461.db2.gz WAQVJFVLUFAXMC-XHSDSOJGSA-N 1 1 347.459 3.835 20 5 EHBDMO CCOc1cccc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000516124722 1026015622 /nfs/dbraw/zinc/01/56/22/1026015622.db2.gz WAQVJFVLUFAXMC-OWCLPIDISA-N 1 1 347.459 3.835 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn4ccsc4n3)C2)cc1 ZINC000451547685 1026098169 /nfs/dbraw/zinc/09/81/69/1026098169.db2.gz LQICWXWESQXGCP-AWEZNQCLSA-N 1 1 342.424 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn4ccsc4n3)C2)cc1 ZINC000451547685 1026098190 /nfs/dbraw/zinc/09/81/90/1026098190.db2.gz LQICWXWESQXGCP-AWEZNQCLSA-N 1 1 342.424 3.684 20 5 EHBDMO CCc1noc(C)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550427 1026102899 /nfs/dbraw/zinc/10/28/99/1026102899.db2.gz RQWHVYXUCHHVBT-HNNXBMFYSA-N 1 1 329.400 3.833 20 5 EHBDMO CCCCc1noc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451566974 1026118681 /nfs/dbraw/zinc/11/86/81/1026118681.db2.gz MXRLNCKGBFVXOP-HNNXBMFYSA-N 1 1 344.415 3.700 20 5 EHBDMO CCCCc1noc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451566974 1026118692 /nfs/dbraw/zinc/11/86/92/1026118692.db2.gz MXRLNCKGBFVXOP-HNNXBMFYSA-N 1 1 344.415 3.700 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611609566 1026315373 /nfs/dbraw/zinc/31/53/73/1026315373.db2.gz PBHDAEGPLBDCEK-ZDUSSCGKSA-N 1 1 328.359 3.922 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611609566 1026315385 /nfs/dbraw/zinc/31/53/85/1026315385.db2.gz PBHDAEGPLBDCEK-ZDUSSCGKSA-N 1 1 328.359 3.922 20 5 EHBDMO CCC[NH+]1CCC(Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000302164782 1026351632 /nfs/dbraw/zinc/35/16/32/1026351632.db2.gz KPXCHZHGCWAQOG-UHFFFAOYSA-N 1 1 328.416 3.738 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)ncn2C ZINC000342619173 1026474487 /nfs/dbraw/zinc/47/44/87/1026474487.db2.gz GTADDJXSXZKCAF-UHFFFAOYSA-N 1 1 338.411 3.892 20 5 EHBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000342786107 1027040601 /nfs/dbraw/zinc/04/06/01/1027040601.db2.gz YMEPPNBKUNRLIO-SECBINFHSA-N 1 1 341.198 3.629 20 5 EHBDMO CC(C)c1ccc(CN[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200570 1027076374 /nfs/dbraw/zinc/07/63/74/1027076374.db2.gz CPVROQRQISIXSF-CVEARBPZSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(C[NH2+][C@@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200570 1027076379 /nfs/dbraw/zinc/07/63/79/1027076379.db2.gz CPVROQRQISIXSF-CVEARBPZSA-N 1 1 333.476 3.928 20 5 EHBDMO CCOc1ccc(OCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501776692 1027529071 /nfs/dbraw/zinc/52/90/71/1027529071.db2.gz NURAJPCTPHWJTO-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000366628408 1027622461 /nfs/dbraw/zinc/62/24/61/1027622461.db2.gz MUBPRHVVQVRQQX-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000366628408 1027622466 /nfs/dbraw/zinc/62/24/66/1027622466.db2.gz MUBPRHVVQVRQQX-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000078336349 1027682285 /nfs/dbraw/zinc/68/22/85/1027682285.db2.gz AKKUQAOQWHSWEE-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000503576729 1027921719 /nfs/dbraw/zinc/92/17/19/1027921719.db2.gz HCAJYPKXDJXXOD-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO C[NH+](C)[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000237173203 1028172574 /nfs/dbraw/zinc/17/25/74/1028172574.db2.gz CMHJXHLFOZAYGL-KRWDZBQOSA-N 1 1 345.468 3.753 20 5 EHBDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369111 1028327752 /nfs/dbraw/zinc/32/77/52/1028327752.db2.gz XVUCUWGEVRCRJP-KBPBESRZSA-N 1 1 346.452 3.774 20 5 EHBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369112 1028330196 /nfs/dbraw/zinc/33/01/96/1028330196.db2.gz XVUCUWGEVRCRJP-KGLIPLIRSA-N 1 1 346.452 3.774 20 5 EHBDMO C[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738972 1028330230 /nfs/dbraw/zinc/33/02/30/1028330230.db2.gz OXPIEQQLWAEQGB-INIZCTEOSA-N 1 1 339.439 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]34CCOC4)s2)cc1 ZINC000421400054 1028347449 /nfs/dbraw/zinc/34/74/49/1028347449.db2.gz QZJQAQUODNXOMI-KRWDZBQOSA-N 1 1 330.409 3.688 20 5 EHBDMO COC(=O)c1cc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])oc1C ZINC000292452231 1028428186 /nfs/dbraw/zinc/42/81/86/1028428186.db2.gz OATIIUDZRBMLHJ-QWRGUYRKSA-N 1 1 332.356 3.695 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342371 1028966826 /nfs/dbraw/zinc/96/68/26/1028966826.db2.gz HCKXIIXTHMNGIN-ZDUSSCGKSA-N 1 1 347.440 3.732 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342371 1028966841 /nfs/dbraw/zinc/96/68/41/1028966841.db2.gz HCKXIIXTHMNGIN-ZDUSSCGKSA-N 1 1 347.440 3.732 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925020 1029110290 /nfs/dbraw/zinc/11/02/90/1029110290.db2.gz RSHIXXWFPALGIU-BXUZGUMPSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925020 1029110301 /nfs/dbraw/zinc/11/03/01/1029110301.db2.gz RSHIXXWFPALGIU-BXUZGUMPSA-N 1 1 332.322 3.699 20 5 EHBDMO COCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000508546395 1029227835 /nfs/dbraw/zinc/22/78/35/1029227835.db2.gz SFKNDULKOOCFFT-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192480561 1029684537 /nfs/dbraw/zinc/68/45/37/1029684537.db2.gz HDPGSRLYTSFHNX-GXTWGEPZSA-N 1 1 332.429 3.516 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192480570 1029684919 /nfs/dbraw/zinc/68/49/19/1029684919.db2.gz HDPGSRLYTSFHNX-OCCSQVGLSA-N 1 1 332.429 3.516 20 5 EHBDMO CCOc1cc(N[C@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536022776 1029819995 /nfs/dbraw/zinc/81/99/95/1029819995.db2.gz JLYMZWOPOWYNAF-INIZCTEOSA-N 1 1 327.384 3.592 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1Cl ZINC000446842604 1029824674 /nfs/dbraw/zinc/82/46/74/1029824674.db2.gz XPMNXWRXDMZXFE-UHFFFAOYSA-N 1 1 330.775 3.723 20 5 EHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407735 1029839421 /nfs/dbraw/zinc/83/94/21/1029839421.db2.gz HLAMISMXLMIVHU-HUUCEWRRSA-N 1 1 326.824 3.884 20 5 EHBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000531868640 1029942723 /nfs/dbraw/zinc/94/27/23/1029942723.db2.gz SESRZOQVTBCNDA-AWEZNQCLSA-N 1 1 334.416 3.539 20 5 EHBDMO CCC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000508586578 1029963817 /nfs/dbraw/zinc/96/38/17/1029963817.db2.gz ICLGPABSIAWHEY-UHFFFAOYSA-N 1 1 330.432 3.863 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNCCC[NH+]2CCCC2)s1 ZINC000237954185 1030139836 /nfs/dbraw/zinc/13/98/36/1030139836.db2.gz DYJFPOGISSCJKC-UHFFFAOYSA-N 1 1 345.468 3.899 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587022 1030321519 /nfs/dbraw/zinc/32/15/19/1030321519.db2.gz PWWBJURSHFAEKY-JXFKEZNVSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587022 1030321537 /nfs/dbraw/zinc/32/15/37/1030321537.db2.gz PWWBJURSHFAEKY-JXFKEZNVSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447836903 1030528645 /nfs/dbraw/zinc/52/86/45/1030528645.db2.gz YOVHCEZXVBRMQT-ZBFHGGJFSA-N 1 1 336.432 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnn2-c2ccccc2)c(Cl)c1 ZINC000447898168 1030577203 /nfs/dbraw/zinc/57/72/03/1030577203.db2.gz SIOIOTAQWCJIGO-UHFFFAOYSA-N 1 1 342.786 3.724 20 5 EHBDMO C[N@@H+](Cc1c2ccccc2cc2ccccc21)[C@@H]1CCS(=O)(=O)C1 ZINC000157606994 1030667558 /nfs/dbraw/zinc/66/75/58/1030667558.db2.gz QGZBUYVUAYAOIH-QGZVFWFLSA-N 1 1 339.460 3.612 20 5 EHBDMO C[C@@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@H+]1C ZINC000343436006 1030867464 /nfs/dbraw/zinc/86/74/64/1030867464.db2.gz LJGSGCBFLROKBB-KUHUBIRLSA-N 1 1 333.435 3.601 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026194045 1030926665 /nfs/dbraw/zinc/92/66/65/1030926665.db2.gz UVVXJPRAUBQADY-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026194045 1030926683 /nfs/dbraw/zinc/92/66/83/1030926683.db2.gz UVVXJPRAUBQADY-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1ccc(-c2noc([C@H]3CC[N@@H+]3C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000923819934 1031272098 /nfs/dbraw/zinc/27/20/98/1031272098.db2.gz GTDLPLMMULIAST-CQSZACIVSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1ccc(-c2noc([C@H]3CC[N@H+]3C3CCCC3)n2)cc1[N+](=O)[O-] ZINC000923819934 1031272105 /nfs/dbraw/zinc/27/21/05/1031272105.db2.gz GTDLPLMMULIAST-CQSZACIVSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC12CCCCC2 ZINC000536176285 1031292176 /nfs/dbraw/zinc/29/21/76/1031292176.db2.gz FMQVRAQNPXBNTB-UHFFFAOYSA-N 1 1 331.416 3.640 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000111171368 1031753817 /nfs/dbraw/zinc/75/38/17/1031753817.db2.gz SLBUOSIAZLSPDF-CQSZACIVSA-N 1 1 334.807 3.509 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485910 1033366955 /nfs/dbraw/zinc/36/69/55/1033366955.db2.gz TZRWEYUWGDVNRN-DZGCQCFKSA-N 1 1 334.445 3.508 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580858 1033571404 /nfs/dbraw/zinc/57/14/04/1033571404.db2.gz XCLZTCPNWBWQJB-ZFWWWQNUSA-N 1 1 331.441 3.836 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2c(C(F)(F)F)cnn2C)cc1[N+](=O)[O-] ZINC000594940612 1033588013 /nfs/dbraw/zinc/58/80/13/1033588013.db2.gz PDIHFAISZDWDII-SNVBAGLBSA-N 1 1 342.321 3.506 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994320 1033648035 /nfs/dbraw/zinc/64/80/35/1033648035.db2.gz JUNTYYGIAQVNRF-HNNXBMFYSA-N 1 1 343.427 3.676 20 5 EHBDMO CC(=O)c1cc(NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125693 1033745215 /nfs/dbraw/zinc/74/52/15/1033745215.db2.gz AKAOUAKENKXAMB-MRXNPFEDSA-N 1 1 331.416 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)cc1OC(F)F ZINC000599164756 1033779694 /nfs/dbraw/zinc/77/96/94/1033779694.db2.gz LTRBRXPCFGIXAE-CYBMUJFWSA-N 1 1 341.358 3.625 20 5 EHBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670817 1033944026 /nfs/dbraw/zinc/94/40/26/1033944026.db2.gz DNPVLWXDCHTWLD-XHDPSFHLSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1noc(C[N@@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000599516073 1033977494 /nfs/dbraw/zinc/97/74/94/1033977494.db2.gz MEMAFYZYCXREQM-GFCCVEGCSA-N 1 1 337.326 3.549 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000599516073 1033977502 /nfs/dbraw/zinc/97/75/02/1033977502.db2.gz MEMAFYZYCXREQM-GFCCVEGCSA-N 1 1 337.326 3.549 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]([C@H]4CCCCO4)C3)nc2c1 ZINC000595788873 1034000324 /nfs/dbraw/zinc/00/03/24/1034000324.db2.gz KLCBQPZGWDYROW-XJKSGUPXSA-N 1 1 345.399 3.517 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856400 1034009545 /nfs/dbraw/zinc/00/95/45/1034009545.db2.gz BWGNLJJOSXVNAC-ARQBPDDDSA-N 1 1 342.399 3.969 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000603895544 1034016206 /nfs/dbraw/zinc/01/62/06/1034016206.db2.gz ODJNRUGVBQZHEZ-UHFFFAOYSA-N 1 1 345.443 3.885 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000059893811 1034042619 /nfs/dbraw/zinc/04/26/19/1034042619.db2.gz HHKLEMYEGIUAQN-LLVKDONJSA-N 1 1 331.338 3.756 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCc2ccccc2-n2ccnc21 ZINC000596063750 1034067184 /nfs/dbraw/zinc/06/71/84/1034067184.db2.gz SCDWUQWEUPMKKO-SFHVURJKSA-N 1 1 348.406 3.866 20 5 EHBDMO C[N@H+](Cc1ccc(OCC(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315272 1034107320 /nfs/dbraw/zinc/10/73/20/1034107320.db2.gz JTOOXHJCHBZMRC-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO C[N@@H+](Cc1ccc(OCC(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315272 1034107336 /nfs/dbraw/zinc/10/73/36/1034107336.db2.gz JTOOXHJCHBZMRC-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000450320755 1034126702 /nfs/dbraw/zinc/12/67/02/1034126702.db2.gz XJYPBXCJGOMGCA-CYBMUJFWSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ccncc21 ZINC000596570700 1034293671 /nfs/dbraw/zinc/29/36/71/1034293671.db2.gz MVZYZOVLKBQQHG-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO CC1(C)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000596591118 1034307524 /nfs/dbraw/zinc/30/75/24/1034307524.db2.gz GRSPEXQDPKVTJR-GOSISDBHSA-N 1 1 341.411 3.842 20 5 EHBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000596591118 1034307537 /nfs/dbraw/zinc/30/75/37/1034307537.db2.gz GRSPEXQDPKVTJR-GOSISDBHSA-N 1 1 341.411 3.842 20 5 EHBDMO Cc1ccc(CNCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604417942 1034371891 /nfs/dbraw/zinc/37/18/91/1034371891.db2.gz SUAASUWSEFVDLY-GASCZTMLSA-N 1 1 333.476 3.749 20 5 EHBDMO Cc1ccc(C[NH2+]CC(C)(C)N2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604417942 1034371924 /nfs/dbraw/zinc/37/19/24/1034371924.db2.gz SUAASUWSEFVDLY-GASCZTMLSA-N 1 1 333.476 3.749 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435880 1034379410 /nfs/dbraw/zinc/37/94/10/1034379410.db2.gz CJFQXNNXBGLRGE-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000179617121 1034515067 /nfs/dbraw/zinc/51/50/67/1034515067.db2.gz LAEVDABDHGYTLP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000179617121 1034515077 /nfs/dbraw/zinc/51/50/77/1034515077.db2.gz LAEVDABDHGYTLP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO CCc1cc(CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000450604874 1034556114 /nfs/dbraw/zinc/55/61/14/1034556114.db2.gz XYUXRDIEDGPHBP-UHFFFAOYSA-N 1 1 329.400 3.742 20 5 EHBDMO CCCn1nccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597136937 1034556593 /nfs/dbraw/zinc/55/65/93/1034556593.db2.gz CNYIDHGRZKQWAZ-INIZCTEOSA-N 1 1 328.416 3.581 20 5 EHBDMO Cn1ncc(C2CC2)c1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137898 1034560314 /nfs/dbraw/zinc/56/03/14/1034560314.db2.gz HOZDSUXCOVVDTL-MRXNPFEDSA-N 1 1 340.427 3.585 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)[C@H]1O ZINC000597207651 1034591107 /nfs/dbraw/zinc/59/11/07/1034591107.db2.gz ZUQOUALIVUGADK-MCBXIFIFSA-N 1 1 346.452 3.772 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+](CC2CC2)C2CCC2)c1 ZINC000475667915 1034626044 /nfs/dbraw/zinc/62/60/44/1034626044.db2.gz HXVGRFJCASVITC-UHFFFAOYSA-N 1 1 326.343 3.961 20 5 EHBDMO Cc1cccc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000614977218 1034741705 /nfs/dbraw/zinc/74/17/05/1034741705.db2.gz GFYDJQFAYYLAJK-KRWDZBQOSA-N 1 1 325.412 3.614 20 5 EHBDMO COc1cncc(/C=C\CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000563061169 1035022440 /nfs/dbraw/zinc/02/24/40/1035022440.db2.gz ZKCWNQNTTDOJJZ-ALCCZGGFSA-N 1 1 327.384 3.534 20 5 EHBDMO CCN(CC)c1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000892569762 1036179073 /nfs/dbraw/zinc/17/90/73/1036179073.db2.gz CAWOAYRAUFKEPO-UHFFFAOYSA-N 1 1 348.834 3.779 20 5 EHBDMO Cc1c(C[NH2+]Cc2cnc(C(F)(F)F)s2)cccc1[N+](=O)[O-] ZINC000444003555 1036265833 /nfs/dbraw/zinc/26/58/33/1036265833.db2.gz SUXXRGRJWLHBOB-UHFFFAOYSA-N 1 1 331.319 3.668 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)Cc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000541764703 1036624923 /nfs/dbraw/zinc/62/49/23/1036624923.db2.gz NZNWODOZNCJKSG-UHFFFAOYSA-N 1 1 349.818 3.901 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000464677510 1036651264 /nfs/dbraw/zinc/65/12/64/1036651264.db2.gz AJIDQUASADDTLB-HNNXBMFYSA-N 1 1 330.359 3.560 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000464677510 1036651278 /nfs/dbraw/zinc/65/12/78/1036651278.db2.gz AJIDQUASADDTLB-HNNXBMFYSA-N 1 1 330.359 3.560 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647941 1036660936 /nfs/dbraw/zinc/66/09/36/1036660936.db2.gz NOKSMWBHBKJRLS-UONOGXRCSA-N 1 1 349.431 3.502 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000464774910 1036764707 /nfs/dbraw/zinc/76/47/07/1036764707.db2.gz LPKBJSMZQDEVLM-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000609144354 1037059477 /nfs/dbraw/zinc/05/94/77/1037059477.db2.gz PUWHTNCMZDAVRD-HNNXBMFYSA-N 1 1 344.386 3.950 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000173895181 1037070017 /nfs/dbraw/zinc/07/00/17/1037070017.db2.gz CBFNYVDKCTXXDZ-XNJGSVPQSA-N 1 1 332.400 3.614 20 5 EHBDMO C[N@@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000539851788 1037280536 /nfs/dbraw/zinc/28/05/36/1037280536.db2.gz BJWYTYIOHXZBGK-UHFFFAOYSA-N 1 1 342.367 3.932 20 5 EHBDMO COC(=O)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000271796871 1037292710 /nfs/dbraw/zinc/29/27/10/1037292710.db2.gz OOOQZMUSQBEPJS-NWDGAFQWSA-N 1 1 332.356 3.695 20 5 EHBDMO COC(=O)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000271796874 1037303311 /nfs/dbraw/zinc/30/33/11/1037303311.db2.gz OOOQZMUSQBEPJS-RYUDHWBXSA-N 1 1 332.356 3.695 20 5 EHBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]2CCCC[C@H]12 ZINC000130174375 1037309073 /nfs/dbraw/zinc/30/90/73/1037309073.db2.gz PTDGJHFGABFONN-MRRJBJDNSA-N 1 1 349.406 3.573 20 5 EHBDMO Cc1cc2ncc([C@H](C)[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])c(C)n2n1 ZINC000271834733 1037428913 /nfs/dbraw/zinc/42/89/13/1037428913.db2.gz VALVTDXIFSZFNC-OLZOCXBDSA-N 1 1 339.399 3.666 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC(C)(C)[NH+]1CCCCC1 ZINC000468638904 1037602481 /nfs/dbraw/zinc/60/24/81/1037602481.db2.gz CSASZBUGIGLMQI-FOWTUZBSSA-N 1 1 331.460 3.852 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1)CC(C)C ZINC000540207430 1037710514 /nfs/dbraw/zinc/71/05/14/1037710514.db2.gz VUPYDOBIQXEAQO-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO Cc1ccc(CN2CC[NH+]([C@@H](C)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000463055553 1037724033 /nfs/dbraw/zinc/72/40/33/1037724033.db2.gz TXVISLJKGASQRQ-HNNXBMFYSA-N 1 1 345.468 3.844 20 5 EHBDMO Cc1cc(N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000463068806 1037731427 /nfs/dbraw/zinc/73/14/27/1037731427.db2.gz MRZCKULQHKTOKL-GOSISDBHSA-N 1 1 339.439 3.862 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2cccc3[nH]ccc32)c([N+](=O)[O-])cc1F ZINC000494076430 1037823788 /nfs/dbraw/zinc/82/37/88/1037823788.db2.gz ANKZPWIOMPZCEA-UHFFFAOYSA-N 1 1 343.358 3.856 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cccc3[nH]ccc32)c([N+](=O)[O-])cc1F ZINC000494076430 1037823814 /nfs/dbraw/zinc/82/38/14/1037823814.db2.gz ANKZPWIOMPZCEA-UHFFFAOYSA-N 1 1 343.358 3.856 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](O)[C@H]2CCc2ccccc2)cs1 ZINC000592165649 1037909757 /nfs/dbraw/zinc/90/97/57/1037909757.db2.gz DIOPGRXXXQOAPK-IAGOWNOFSA-N 1 1 346.452 3.614 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000051254765 1037957868 /nfs/dbraw/zinc/95/78/68/1037957868.db2.gz UYAWLQAVJLUKTR-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072578046 1038160254 /nfs/dbraw/zinc/16/02/54/1038160254.db2.gz ALQNHHWHRQAAGQ-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072578046 1038160262 /nfs/dbraw/zinc/16/02/62/1038160262.db2.gz ALQNHHWHRQAAGQ-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO C/C(=C\c1ccccc1)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737317 1038501284 /nfs/dbraw/zinc/50/12/84/1038501284.db2.gz VVQCPKXQVUSWFV-GSPCDJLXSA-N 1 1 338.411 3.580 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000549426304 1038569365 /nfs/dbraw/zinc/56/93/65/1038569365.db2.gz YXTDBIJUXJUGSG-UHFFFAOYSA-N 1 1 348.443 3.847 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccncc1F ZINC000339172385 1038617026 /nfs/dbraw/zinc/61/70/26/1038617026.db2.gz QXHUGOYAOPWXNH-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1C ZINC000539380111 1038871539 /nfs/dbraw/zinc/87/15/39/1038871539.db2.gz GSARSZFONUJCRV-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000432792486 1039201073 /nfs/dbraw/zinc/20/10/73/1039201073.db2.gz KSSZKMMHOLJZOM-GDNBJRDFSA-N 1 1 340.427 3.663 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000432792486 1039201090 /nfs/dbraw/zinc/20/10/90/1039201090.db2.gz KSSZKMMHOLJZOM-GDNBJRDFSA-N 1 1 340.427 3.663 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668096 1039386576 /nfs/dbraw/zinc/38/65/76/1039386576.db2.gz ICUGJSLWRZBFEK-SWLSCSKDSA-N 1 1 346.818 3.891 20 5 EHBDMO Cc1cc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)ccc1[N+](=O)[O-] ZINC000500757933 1039401920 /nfs/dbraw/zinc/40/19/20/1039401920.db2.gz KFFLGSXWDVUYCT-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489101300 1039621104 /nfs/dbraw/zinc/62/11/04/1039621104.db2.gz GISJMASOARRXLT-OAHLLOKOSA-N 1 1 330.359 3.732 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000573743499 1040214015 /nfs/dbraw/zinc/21/40/15/1040214015.db2.gz RWAAOXDXGAXCFV-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO COc1cc(C[N@@H+](C)C2(C)CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000489879728 1040219948 /nfs/dbraw/zinc/21/99/48/1040219948.db2.gz FLZGECCNJDZSIJ-UHFFFAOYSA-N 1 1 344.358 3.969 20 5 EHBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051139 1040563636 /nfs/dbraw/zinc/56/36/36/1040563636.db2.gz GLUQZTUZOLYFQO-GUYCJALGSA-N 1 1 328.416 3.616 20 5 EHBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051138 1040563956 /nfs/dbraw/zinc/56/39/56/1040563956.db2.gz GLUQZTUZOLYFQO-DYVFJYSZSA-N 1 1 328.416 3.616 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600213370 1040850847 /nfs/dbraw/zinc/85/08/47/1040850847.db2.gz CSVDCTNAEJCRGZ-OAHLLOKOSA-N 1 1 342.395 3.689 20 5 EHBDMO COC(=O)c1cc([C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178860 1041010179 /nfs/dbraw/zinc/01/01/79/1041010179.db2.gz CQORMHLEDGYOHQ-LBPRGKRZSA-N 1 1 346.383 3.518 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2[nH]c(=O)oc2c1 ZINC000586793466 1041028946 /nfs/dbraw/zinc/02/89/46/1041028946.db2.gz GKNHXGRGVASKNL-VIFPVBQESA-N 1 1 347.758 3.946 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000555721204 1041059301 /nfs/dbraw/zinc/05/93/01/1041059301.db2.gz IRYKRCZGHRZCSG-DOTOQJQBSA-N 1 1 345.443 3.742 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253532 1042254068 /nfs/dbraw/zinc/25/40/68/1042254068.db2.gz HIZJUVAOCIPLJF-QWRGUYRKSA-N 1 1 327.812 3.553 20 5 EHBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC(C)(C)O ZINC000093414644 1042296832 /nfs/dbraw/zinc/29/68/32/1042296832.db2.gz LEKZPEHUGHUNRT-UHFFFAOYSA-N 1 1 348.374 3.729 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000112658927 1042416576 /nfs/dbraw/zinc/41/65/76/1042416576.db2.gz HXZYOALUNSERSP-IBGZPJMESA-N 1 1 328.412 3.614 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCCCC[C@H]2CCO)o1 ZINC000585767851 1043029910 /nfs/dbraw/zinc/02/99/10/1043029910.db2.gz MVELHMATGVSUSW-HNNXBMFYSA-N 1 1 344.411 3.982 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]C2CCN(C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003348 1043165720 /nfs/dbraw/zinc/16/57/20/1043165720.db2.gz GASXFJKXRMYIPJ-LJQANCHMSA-N 1 1 343.471 3.924 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(N3CCCC3)c2)c(Cl)c1 ZINC000344120115 1043290542 /nfs/dbraw/zinc/29/05/42/1043290542.db2.gz CWXIMESBLHAPKB-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764283771 1127473370 /nfs/dbraw/zinc/47/33/70/1127473370.db2.gz SKDKRSHBQKCVCY-LLVKDONJSA-N 1 1 327.812 3.555 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764943314 1127552346 /nfs/dbraw/zinc/55/23/46/1127552346.db2.gz DOSJENUSAGJBKX-UHFFFAOYSA-N 1 1 344.440 3.837 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)c2ncccc12 ZINC000301477505 1128468164 /nfs/dbraw/zinc/46/81/64/1128468164.db2.gz UDUIVPLUKLTBNS-HNNXBMFYSA-N 1 1 340.427 3.819 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000301479811 1128468728 /nfs/dbraw/zinc/46/87/28/1128468728.db2.gz NQIWRUHVONMVPK-INIZCTEOSA-N 1 1 341.411 3.680 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000715651299 1128655830 /nfs/dbraw/zinc/65/58/30/1128655830.db2.gz VYZCAAKJODHLGT-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO Cc1cc[nH+]c(N2CCN(c3cc(C)c([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000301657604 1128850279 /nfs/dbraw/zinc/85/02/79/1128850279.db2.gz BJLYNYOOANBJQO-UHFFFAOYSA-N 1 1 346.818 3.587 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673402 1128899390 /nfs/dbraw/zinc/89/93/90/1128899390.db2.gz RJWAONUPVYSHLT-PBHICJAKSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1ccc(C[NH2+][C@H](CN(C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938856 1128905344 /nfs/dbraw/zinc/90/53/44/1128905344.db2.gz YPVLMEHAQIKDBJ-QGZVFWFLSA-N 1 1 347.846 3.949 20 5 EHBDMO CC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000915220022 1121255614 /nfs/dbraw/zinc/25/56/14/1121255614.db2.gz KTJMERZETVNBJG-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000915220022 1121255620 /nfs/dbraw/zinc/25/56/20/1121255620.db2.gz KTJMERZETVNBJG-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC000762632413 1121389048 /nfs/dbraw/zinc/38/90/48/1121389048.db2.gz ISOBYQUINFZCMX-RBUKOAKNSA-N 1 1 326.396 3.855 20 5 EHBDMO COCc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000154283204 1121523018 /nfs/dbraw/zinc/52/30/18/1121523018.db2.gz SEDFZKPYKYELIB-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000122815809 1121952743 /nfs/dbraw/zinc/95/27/43/1121952743.db2.gz HDACOZCUGZSWIM-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000122815809 1121952749 /nfs/dbraw/zinc/95/27/49/1121952749.db2.gz HDACOZCUGZSWIM-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151320 1122081324 /nfs/dbraw/zinc/08/13/24/1122081324.db2.gz FMJMCTOXEQPZBL-KGLIPLIRSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151320 1122081330 /nfs/dbraw/zinc/08/13/30/1122081330.db2.gz FMJMCTOXEQPZBL-KGLIPLIRSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301754813 1129035935 /nfs/dbraw/zinc/03/59/35/1129035935.db2.gz WYVVFEQLTMGLTR-LBPRGKRZSA-N 1 1 326.828 3.710 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301754812 1129036159 /nfs/dbraw/zinc/03/61/59/1129036159.db2.gz WYVVFEQLTMGLTR-GFCCVEGCSA-N 1 1 326.828 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775456 1129058996 /nfs/dbraw/zinc/05/89/96/1129058996.db2.gz LCIRCOFLJCIHFP-LRDDRELGSA-N 1 1 335.835 3.701 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154339444 1122564678 /nfs/dbraw/zinc/56/46/78/1122564678.db2.gz XMVIHCHCPFVECL-VPWXQRGCSA-N 1 1 340.423 3.815 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCO3)o2)cc1 ZINC000556620409 1123063375 /nfs/dbraw/zinc/06/33/75/1123063375.db2.gz ZXHACWCQRLSJRR-IEBWSBKVSA-N 1 1 342.395 3.998 20 5 EHBDMO C[C@H](C[NH+]1CCCCC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000237662265 1123806304 /nfs/dbraw/zinc/80/63/04/1123806304.db2.gz OBUVTBALGBXWEJ-OAHLLOKOSA-N 1 1 343.427 3.819 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000615835122 1123884225 /nfs/dbraw/zinc/88/42/25/1123884225.db2.gz PURRORKVIFRPAP-PMXLPMHFSA-N 1 1 340.427 3.741 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836012 1123884385 /nfs/dbraw/zinc/88/43/85/1123884385.db2.gz HCDDJXOIXIMFDU-DKGMDFAASA-N 1 1 326.400 3.601 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000615836101 1123885401 /nfs/dbraw/zinc/88/54/01/1123885401.db2.gz RUKGBZQQDZSVIL-PTNGSMBKSA-N 1 1 338.407 3.805 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@@H](c2ccccc2)N2CCCC2)cs1 ZINC000237974937 1123935212 /nfs/dbraw/zinc/93/52/12/1123935212.db2.gz NLGUNPCOAXWGBS-INIZCTEOSA-N 1 1 331.441 3.583 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216828 1124100343 /nfs/dbraw/zinc/10/03/43/1124100343.db2.gz ZQJWZVYOHHMWIH-WBVHZDCISA-N 1 1 348.443 3.632 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000619531679 1125358632 /nfs/dbraw/zinc/35/86/32/1125358632.db2.gz RGBZNEDSPGCGIO-QGZVFWFLSA-N 1 1 328.368 3.646 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000619531963 1125358713 /nfs/dbraw/zinc/35/87/13/1125358713.db2.gz KFFPWHWIKBQUAP-CMPLNLGQSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000619531963 1125358714 /nfs/dbraw/zinc/35/87/14/1125358714.db2.gz KFFPWHWIKBQUAP-CMPLNLGQSA-N 1 1 332.322 3.766 20 5 EHBDMO CC(C)Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000183063027 1125428845 /nfs/dbraw/zinc/42/88/45/1125428845.db2.gz QIVXYCSSMUMUFJ-UHFFFAOYSA-N 1 1 330.432 3.858 20 5 EHBDMO CC(C)Cn1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000183062765 1125428900 /nfs/dbraw/zinc/42/89/00/1125428900.db2.gz OHARKWZDVDFGJV-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO CC(C)Cn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000183062765 1125428901 /nfs/dbraw/zinc/42/89/01/1125428901.db2.gz OHARKWZDVDFGJV-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO O=[N+]([O-])c1ccsc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000301974145 1129465986 /nfs/dbraw/zinc/46/59/86/1129465986.db2.gz AQQSMGRLXWMAKT-UHFFFAOYSA-N 1 1 335.404 3.872 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000154455696 1129559761 /nfs/dbraw/zinc/55/97/61/1129559761.db2.gz SPRZGUPBLQGVDQ-QGZVFWFLSA-N 1 1 330.384 3.590 20 5 EHBDMO Cn1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093441805 1129588134 /nfs/dbraw/zinc/58/81/34/1129588134.db2.gz LPKRGWQEWVZCLE-IYBDPMFKSA-N 1 1 340.427 3.617 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000125585486 1129704491 /nfs/dbraw/zinc/70/44/91/1129704491.db2.gz OFQJYBUICAWKRG-UHFFFAOYSA-N 1 1 348.443 3.917 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000302027467 1129764212 /nfs/dbraw/zinc/76/42/12/1129764212.db2.gz QWDHZPCKWBZPBO-CQSZACIVSA-N 1 1 328.416 3.595 20 5 EHBDMO CCOC(=O)CC[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044545 1129796916 /nfs/dbraw/zinc/79/69/16/1129796916.db2.gz CNUYOTNLQMSFMT-LSDHHAIUSA-N 1 1 334.416 3.711 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000227695577 1129917595 /nfs/dbraw/zinc/91/75/95/1129917595.db2.gz WJPWEVOCOHKVPV-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000227695577 1129917598 /nfs/dbraw/zinc/91/75/98/1129917598.db2.gz WJPWEVOCOHKVPV-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO COc1cccc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000355408452 1129950791 /nfs/dbraw/zinc/95/07/91/1129950791.db2.gz BJYGBUWTZIKBRN-AWEZNQCLSA-N 1 1 329.400 3.536 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000245527507 1130230624 /nfs/dbraw/zinc/23/06/24/1130230624.db2.gz PWMXJYPBBDBJTG-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000245527507 1130230630 /nfs/dbraw/zinc/23/06/30/1130230630.db2.gz PWMXJYPBBDBJTG-LFPIHBKWSA-N 1 1 346.452 3.834 20 5 EHBDMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246107123 1130344419 /nfs/dbraw/zinc/34/44/19/1130344419.db2.gz DJEJMQDPYMIZCT-WBVHZDCISA-N 1 1 326.400 3.627 20 5 EHBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000733301264 1131018806 /nfs/dbraw/zinc/01/88/06/1131018806.db2.gz ZFJJMOFIQCMGBT-UHFFFAOYSA-N 1 1 344.802 3.730 20 5 EHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146882 1131691293 /nfs/dbraw/zinc/69/12/93/1131691293.db2.gz QUTPUKJPDRUQSA-OAHLLOKOSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013792 1131936207 /nfs/dbraw/zinc/93/62/07/1131936207.db2.gz FXUFAQPXBPSZKY-GFCCVEGCSA-N 1 1 339.386 3.716 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC3(CCCC3)C2)c1F ZINC001173188472 1131993853 /nfs/dbraw/zinc/99/38/53/1131993853.db2.gz FOUJUQWVBKJNIS-ZDUSSCGKSA-N 1 1 336.407 3.940 20 5 EHBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184465 1131994155 /nfs/dbraw/zinc/99/41/55/1131994155.db2.gz NLNGUFBXLZLSFZ-ZDUSSCGKSA-N 1 1 347.390 3.591 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001173238451 1132027944 /nfs/dbraw/zinc/02/79/44/1132027944.db2.gz SRZKTLDQYUELGT-LBPRGKRZSA-N 1 1 332.350 3.862 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC001169604455 1132793118 /nfs/dbraw/zinc/79/31/18/1132793118.db2.gz MJSRNRVGEMEJCU-CQSZACIVSA-N 1 1 334.441 3.988 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177294667 1133047485 /nfs/dbraw/zinc/04/74/85/1133047485.db2.gz ONJUDYXXJUPIEV-NCSNTAPHSA-N 1 1 345.487 3.956 20 5 EHBDMO NC(=O)[C@@H]1CC[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000768138671 1133101622 /nfs/dbraw/zinc/10/16/22/1133101622.db2.gz QAXZFORQVFKEQN-CYBMUJFWSA-N 1 1 338.838 3.954 20 5 EHBDMO CC(C)(C)[N@@H+]1CC[C@@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142760 1133228957 /nfs/dbraw/zinc/22/89/57/1133228957.db2.gz MNGINLRZARKVOR-MRXNPFEDSA-N 1 1 343.427 3.817 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142760 1133228962 /nfs/dbraw/zinc/22/89/62/1133228962.db2.gz MNGINLRZARKVOR-MRXNPFEDSA-N 1 1 343.427 3.817 20 5 EHBDMO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000769483968 1133289057 /nfs/dbraw/zinc/28/90/57/1133289057.db2.gz QQJFNTVGECPOTR-LJQANCHMSA-N 1 1 328.412 3.767 20 5 EHBDMO C[C@H]1COCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000769457802 1133294782 /nfs/dbraw/zinc/29/47/82/1133294782.db2.gz UTNJBYLGSWQLSL-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000770666410 1133456799 /nfs/dbraw/zinc/45/67/99/1133456799.db2.gz VRDMCBZDTJAZOP-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000770666410 1133456805 /nfs/dbraw/zinc/45/68/05/1133456805.db2.gz VRDMCBZDTJAZOP-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1(C)C ZINC001183135639 1133774318 /nfs/dbraw/zinc/77/43/18/1133774318.db2.gz CXHDJKQQYLLLAT-UHFFFAOYSA-N 1 1 345.365 3.530 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000786880481 1133922991 /nfs/dbraw/zinc/92/29/91/1133922991.db2.gz QSCMDQWVTXCZKY-KBXCAEBGSA-N 1 1 346.427 3.914 20 5 EHBDMO Cc1cc(N2CC[NH+](Cc3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC001185708598 1134127876 /nfs/dbraw/zinc/12/78/76/1134127876.db2.gz RGIOTXAEHPNNDV-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO COc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000788479588 1134130614 /nfs/dbraw/zinc/13/06/14/1134130614.db2.gz WSZVKVMAGBYUBY-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000788479588 1134130617 /nfs/dbraw/zinc/13/06/17/1134130617.db2.gz WSZVKVMAGBYUBY-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO CC[C@@H]1CN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001186070004 1134164444 /nfs/dbraw/zinc/16/44/44/1134164444.db2.gz MEBJYLAZTLMMTA-OAHLLOKOSA-N 1 1 331.441 3.757 20 5 EHBDMO CC(C)C[N@@H+](C)CCCNc1c(Br)cccc1[N+](=O)[O-] ZINC001186913269 1134273770 /nfs/dbraw/zinc/27/37/70/1134273770.db2.gz ADXJTRASWLTLGS-UHFFFAOYSA-N 1 1 344.253 3.747 20 5 EHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000775120783 1134336697 /nfs/dbraw/zinc/33/66/97/1134336697.db2.gz XYBHPRVKYSVXMX-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO Cc1ccc(C)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000775120783 1134336704 /nfs/dbraw/zinc/33/67/04/1134336704.db2.gz XYBHPRVKYSVXMX-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO CC1(C)CC[N@@H+](CCNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC001187861553 1134391610 /nfs/dbraw/zinc/39/16/10/1134391610.db2.gz KOISBWMJMLGZGX-UHFFFAOYSA-N 1 1 342.237 3.501 20 5 EHBDMO Cn1c2ccc(F)cc2[nH+]c1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000775159450 1134418949 /nfs/dbraw/zinc/41/89/49/1134418949.db2.gz QCUWLJFXFOFYQE-UHFFFAOYSA-N 1 1 334.738 3.886 20 5 EHBDMO C[C@@H]1CCSCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000790480936 1134423488 /nfs/dbraw/zinc/42/34/88/1134423488.db2.gz NTFRFMWAZKTTSW-SNVBAGLBSA-N 1 1 339.442 3.657 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000790480936 1134423490 /nfs/dbraw/zinc/42/34/90/1134423490.db2.gz NTFRFMWAZKTTSW-SNVBAGLBSA-N 1 1 339.442 3.657 20 5 EHBDMO CC[C@@]1(C)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001191212910 1134817886 /nfs/dbraw/zinc/81/78/86/1134817886.db2.gz DZHNVJNJQDROJX-INIZCTEOSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001191212910 1134817893 /nfs/dbraw/zinc/81/78/93/1134817893.db2.gz DZHNVJNJQDROJX-INIZCTEOSA-N 1 1 339.823 3.699 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](C)[C@H]1c1ccc(C)cc1 ZINC001191184188 1134821274 /nfs/dbraw/zinc/82/12/74/1134821274.db2.gz VEFYAGDIAVMLPU-KXBFYZLASA-N 1 1 342.443 3.881 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cccnc2F)o1 ZINC000793281963 1134900999 /nfs/dbraw/zinc/90/09/99/1134900999.db2.gz SUJLOYQWCOZPLY-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO Cc1ccc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504170 1135093467 /nfs/dbraw/zinc/09/34/67/1135093467.db2.gz NMBHZFQLZVWSGQ-QWRGUYRKSA-N 1 1 342.237 3.560 20 5 EHBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001193119686 1135104765 /nfs/dbraw/zinc/10/47/65/1135104765.db2.gz YZXXWWCYLAWKQK-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000747207158 1135163718 /nfs/dbraw/zinc/16/37/18/1135163718.db2.gz HKTIEOOOSIYCRN-ZDUSSCGKSA-N 1 1 339.411 3.809 20 5 EHBDMO C[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC001194394959 1135263299 /nfs/dbraw/zinc/26/32/99/1135263299.db2.gz XLNQAVSSBGFOFQ-HNNXBMFYSA-N 1 1 345.468 3.610 20 5 EHBDMO C[N@H+](CCNC(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001194683619 1135305514 /nfs/dbraw/zinc/30/55/14/1135305514.db2.gz PFDOCHPLTBLELO-UHFFFAOYSA-N 1 1 327.428 3.552 20 5 EHBDMO C[N@@H+](CCNC(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001194683619 1135305519 /nfs/dbraw/zinc/30/55/19/1135305519.db2.gz PFDOCHPLTBLELO-UHFFFAOYSA-N 1 1 327.428 3.552 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1CC1CCCC1 ZINC001195639453 1135445590 /nfs/dbraw/zinc/44/55/90/1135445590.db2.gz URHSTALJFIOSQE-MRXNPFEDSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@H]2CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001195795707 1135470754 /nfs/dbraw/zinc/47/07/54/1135470754.db2.gz AJWWFPGEQATJEB-INIZCTEOSA-N 1 1 348.443 3.990 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001198818849 1135859756 /nfs/dbraw/zinc/85/97/56/1135859756.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 1 1 343.471 3.772 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859770 /nfs/dbraw/zinc/85/97/70/1135859770.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 1 1 343.471 3.772 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001198818849 1135859774 /nfs/dbraw/zinc/85/97/74/1135859774.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 1 1 343.471 3.772 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700321 1135868958 /nfs/dbraw/zinc/86/89/58/1135868958.db2.gz CPTYFTGQFHIUPE-TZMCWYRMSA-N 1 1 326.824 3.764 20 5 EHBDMO Cn1cc(C(C)(C)[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000809976263 1135907921 /nfs/dbraw/zinc/90/79/21/1135907921.db2.gz AUXAQJHRKOCUAA-UHFFFAOYSA-N 1 1 343.214 3.660 20 5 EHBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809982046 1135908398 /nfs/dbraw/zinc/90/83/98/1135908398.db2.gz GLAQYVQLRMOKCL-MEBBXXQBSA-N 1 1 347.242 3.885 20 5 EHBDMO Cc1ncc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000811479118 1136096866 /nfs/dbraw/zinc/09/68/66/1136096866.db2.gz XRYBOZBNNFYKMT-UHFFFAOYSA-N 1 1 332.212 3.956 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](Cc2ccccc2)CC2CCC2)cc1 ZINC000776275054 1136129255 /nfs/dbraw/zinc/12/92/55/1136129255.db2.gz FVHQKPVRPOBJFF-HXUWFJFHSA-N 1 1 340.423 3.931 20 5 EHBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278194 1136133880 /nfs/dbraw/zinc/13/38/80/1136133880.db2.gz SNIKGPBPMFXYHI-RBUKOAKNSA-N 1 1 326.396 3.774 20 5 EHBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579236 1136444206 /nfs/dbraw/zinc/44/42/06/1136444206.db2.gz KAYKLDLKDFZHPI-BEFAXECRSA-N 1 1 328.412 3.929 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000776579583 1136444637 /nfs/dbraw/zinc/44/46/37/1136444637.db2.gz NRNUGIQQOYBPDW-LIRRHRJNSA-N 1 1 344.411 3.720 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587634 1136447897 /nfs/dbraw/zinc/44/78/97/1136447897.db2.gz XPPZBTKYBXIYEC-ADLMAVQZSA-N 1 1 348.349 3.526 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587634 1136447898 /nfs/dbraw/zinc/44/78/98/1136447898.db2.gz XPPZBTKYBXIYEC-ADLMAVQZSA-N 1 1 348.349 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666338 1136491843 /nfs/dbraw/zinc/49/18/43/1136491843.db2.gz GMGJIIKVNURMBM-YJBOKZPZSA-N 1 1 346.814 3.771 20 5 EHBDMO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCC[C@@H](C)C1 ZINC000111193289 1136520378 /nfs/dbraw/zinc/52/03/78/1136520378.db2.gz PYRIPQLZTJNOGG-NEPJUHHUSA-N 1 1 334.445 3.737 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C2CCC2)s1 ZINC000338959429 1136604913 /nfs/dbraw/zinc/60/49/13/1136604913.db2.gz YNJZYVTVPRLMOF-UHFFFAOYSA-N 1 1 331.441 3.993 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000818201398 1136866109 /nfs/dbraw/zinc/86/61/09/1136866109.db2.gz VMYATCJCBCKGQQ-LBPRGKRZSA-N 1 1 348.374 3.876 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nc1 ZINC000858011269 1136929792 /nfs/dbraw/zinc/92/97/92/1136929792.db2.gz LURKUFABBOMSEX-CQSZACIVSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nc1 ZINC000858011269 1136929794 /nfs/dbraw/zinc/92/97/94/1136929794.db2.gz LURKUFABBOMSEX-CQSZACIVSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040794 1136934437 /nfs/dbraw/zinc/93/44/37/1136934437.db2.gz QGEJQCXSUFLQPN-DOTOQJQBSA-N 1 1 341.411 3.821 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483471 1137146507 /nfs/dbraw/zinc/14/65/07/1137146507.db2.gz UPRYHHFOWAQTDM-ZGBFETHSSA-N 1 1 338.407 3.592 20 5 EHBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359983 1137215346 /nfs/dbraw/zinc/21/53/46/1137215346.db2.gz LXGJXYNJJPNODU-KSSFIOAISA-N 1 1 346.452 3.741 20 5 EHBDMO Cc1nn(C[NH+]2CCC(C)(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC000794646294 1137220534 /nfs/dbraw/zinc/22/05/34/1137220534.db2.gz GNAYXQYKHNKJGD-UHFFFAOYSA-N 1 1 348.834 3.764 20 5 EHBDMO CCCCC[C@@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631448 1137221733 /nfs/dbraw/zinc/22/17/33/1137221733.db2.gz AVGCYAUGQSCQCD-CYBMUJFWSA-N 1 1 333.388 3.505 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631448 1137221735 /nfs/dbraw/zinc/22/17/35/1137221735.db2.gz AVGCYAUGQSCQCD-CYBMUJFWSA-N 1 1 333.388 3.505 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cnc([C@@H]3CCCO3)s2)cc1[N+](=O)[O-] ZINC000865787715 1137312018 /nfs/dbraw/zinc/31/20/18/1137312018.db2.gz RPTSKGUNIGGQSQ-HNNXBMFYSA-N 1 1 333.413 3.501 20 5 EHBDMO C[C@@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1F ZINC000846013166 1137326126 /nfs/dbraw/zinc/32/61/26/1137326126.db2.gz KOEKBMHOFLKMOY-QLJPJBMISA-N 1 1 338.766 3.599 20 5 EHBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100779 1137484663 /nfs/dbraw/zinc/48/46/63/1137484663.db2.gz VCGUXVDPVGHTRM-XHDPSFHLSA-N 1 1 346.349 3.597 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000872022240 1137565190 /nfs/dbraw/zinc/56/51/90/1137565190.db2.gz IHPGXFXMNTWRCD-RCBQFDQVSA-N 1 1 335.473 3.594 20 5 EHBDMO CCOc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872023390 1137565523 /nfs/dbraw/zinc/56/55/23/1137565523.db2.gz RMKBCOXFUSSIBR-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@H]2C2CC2)o1 ZINC000878050630 1137700842 /nfs/dbraw/zinc/70/08/42/1137700842.db2.gz ZLZALHDQRGKBCE-ZDUSSCGKSA-N 1 1 348.790 3.673 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055382 1137766743 /nfs/dbraw/zinc/76/67/43/1137766743.db2.gz XCOWUPZUBYOBNT-UHIISALHSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880055382 1137766744 /nfs/dbraw/zinc/76/67/44/1137766744.db2.gz XCOWUPZUBYOBNT-UHIISALHSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061726 1137766886 /nfs/dbraw/zinc/76/68/86/1137766886.db2.gz ZZQYIJYKJGGYST-GYSYKLTISA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061726 1137766887 /nfs/dbraw/zinc/76/68/87/1137766887.db2.gz ZZQYIJYKJGGYST-GYSYKLTISA-N 1 1 332.322 3.698 20 5 EHBDMO Cc1cc(N2CCC(C)([NH+]3CCC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000882963614 1137839936 /nfs/dbraw/zinc/83/99/36/1137839936.db2.gz DOCNPLSKMJJOEJ-UHFFFAOYSA-N 1 1 340.427 3.516 20 5 EHBDMO CC[C@H](c1ccncc1)[N@@H+](CC)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000131487311 1137854390 /nfs/dbraw/zinc/85/43/90/1137854390.db2.gz XCNBFEJZWROOSV-QGZVFWFLSA-N 1 1 339.399 3.770 20 5 EHBDMO CC(C)n1cnnc1[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861037 1137935988 /nfs/dbraw/zinc/93/59/88/1137935988.db2.gz UBSOWEIZGBFNTQ-HOCLYGCPSA-N 1 1 343.431 3.708 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000332323338 1137939797 /nfs/dbraw/zinc/93/97/97/1137939797.db2.gz NYZKVZSQMMVONP-GJZGRUSLSA-N 1 1 328.416 3.577 20 5 EHBDMO Cc1ccc(C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000136999104 1138045055 /nfs/dbraw/zinc/04/50/55/1138045055.db2.gz DAVAQHMVOUJIIL-KRWDZBQOSA-N 1 1 334.441 3.909 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066264 1138224399 /nfs/dbraw/zinc/22/43/99/1138224399.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 1 1 341.455 3.557 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134922593 1138713468 /nfs/dbraw/zinc/71/34/68/1138713468.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000134922593 1138713470 /nfs/dbraw/zinc/71/34/70/1138713470.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000134922593 1138713472 /nfs/dbraw/zinc/71/34/72/1138713472.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 1 1 329.444 3.605 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000178728685 1139715442 /nfs/dbraw/zinc/71/54/42/1139715442.db2.gz XKIHVDWCQITYNO-INIZCTEOSA-N 1 1 346.358 3.746 20 5 EHBDMO COC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000192924844 1140556498 /nfs/dbraw/zinc/55/64/98/1140556498.db2.gz KRBLYZDJWUOPQL-IAGOWNOFSA-N 1 1 330.384 3.851 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269672669 1141134139 /nfs/dbraw/zinc/13/41/39/1141134139.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 1 1 329.444 3.605 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCC[C@H]1O ZINC000270170605 1141187707 /nfs/dbraw/zinc/18/77/07/1141187707.db2.gz UGPBAVRPUOMXHN-MAUKXSAKSA-N 1 1 337.419 3.539 20 5 EHBDMO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271624255 1141407685 /nfs/dbraw/zinc/40/76/85/1141407685.db2.gz NHWYGWRNWVUHHK-CABCVRRESA-N 1 1 341.411 3.889 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000610215037 1015006751 /nfs/dbraw/zinc/00/67/51/1015006751.db2.gz YELKGCHBPYNEKH-INIZCTEOSA-N 1 1 326.396 3.668 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000430226728 1015124171 /nfs/dbraw/zinc/12/41/71/1015124171.db2.gz NQMFNJVEKFLXMX-JQHSSLGASA-N 1 1 348.443 3.629 20 5 EHBDMO CC(C)[N@H+](C)C[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000578179164 1015149620 /nfs/dbraw/zinc/14/96/20/1015149620.db2.gz JUNXGXZZWILTLL-ZDUSSCGKSA-N 1 1 348.472 3.537 20 5 EHBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000471166506 1015181523 /nfs/dbraw/zinc/18/15/23/1015181523.db2.gz XCSUMBNFQMHZMZ-INIZCTEOSA-N 1 1 343.402 3.835 20 5 EHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000471166506 1015181527 /nfs/dbraw/zinc/18/15/27/1015181527.db2.gz XCSUMBNFQMHZMZ-INIZCTEOSA-N 1 1 343.402 3.835 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000339670820 1015491711 /nfs/dbraw/zinc/49/17/11/1015491711.db2.gz FUFRMWBBMHGYDF-JSGCOSHPSA-N 1 1 342.399 3.828 20 5 EHBDMO COc1ccc([C@@H](C)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279529 1032267222 /nfs/dbraw/zinc/26/72/22/1032267222.db2.gz KEMYBECXNGQSGT-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO COc1ccccc1/C=C\C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000567000770 1032291831 /nfs/dbraw/zinc/29/18/31/1032291831.db2.gz RJRNRLANVITAHV-YFHOEESVSA-N 1 1 326.396 3.791 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506992 1032691832 /nfs/dbraw/zinc/69/18/32/1032691832.db2.gz ZZYMDYKZVKYOMK-MRXNPFEDSA-N 1 1 342.395 3.689 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc(OCC2CC2)nc1 ZINC000892810720 1017486065 /nfs/dbraw/zinc/48/60/65/1017486065.db2.gz GRGWTGGLIMGKPK-UHFFFAOYSA-N 1 1 347.802 3.722 20 5 EHBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000119632514 1018175203 /nfs/dbraw/zinc/17/52/03/1018175203.db2.gz VSPUZLWPKLJXRI-NSHDSACASA-N 1 1 348.786 3.870 20 5 EHBDMO Cc1ccc(-c2csc([C@@H]3C[N@H+]4CCC[C@@H]4CO3)n2)cc1[N+](=O)[O-] ZINC000102662597 1018572905 /nfs/dbraw/zinc/57/29/05/1018572905.db2.gz KCCPFLCSZRECDA-CJNGLKHVSA-N 1 1 345.424 3.562 20 5 EHBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000052210063 1018869394 /nfs/dbraw/zinc/86/93/94/1018869394.db2.gz NWHRBBXVSSQNDU-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000052210063 1018869415 /nfs/dbraw/zinc/86/94/15/1018869415.db2.gz NWHRBBXVSSQNDU-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO COc1ccc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000025447909 1018979889 /nfs/dbraw/zinc/97/98/89/1018979889.db2.gz MMWFHRZFNDPOLD-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000025447909 1018979907 /nfs/dbraw/zinc/97/99/07/1018979907.db2.gz MMWFHRZFNDPOLD-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO Cc1ccc(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] ZINC001167935909 1019203479 /nfs/dbraw/zinc/20/34/79/1019203479.db2.gz CMTXOQPXKIMDCJ-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO Cn1cccc1C[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000129339694 1019565053 /nfs/dbraw/zinc/56/50/53/1019565053.db2.gz OROTVDRIKIMXHX-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000129339694 1019565066 /nfs/dbraw/zinc/56/50/66/1019565066.db2.gz OROTVDRIKIMXHX-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO C[C@@]1(C[NH3+])CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918143 1019717063 /nfs/dbraw/zinc/71/70/63/1019717063.db2.gz YIXNMTQWACCGRF-KRWDZBQOSA-N 1 1 349.818 3.679 20 5 EHBDMO Cn1cc([C@H]2C[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000580841783 1020128798 /nfs/dbraw/zinc/12/87/98/1020128798.db2.gz MHGNXKVKQZKAHT-CQSZACIVSA-N 1 1 348.834 3.607 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)nc1-c1ccccc1 ZINC000341269526 1021250676 /nfs/dbraw/zinc/25/06/76/1021250676.db2.gz NKXICNLDMJDDLO-UHFFFAOYSA-N 1 1 349.394 3.764 20 5 EHBDMO C[N@H+]1CCC2(CN(C(=O)c3ccc4cc5ccccc5cc4c3)C2)C1 ZINC001270140623 1021360836 /nfs/dbraw/zinc/36/08/36/1021360836.db2.gz MKZRODYKXBJWPD-UHFFFAOYSA-N 1 1 330.431 3.771 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCOCc1ccccc1 ZINC000439481914 1021488050 /nfs/dbraw/zinc/48/80/50/1021488050.db2.gz OMZNLBJLDGATFO-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2N(C)C)ccc1[N+](=O)[O-] ZINC000516509642 1021502702 /nfs/dbraw/zinc/50/27/02/1021502702.db2.gz WSTRQQZGUAQGEF-UHFFFAOYSA-N 1 1 343.427 3.692 20 5 EHBDMO CCn1cc([C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000449665075 1033001263 /nfs/dbraw/zinc/00/12/63/1033001263.db2.gz DIZRRVGRILOUCS-ZDUSSCGKSA-N 1 1 340.383 3.922 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000490042888 1021714066 /nfs/dbraw/zinc/71/40/66/1021714066.db2.gz PGKXFIIWMNJKKR-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO CC(C)[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000506749699 1021917702 /nfs/dbraw/zinc/91/77/02/1021917702.db2.gz BTLCASXDKZZBKP-UHFFFAOYSA-N 1 1 338.791 3.711 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)n1 ZINC000178201372 1022099799 /nfs/dbraw/zinc/09/97/99/1022099799.db2.gz LHOKEVPWLAWQKO-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CCO2 ZINC000341540317 1022183657 /nfs/dbraw/zinc/18/36/57/1022183657.db2.gz HBNIRFDMQPZMIN-MRXNPFEDSA-N 1 1 348.786 3.870 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccsc2Br)c1 ZINC000337762206 1022368840 /nfs/dbraw/zinc/36/88/40/1022368840.db2.gz ABIZHUCJZZYUQM-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336453 1022375313 /nfs/dbraw/zinc/37/53/13/1022375313.db2.gz JTMBQUVGXPWYQY-GJZGRUSLSA-N 1 1 340.427 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCCOc1ccccc1)CC2 ZINC000438113204 1022398431 /nfs/dbraw/zinc/39/84/31/1022398431.db2.gz DYYNPWAKOWCEDL-UHFFFAOYSA-N 1 1 326.396 3.812 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000441427411 1022531980 /nfs/dbraw/zinc/53/19/80/1022531980.db2.gz GTCFVGNKSXSCRP-OAHLLOKOSA-N 1 1 344.411 3.545 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)[C@@H](C)O1 ZINC000438371678 1022616823 /nfs/dbraw/zinc/61/68/23/1022616823.db2.gz GSBWAKXEFRFKSM-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)[C@@H](C)O1 ZINC000438371678 1022616832 /nfs/dbraw/zinc/61/68/32/1022616832.db2.gz GSBWAKXEFRFKSM-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO CCC1(CC)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438506162 1022745108 /nfs/dbraw/zinc/74/51/08/1022745108.db2.gz FJSJSFBAUVHEHF-UHFFFAOYSA-N 1 1 339.823 3.699 20 5 EHBDMO CCC1(CC)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438506162 1022745119 /nfs/dbraw/zinc/74/51/19/1022745119.db2.gz FJSJSFBAUVHEHF-UHFFFAOYSA-N 1 1 339.823 3.699 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3Cc3ccccc3)nc2c1 ZINC000610580805 1022780806 /nfs/dbraw/zinc/78/08/06/1022780806.db2.gz LJZUEXLAKUFOJG-HNNXBMFYSA-N 1 1 337.379 3.943 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CC2)n1 ZINC000894723774 1022820071 /nfs/dbraw/zinc/82/00/71/1022820071.db2.gz PLIIYLSILZFIIR-MRXNPFEDSA-N 1 1 340.427 3.585 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536345656 1022954874 /nfs/dbraw/zinc/95/48/74/1022954874.db2.gz NJUZGNASMGCPAF-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO Cc1ccc(NC(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000506357997 1023000150 /nfs/dbraw/zinc/00/01/50/1023000150.db2.gz WEAPKKCNNFQZAX-ZDUSSCGKSA-N 1 1 348.447 3.535 20 5 EHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000610705517 1023277170 /nfs/dbraw/zinc/27/71/70/1023277170.db2.gz RIBLUEHQPADKBV-QGZVFWFLSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](O)C[C@H]1c1ccccc1 ZINC000602730809 1033122950 /nfs/dbraw/zinc/12/29/50/1033122950.db2.gz IUIMUHWFAMLNII-YRCFHQPNSA-N 1 1 338.407 3.806 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@H]43)o2)c1 ZINC000535801269 1023647788 /nfs/dbraw/zinc/64/77/88/1023647788.db2.gz GFPMOJHYYBTBHI-MAUKXSAKSA-N 1 1 342.395 3.856 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccccc2)CC2(CO)CC2)cccc1[N+](=O)[O-] ZINC000341951811 1023716976 /nfs/dbraw/zinc/71/69/76/1023716976.db2.gz NPMFVELGRVYJMR-UHFFFAOYSA-N 1 1 340.423 3.678 20 5 EHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1cc2ccccc2o1 ZINC000176216748 1023883461 /nfs/dbraw/zinc/88/34/61/1023883461.db2.gz VYOCXYMTXQQJDA-CYBMUJFWSA-N 1 1 328.372 3.621 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000522268430 1024127910 /nfs/dbraw/zinc/12/79/10/1024127910.db2.gz AUFOCOLVVYTAKH-UHFFFAOYSA-N 1 1 326.396 3.594 20 5 EHBDMO O=[N+]([O-])c1cnccc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000142810483 1024144899 /nfs/dbraw/zinc/14/48/99/1024144899.db2.gz KXTZKHKDUKWAKM-ALOPSCKCSA-N 1 1 338.411 3.597 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@H](C)C1 ZINC000443643640 1024307902 /nfs/dbraw/zinc/30/79/02/1024307902.db2.gz SEOLYIDDGLRGJV-KBPBESRZSA-N 1 1 333.432 3.600 20 5 EHBDMO CCn1ccnc1[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000280966407 1024465698 /nfs/dbraw/zinc/46/56/98/1024465698.db2.gz KCEPDCOTBSLRCM-KRWDZBQOSA-N 1 1 328.416 3.581 20 5 EHBDMO CCCCOC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000435039675 1024563182 /nfs/dbraw/zinc/56/31/82/1024563182.db2.gz AZVRWXGILARIFN-UHFFFAOYSA-N 1 1 333.388 3.517 20 5 EHBDMO C[C@@H](c1ccccc1)[C@@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600321 1024803020 /nfs/dbraw/zinc/80/30/20/1024803020.db2.gz NGSUKYRUVHZTSN-YWZLYKJASA-N 1 1 340.423 3.724 20 5 EHBDMO CC(C)n1cncc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369119 1024886642 /nfs/dbraw/zinc/88/66/42/1024886642.db2.gz LETUNNZTAPQTRX-INIZCTEOSA-N 1 1 328.416 3.752 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000072014224 1025147369 /nfs/dbraw/zinc/14/73/69/1025147369.db2.gz YFNBJKDNQMCZPP-UHFFFAOYSA-N 1 1 328.412 3.976 20 5 EHBDMO CC(C)OCCC[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422909 1025246074 /nfs/dbraw/zinc/24/60/74/1025246074.db2.gz SVCIUXFVADTJBF-UHFFFAOYSA-N 1 1 345.237 3.604 20 5 EHBDMO CN(C)c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc[nH+]1 ZINC000346885783 1025257940 /nfs/dbraw/zinc/25/79/40/1025257940.db2.gz SBMGYKGRGFIQGY-UHFFFAOYSA-N 1 1 342.380 3.523 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nccc3c2CCCC3)cc1Cl ZINC000896282070 1025313772 /nfs/dbraw/zinc/31/37/72/1025313772.db2.gz NQBIWRIHDOBKFQ-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCN(c2ccccc2)CC1 ZINC000438997491 1025384568 /nfs/dbraw/zinc/38/45/68/1025384568.db2.gz HHEOBQOFVGVHHC-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCN(c2ccccc2)CC1 ZINC000438997491 1025384580 /nfs/dbraw/zinc/38/45/80/1025384580.db2.gz HHEOBQOFVGVHHC-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000120091546 1025985554 /nfs/dbraw/zinc/98/55/54/1025985554.db2.gz KRBOJTOOHOOHJV-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000120091546 1025985567 /nfs/dbraw/zinc/98/55/67/1025985567.db2.gz KRBOJTOOHOOHJV-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000120091383 1025991993 /nfs/dbraw/zinc/99/19/93/1025991993.db2.gz KRBOJTOOHOOHJV-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000120091383 1025992000 /nfs/dbraw/zinc/99/20/00/1025992000.db2.gz KRBOJTOOHOOHJV-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000530627265 1026151536 /nfs/dbraw/zinc/15/15/36/1026151536.db2.gz NATVLFBXZOMGNG-SFHVURJKSA-N 1 1 328.412 3.674 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C(F)(F)F)s1 ZINC000338957473 1026301651 /nfs/dbraw/zinc/30/16/51/1026301651.db2.gz FRVJBTIVROZAMI-UHFFFAOYSA-N 1 1 345.346 3.745 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C(F)(F)F)s1 ZINC000338957473 1026301662 /nfs/dbraw/zinc/30/16/62/1026301662.db2.gz FRVJBTIVROZAMI-UHFFFAOYSA-N 1 1 345.346 3.745 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451971601 1026428286 /nfs/dbraw/zinc/42/82/86/1026428286.db2.gz LZGFGMNIYCKPGO-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000501785390 1027534237 /nfs/dbraw/zinc/53/42/37/1027534237.db2.gz PNJOGZPWKNIOPE-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@@H](CO)C2)c1 ZINC000347330985 1027709856 /nfs/dbraw/zinc/70/98/56/1027709856.db2.gz HXZWHAHNRKNKHR-HZPDHXFCSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)[C@@H]2C=C[C@@H](CO)C2)c1 ZINC000347330985 1027709875 /nfs/dbraw/zinc/70/98/75/1027709875.db2.gz HXZWHAHNRKNKHR-HZPDHXFCSA-N 1 1 344.436 3.596 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000091457200 1027875807 /nfs/dbraw/zinc/87/58/07/1027875807.db2.gz NXRXQMJBYBIYIK-UHFFFAOYSA-N 1 1 329.400 3.667 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174575 1027911786 /nfs/dbraw/zinc/91/17/86/1027911786.db2.gz IUNWSAUQCFZRMA-BBRMVZONSA-N 1 1 330.359 3.948 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H](CCO)CC2)c1 ZINC000421018118 1028003286 /nfs/dbraw/zinc/00/32/86/1028003286.db2.gz OAYHLIVULFVGMO-GFCCVEGCSA-N 1 1 346.349 3.598 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](CCC(F)(F)F)CC3CC3)nc2c1 ZINC000444650138 1028114457 /nfs/dbraw/zinc/11/44/57/1028114457.db2.gz NNEHOWPSFJZBAV-UHFFFAOYSA-N 1 1 342.321 3.636 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](CCC(F)(F)F)CC3CC3)nc2c1 ZINC000444650138 1028114471 /nfs/dbraw/zinc/11/44/71/1028114471.db2.gz NNEHOWPSFJZBAV-UHFFFAOYSA-N 1 1 342.321 3.636 20 5 EHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680974 1028150504 /nfs/dbraw/zinc/15/05/04/1028150504.db2.gz XWJDRIGGGIGOOL-YOEHRIQHSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000444699884 1028172867 /nfs/dbraw/zinc/17/28/67/1028172867.db2.gz FFXRMVRXKQZVPU-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000444699884 1028172876 /nfs/dbraw/zinc/17/28/76/1028172876.db2.gz FFXRMVRXKQZVPU-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)n1 ZINC000444806582 1028277499 /nfs/dbraw/zinc/27/74/99/1028277499.db2.gz UXLYTBLWNUYVCD-OAHLLOKOSA-N 1 1 334.807 3.672 20 5 EHBDMO CCc1ccc([C@H](NC2CCC([NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423229142 1028292713 /nfs/dbraw/zinc/29/27/13/1028292713.db2.gz GMJHLLOOEWITMS-JFIBYHEFSA-N 1 1 343.427 3.699 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)c1 ZINC000444792672 1028292669 /nfs/dbraw/zinc/29/26/69/1028292669.db2.gz FDTGEDXBUFABNB-INIZCTEOSA-N 1 1 334.807 3.672 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)C1CCCCC1 ZINC000532747140 1028765571 /nfs/dbraw/zinc/76/55/71/1028765571.db2.gz QVSRIYYJURZQRO-UHFFFAOYSA-N 1 1 336.432 3.509 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912015 1029055450 /nfs/dbraw/zinc/05/54/50/1029055450.db2.gz OVGQBILFCUNYPI-XHSDSOJGSA-N 1 1 349.475 3.907 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912015 1029055463 /nfs/dbraw/zinc/05/54/63/1029055463.db2.gz OVGQBILFCUNYPI-XHSDSOJGSA-N 1 1 349.475 3.907 20 5 EHBDMO CCN1CCC([NH2+]Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000271937524 1029238684 /nfs/dbraw/zinc/23/86/84/1029238684.db2.gz YCBWNXYTOYLCCZ-UHFFFAOYSA-N 1 1 336.435 3.520 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1F ZINC000176535597 1029310064 /nfs/dbraw/zinc/31/00/64/1029310064.db2.gz CQSZPDSHQAHCNU-GFCCVEGCSA-N 1 1 346.358 3.760 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000524593833 1029349252 /nfs/dbraw/zinc/34/92/52/1029349252.db2.gz TUCKXTRPJBRLKZ-UHFFFAOYSA-N 1 1 345.468 3.537 20 5 EHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059130 1029725209 /nfs/dbraw/zinc/72/52/09/1029725209.db2.gz IJGYMGYUABMCMK-SFHVURJKSA-N 1 1 328.412 3.676 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000343224681 1029809683 /nfs/dbraw/zinc/80/96/83/1029809683.db2.gz ZHHILLBFKWLAIZ-ZDUSSCGKSA-N 1 1 342.399 3.550 20 5 EHBDMO CC(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000533784107 1029825954 /nfs/dbraw/zinc/82/59/54/1029825954.db2.gz BIEPYHUZDGLNQO-UHFFFAOYSA-N 1 1 331.338 3.534 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000533820157 1029879129 /nfs/dbraw/zinc/87/91/29/1029879129.db2.gz UACJZUQGTUBNNV-AWEZNQCLSA-N 1 1 349.337 3.795 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000525634473 1029984425 /nfs/dbraw/zinc/98/44/25/1029984425.db2.gz WYMAJKACHXSDHN-KRWDZBQOSA-N 1 1 326.396 3.538 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)n1 ZINC000481977712 1030143318 /nfs/dbraw/zinc/14/33/18/1030143318.db2.gz PGOWAPYKFRUVBK-INIZCTEOSA-N 1 1 346.475 3.779 20 5 EHBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013892 1030272616 /nfs/dbraw/zinc/27/26/16/1030272616.db2.gz ZEALOROLMXXQAH-INIZCTEOSA-N 1 1 334.416 3.862 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000520348492 1030328886 /nfs/dbraw/zinc/32/88/86/1030328886.db2.gz XRLWUDHVBYIWQT-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870421 1030418438 /nfs/dbraw/zinc/41/84/38/1030418438.db2.gz JNXQIBNMAWEEAN-GOSISDBHSA-N 1 1 327.384 3.514 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000447732151 1030441227 /nfs/dbraw/zinc/44/12/27/1030441227.db2.gz VOBVSSXUHPARCY-AWEZNQCLSA-N 1 1 346.818 3.638 20 5 EHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607376 1030750959 /nfs/dbraw/zinc/75/09/59/1030750959.db2.gz OSCIMSKGPUCKGO-DOMZBBRYSA-N 1 1 330.388 3.655 20 5 EHBDMO CCC(CC)[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CC(C)C ZINC000482866835 1030760252 /nfs/dbraw/zinc/76/02/52/1030760252.db2.gz MXRQTRQYYOVIFX-UHFFFAOYSA-N 1 1 335.448 3.988 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccc1)C[C@H](C)O ZINC000527304336 1030767929 /nfs/dbraw/zinc/76/79/29/1030767929.db2.gz AQYOAMXUWBKYFF-YTBHAWNYSA-N 1 1 340.423 3.881 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000483120922 1030968391 /nfs/dbraw/zinc/96/83/91/1030968391.db2.gz LIYIKLDITHDVLR-GFCCVEGCSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000483110859 1030975837 /nfs/dbraw/zinc/97/58/37/1030975837.db2.gz MJJITIVEZMLVCQ-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC000611797333 1031289059 /nfs/dbraw/zinc/28/90/59/1031289059.db2.gz UZYDNWKXJSGFCJ-KGLIPLIRSA-N 1 1 338.835 3.887 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248136823 1031423585 /nfs/dbraw/zinc/42/35/85/1031423585.db2.gz PDQXHOAEAXOKNL-LPHOPBHVSA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCO3)o2)c1 ZINC000551586963 1031473850 /nfs/dbraw/zinc/47/38/50/1031473850.db2.gz SOZGVPJBAWIZNS-MJGOQNOKSA-N 1 1 342.395 3.998 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC[C@H]1C(F)(F)F ZINC000484340121 1031535098 /nfs/dbraw/zinc/53/50/98/1031535098.db2.gz MPDNKLKYRMMMNR-CQSZACIVSA-N 1 1 346.349 3.884 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365243 1031870486 /nfs/dbraw/zinc/87/04/86/1031870486.db2.gz SZUBITLGGQRBPE-LRFDDAOPSA-N 1 1 342.399 3.569 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580855 1033571915 /nfs/dbraw/zinc/57/19/15/1033571915.db2.gz XCLZTCPNWBWQJB-DZGCQCFKSA-N 1 1 331.441 3.836 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H](OC1CCCC1)C(F)(F)F ZINC000594967259 1033604673 /nfs/dbraw/zinc/60/46/73/1033604673.db2.gz JSXMQERJYJBDAM-AWEZNQCLSA-N 1 1 332.322 3.575 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081031 1033696474 /nfs/dbraw/zinc/69/64/74/1033696474.db2.gz PIOLWKHWNACIJD-KDOFPFPSSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC000595081031 1033696477 /nfs/dbraw/zinc/69/64/77/1033696477.db2.gz PIOLWKHWNACIJD-KDOFPFPSSA-N 1 1 329.444 3.579 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081591 1033696962 /nfs/dbraw/zinc/69/69/62/1033696962.db2.gz SMNLMMRBTQRECB-LSDHHAIUSA-N 1 1 347.459 3.661 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc2ccccc2n1 ZINC000595295406 1033720998 /nfs/dbraw/zinc/72/09/98/1033720998.db2.gz LSCXTVRPPRTSQM-UHFFFAOYSA-N 1 1 336.395 3.949 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CC[N@H+]2C2CCCC2)ccc2ncccc21 ZINC000599165776 1033782339 /nfs/dbraw/zinc/78/23/39/1033782339.db2.gz SJNAFDJOMJPFAM-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000595497029 1033831368 /nfs/dbraw/zinc/83/13/68/1033831368.db2.gz LIMYIXHYXIIJNG-HNNXBMFYSA-N 1 1 338.766 3.601 20 5 EHBDMO Cc1c(C[NH+]2CCN(c3cccc(Cl)c3)CC2)cccc1[N+](=O)[O-] ZINC000603837809 1033962687 /nfs/dbraw/zinc/96/26/87/1033962687.db2.gz IEFNBHKQPOVDFW-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000603853710 1033977208 /nfs/dbraw/zinc/97/72/08/1033977208.db2.gz KHPXTNFVBKJDLO-KBPBESRZSA-N 1 1 328.416 3.818 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](CCF)C3)co2)cc1 ZINC000595755096 1033984820 /nfs/dbraw/zinc/98/48/20/1033984820.db2.gz GGYAWXWTPYVSAW-CYBMUJFWSA-N 1 1 333.363 3.821 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000603867320 1033994238 /nfs/dbraw/zinc/99/42/38/1033994238.db2.gz KTTHHODWFGWYMR-LJQANCHMSA-N 1 1 326.396 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]4CC[C@@H](C3)S4)co2)cc1 ZINC000599553369 1034008810 /nfs/dbraw/zinc/00/88/10/1034008810.db2.gz RDQSVPDQZOHXDO-CVEARBPZSA-N 1 1 345.424 3.720 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590223 1034028157 /nfs/dbraw/zinc/02/81/57/1034028157.db2.gz VWYRBWFEUOOVTH-CZUORRHYSA-N 1 1 348.443 3.703 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910280 1034030086 /nfs/dbraw/zinc/03/00/86/1034030086.db2.gz OHSKCOHIZAAZSG-LZQZEXGQSA-N 1 1 330.428 3.857 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691145 1034096399 /nfs/dbraw/zinc/09/63/99/1034096399.db2.gz QSLZBPZLRWGHBB-PYLYLYNFSA-N 1 1 342.399 3.823 20 5 EHBDMO COc1ccc([C@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1F ZINC000599679770 1034107452 /nfs/dbraw/zinc/10/74/52/1034107452.db2.gz OJDLLFLVNINPHC-ZDUSSCGKSA-N 1 1 336.388 3.794 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1F ZINC000599679770 1034107463 /nfs/dbraw/zinc/10/74/63/1034107463.db2.gz OJDLLFLVNINPHC-ZDUSSCGKSA-N 1 1 336.388 3.794 20 5 EHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](CC)c1ccccc1 ZINC000534134930 1034176249 /nfs/dbraw/zinc/17/62/49/1034176249.db2.gz YJQGTJREBCSQGT-SFHVURJKSA-N 1 1 343.427 3.620 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000596478970 1034254761 /nfs/dbraw/zinc/25/47/61/1034254761.db2.gz QNUBWSRFVHCONX-OAHLLOKOSA-N 1 1 333.432 3.560 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC/C=C\c3ccccc3)C2)nc1 ZINC000450556368 1034518892 /nfs/dbraw/zinc/51/88/92/1034518892.db2.gz AVTHHOJQMCSCAH-LYLYKKCESA-N 1 1 338.411 3.580 20 5 EHBDMO C[C@]12COC[C@@H]1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212093 1034595882 /nfs/dbraw/zinc/59/58/82/1034595882.db2.gz RPSMVSYVNXMZIZ-KSSFIOAISA-N 1 1 344.436 3.792 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000597205770 1034609302 /nfs/dbraw/zinc/60/93/02/1034609302.db2.gz IMWYTWIDLUSZGV-RBUKOAKNSA-N 1 1 340.423 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000172257411 1034868969 /nfs/dbraw/zinc/86/89/69/1034868969.db2.gz GVBDBIZCTWNJOJ-LJQANCHMSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000172257411 1034868974 /nfs/dbraw/zinc/86/89/74/1034868974.db2.gz GVBDBIZCTWNJOJ-LJQANCHMSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000172258402 1034870065 /nfs/dbraw/zinc/87/00/65/1034870065.db2.gz PQSCDTCUBQTESB-IBGZPJMESA-N 1 1 344.386 3.606 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000615837653 1035028761 /nfs/dbraw/zinc/02/87/61/1035028761.db2.gz SNGNOTOVPMBHPH-KZIRBZLESA-N 1 1 337.423 3.958 20 5 EHBDMO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1noc(-c2ccccc2)n1 ZINC000612523785 1035029372 /nfs/dbraw/zinc/02/93/72/1035029372.db2.gz USOIJDULZHXLKR-CYBMUJFWSA-N 1 1 338.367 3.538 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)cc1 ZINC000412001716 1035274056 /nfs/dbraw/zinc/27/40/56/1035274056.db2.gz QTIXEPGQNPTGGT-LJQANCHMSA-N 1 1 338.407 3.949 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000580373716 1035427561 /nfs/dbraw/zinc/42/75/61/1035427561.db2.gz INQDSAFBFWSGTE-CQSZACIVSA-N 1 1 340.379 3.838 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000580373716 1035427567 /nfs/dbraw/zinc/42/75/67/1035427567.db2.gz INQDSAFBFWSGTE-CQSZACIVSA-N 1 1 340.379 3.838 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000540648372 1035537329 /nfs/dbraw/zinc/53/73/29/1035537329.db2.gz USCXHWPHPWHCSH-AWEZNQCLSA-N 1 1 328.416 3.594 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075864703 1035569007 /nfs/dbraw/zinc/56/90/07/1035569007.db2.gz WJHHZNSPTXQYAA-INIZCTEOSA-N 1 1 344.386 3.773 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113835 1036257252 /nfs/dbraw/zinc/25/72/52/1036257252.db2.gz ZOXJYGLTYCGZAP-FZMZJTMJSA-N 1 1 343.349 3.534 20 5 EHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000492830527 1036343112 /nfs/dbraw/zinc/34/31/12/1036343112.db2.gz NAOIGSCAMXWGLB-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000589508049 1036430639 /nfs/dbraw/zinc/43/06/39/1036430639.db2.gz YPEAZMUWUJUXGE-GFCCVEGCSA-N 1 1 346.358 3.680 20 5 EHBDMO CCC(CC)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000165365472 1036434974 /nfs/dbraw/zinc/43/49/74/1036434974.db2.gz CUSQHLSEWHAAIY-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO Cc1nc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)s1 ZINC000443613622 1036679078 /nfs/dbraw/zinc/67/90/78/1036679078.db2.gz JFJBVRJLFKKYGV-UHFFFAOYSA-N 1 1 347.440 3.712 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651849 1036940837 /nfs/dbraw/zinc/94/08/37/1036940837.db2.gz JXVZIURJJKLCLL-YDHLFZDLSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271702918 1036960342 /nfs/dbraw/zinc/96/03/42/1036960342.db2.gz HQGKYQDRLUBGHB-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO CC[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000180639619 1037048018 /nfs/dbraw/zinc/04/80/18/1037048018.db2.gz MMHXDLAJZKZIKN-OAHLLOKOSA-N 1 1 346.358 3.746 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000609144355 1037059940 /nfs/dbraw/zinc/05/99/40/1037059940.db2.gz PUWHTNCMZDAVRD-OAHLLOKOSA-N 1 1 344.386 3.950 20 5 EHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521355 1037097057 /nfs/dbraw/zinc/09/70/57/1037097057.db2.gz GDASIXUJNDKPIR-CYBMUJFWSA-N 1 1 339.867 3.848 20 5 EHBDMO C[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521355 1037097071 /nfs/dbraw/zinc/09/70/71/1037097071.db2.gz GDASIXUJNDKPIR-CYBMUJFWSA-N 1 1 339.867 3.848 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000493571966 1037459766 /nfs/dbraw/zinc/45/97/66/1037459766.db2.gz IXTSIEWHSLDEJL-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000030153658 1037632274 /nfs/dbraw/zinc/63/22/74/1037632274.db2.gz DCCNIUWRPSOKRS-UHFFFAOYSA-N 1 1 339.439 3.611 20 5 EHBDMO COc1cc(C[N@H+](Cc2ccc(C)nc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000592146443 1037868466 /nfs/dbraw/zinc/86/84/66/1037868466.db2.gz QIRMHSNBIKUZPB-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000784396702 1037921822 /nfs/dbraw/zinc/92/18/22/1037921822.db2.gz CSIBABXVHPNHCH-LJQANCHMSA-N 1 1 346.402 3.897 20 5 EHBDMO Cc1cccc([C@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001167735185 1038444255 /nfs/dbraw/zinc/44/42/55/1038444255.db2.gz UTQFLTWBBXGVSJ-LJQANCHMSA-N 1 1 326.396 3.601 20 5 EHBDMO O=C(c1cccs1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000365786354 1038531818 /nfs/dbraw/zinc/53/18/18/1038531818.db2.gz JWMTXKRQDQTLCZ-UHFFFAOYSA-N 1 1 330.409 3.751 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000365794660 1038539453 /nfs/dbraw/zinc/53/94/53/1038539453.db2.gz KSULLOJIQAOJOW-INIZCTEOSA-N 1 1 343.339 3.546 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000365794660 1038539463 /nfs/dbraw/zinc/53/94/63/1038539463.db2.gz KSULLOJIQAOJOW-INIZCTEOSA-N 1 1 343.339 3.546 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788567 1038610618 /nfs/dbraw/zinc/61/06/18/1038610618.db2.gz XRQODSBVBBMGEA-RYUDHWBXSA-N 1 1 343.349 3.961 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000539068802 1038669359 /nfs/dbraw/zinc/66/93/59/1038669359.db2.gz WXIKYHQLPFBOSB-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1)CC(C)C ZINC000539107760 1038676187 /nfs/dbraw/zinc/67/61/87/1038676187.db2.gz SXRZUMFTPYOJMB-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO C[N@H+](Cc1ccc2ccccc2c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749637878 1038906977 /nfs/dbraw/zinc/90/69/77/1038906977.db2.gz FBVDYVSIVJRBPG-HXUWFJFHSA-N 1 1 336.391 3.913 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC1CCC1 ZINC000478004936 1039130928 /nfs/dbraw/zinc/13/09/28/1039130928.db2.gz UEETVYMKUQUGST-OAHLLOKOSA-N 1 1 328.416 3.655 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485473040 1039136780 /nfs/dbraw/zinc/13/67/80/1039136780.db2.gz HMALGUOIWVHCKB-YOEHRIQHSA-N 1 1 326.396 3.981 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnc(C(C)C)s1 ZINC000345043843 1039287779 /nfs/dbraw/zinc/28/77/79/1039287779.db2.gz KGQUJACBNFPLJP-KPKJPENVSA-N 1 1 332.429 3.763 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1CO ZINC000249062714 1039343670 /nfs/dbraw/zinc/34/36/70/1039343670.db2.gz ICDCRLXCZNLTPG-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO CC(C)(C)OCc1cc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])no1 ZINC000485727922 1039472405 /nfs/dbraw/zinc/47/24/05/1039472405.db2.gz XYAGEXVZBFGQOD-VURMDHGXSA-N 1 1 345.399 3.701 20 5 EHBDMO Cc1c(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000500787713 1039496219 /nfs/dbraw/zinc/49/62/19/1039496219.db2.gz OKSLFJQTVIDVIK-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000485746884 1039507087 /nfs/dbraw/zinc/50/70/87/1039507087.db2.gz UAKVXJKHBQEZGV-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485798305 1039572377 /nfs/dbraw/zinc/57/23/77/1039572377.db2.gz DNJXECALPAJVGO-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO CCc1onc(C)c1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000894082429 1040039371 /nfs/dbraw/zinc/03/93/71/1040039371.db2.gz WSNOTBBBGBJPNL-UHFFFAOYSA-N 1 1 343.305 3.762 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccsc2)CC1 ZINC000029157207 1040171537 /nfs/dbraw/zinc/17/15/37/1040171537.db2.gz VCAFNSFNMGDHNU-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000489980364 1040286302 /nfs/dbraw/zinc/28/63/02/1040286302.db2.gz RESXXDJQWBXAJY-AWEZNQCLSA-N 1 1 342.395 3.883 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490034536 1040302319 /nfs/dbraw/zinc/30/23/19/1040302319.db2.gz AJAUVHUTJVDMAT-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490014981 1040307300 /nfs/dbraw/zinc/30/73/00/1040307300.db2.gz RVVIVBWBBQUZCD-KRWDZBQOSA-N 1 1 326.396 3.668 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071077 1040332874 /nfs/dbraw/zinc/33/28/74/1040332874.db2.gz YLNFBJVZKJEEGW-SFHVURJKSA-N 1 1 325.412 3.980 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000418089668 1040567235 /nfs/dbraw/zinc/56/72/35/1040567235.db2.gz JKUKARUDLRYIGI-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO CC1(C)C[C@H](N[C@@H]2CC[N@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114679 1040765289 /nfs/dbraw/zinc/76/52/89/1040765289.db2.gz GTIKIRFAQFDIBV-KUHUBIRLSA-N 1 1 343.471 3.924 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@@H]2CCN(C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114679 1040765307 /nfs/dbraw/zinc/76/53/07/1040765307.db2.gz GTIKIRFAQFDIBV-KUHUBIRLSA-N 1 1 343.471 3.924 20 5 EHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182646 1040944108 /nfs/dbraw/zinc/94/41/08/1040944108.db2.gz NEFVVCIDCFUKLO-NSHDSACASA-N 1 1 346.374 3.868 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000555665338 1040975500 /nfs/dbraw/zinc/97/55/00/1040975500.db2.gz AYERRSPRJHJVBQ-AWEZNQCLSA-N 1 1 338.407 3.959 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000738221953 1041081712 /nfs/dbraw/zinc/08/17/12/1041081712.db2.gz QFUGDAQOGSULIR-HNNXBMFYSA-N 1 1 334.445 3.510 20 5 EHBDMO [NH3+]C[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227074 1041365786 /nfs/dbraw/zinc/36/57/86/1041365786.db2.gz GSCNENRNBSEPOP-GFCCVEGCSA-N 1 1 349.818 3.679 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000500425582 1041438070 /nfs/dbraw/zinc/43/80/70/1041438070.db2.gz UMTRTEUVERITSI-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000511668798 1041457353 /nfs/dbraw/zinc/45/73/53/1041457353.db2.gz VSILLLZNSGRWBA-QKWWCAPFSA-N 1 1 338.407 3.854 20 5 EHBDMO C[N@@H+](CCNc1ccc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000111816843 1042294920 /nfs/dbraw/zinc/29/49/20/1042294920.db2.gz CBTUAIHLTZFFFX-UHFFFAOYSA-N 1 1 342.237 3.644 20 5 EHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000072948518 1042944162 /nfs/dbraw/zinc/94/41/62/1042944162.db2.gz LKHUOVGJRNOREZ-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000432339475 1042972626 /nfs/dbraw/zinc/97/26/26/1042972626.db2.gz ITYXSOHXACWZBI-DOMZBBRYSA-N 1 1 335.835 3.701 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCCCC[C@H]3CCO)o2)cc1 ZINC000585767882 1043029949 /nfs/dbraw/zinc/02/99/49/1043029949.db2.gz VVYKHCNOJQGCML-INIZCTEOSA-N 1 1 344.411 3.982 20 5 EHBDMO CCn1nccc1C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000278958438 1043085557 /nfs/dbraw/zinc/08/55/57/1043085557.db2.gz WLKUGXPROLSAEV-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO CC1(C)C[C@H]([NH2+]C2CCN(C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003346 1043165875 /nfs/dbraw/zinc/16/58/75/1043165875.db2.gz GASXFJKXRMYIPJ-IBGZPJMESA-N 1 1 343.471 3.924 20 5 EHBDMO C[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1C ZINC000090095024 1043375628 /nfs/dbraw/zinc/37/56/28/1043375628.db2.gz WVBSFPKPIMBFMF-GDBMZVCRSA-N 1 1 340.427 3.576 20 5 EHBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000279625780 1044327883 /nfs/dbraw/zinc/32/78/83/1044327883.db2.gz HIJVYHRIXUSDAW-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000072556527 1126761423 /nfs/dbraw/zinc/76/14/23/1126761423.db2.gz UHOQYAYACOFMPA-CYBMUJFWSA-N 1 1 328.368 3.559 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000072556527 1126761425 /nfs/dbraw/zinc/76/14/25/1126761425.db2.gz UHOQYAYACOFMPA-CYBMUJFWSA-N 1 1 328.368 3.559 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185856052 1127163233 /nfs/dbraw/zinc/16/32/33/1127163233.db2.gz SSJGJWBGBZIDIQ-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO Cc1ccnc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302497 1127736050 /nfs/dbraw/zinc/73/60/50/1127736050.db2.gz RWQOYZXBWFEFJM-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO COc1cc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301328074 1127737235 /nfs/dbraw/zinc/73/72/35/1127737235.db2.gz JFBHYQSTXSSBJD-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO Cc1cnc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444913 1127932494 /nfs/dbraw/zinc/93/24/94/1127932494.db2.gz NRPXYXQGNBOLEV-CZUORRHYSA-N 1 1 346.456 3.855 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301602410 1128516705 /nfs/dbraw/zinc/51/67/05/1128516705.db2.gz WHTMXMGDPLJALI-WBVHZDCISA-N 1 1 340.427 3.621 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631229 1128528378 /nfs/dbraw/zinc/52/83/78/1128528378.db2.gz PQIBGQQOGIZAOX-CQSZACIVSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]CCN(C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631229 1128528382 /nfs/dbraw/zinc/52/83/82/1128528382.db2.gz PQIBGQQOGIZAOX-CQSZACIVSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000172619125 1128736710 /nfs/dbraw/zinc/73/67/10/1128736710.db2.gz JHKLFYKYDKZEEI-RDJZCZTQSA-N 1 1 347.462 3.943 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c2ncccc12 ZINC000715715945 1128810773 /nfs/dbraw/zinc/81/07/73/1128810773.db2.gz VESHJPTWEKZESQ-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@@H]1CCc2ccccc21 ZINC000595876754 1120362396 /nfs/dbraw/zinc/36/23/96/1120362396.db2.gz GFSDTZPNVRFPRO-AWEZNQCLSA-N 1 1 336.395 3.633 20 5 EHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200551 1120561497 /nfs/dbraw/zinc/56/14/97/1120561497.db2.gz OLHZXCQAFXQZPP-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200551 1120561499 /nfs/dbraw/zinc/56/14/99/1120561499.db2.gz OLHZXCQAFXQZPP-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO CC(C)(C)c1coc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000921976933 1128989434 /nfs/dbraw/zinc/98/94/34/1128989434.db2.gz VBVRBTNBFPZULP-UHFFFAOYSA-N 1 1 337.807 3.866 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663371 1121561057 /nfs/dbraw/zinc/56/10/57/1121561057.db2.gz PXQLMBNSJXFWRQ-HOCLYGCPSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663371 1121561063 /nfs/dbraw/zinc/56/10/63/1121561063.db2.gz PXQLMBNSJXFWRQ-HOCLYGCPSA-N 1 1 347.459 3.661 20 5 EHBDMO C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380209 1121596187 /nfs/dbraw/zinc/59/61/87/1121596187.db2.gz BRNLJXUGSOIIOA-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000390706934 1129016867 /nfs/dbraw/zinc/01/68/67/1129016867.db2.gz RDPSPGULIVSNFY-MRXNPFEDSA-N 1 1 341.411 3.680 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2cccc([N+](=O)[O-])c2C(C)=O)c1 ZINC000763203557 1121868823 /nfs/dbraw/zinc/86/88/23/1121868823.db2.gz NOUPQABSKSEXBD-UHFFFAOYSA-N 1 1 341.411 3.861 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[NH+](C2CC2)CC1 ZINC000301125308 1122035734 /nfs/dbraw/zinc/03/57/34/1122035734.db2.gz XZQQDMHLPHLVQF-UHFFFAOYSA-N 1 1 349.740 3.551 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151319 1122080960 /nfs/dbraw/zinc/08/09/60/1122080960.db2.gz FMJMCTOXEQPZBL-KBPBESRZSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000916151319 1122080969 /nfs/dbraw/zinc/08/09/69/1122080969.db2.gz FMJMCTOXEQPZBL-KBPBESRZSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000032791934 1122103707 /nfs/dbraw/zinc/10/37/07/1122103707.db2.gz WWFFJNWMEIPLFF-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000497118334 1122340210 /nfs/dbraw/zinc/34/02/10/1122340210.db2.gz YRTKDHWHWCLLKU-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000497118334 1122340216 /nfs/dbraw/zinc/34/02/16/1122340216.db2.gz YRTKDHWHWCLLKU-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301193509 1122449592 /nfs/dbraw/zinc/44/95/92/1122449592.db2.gz SRTZPHWGHWHIJE-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000497445805 1122554741 /nfs/dbraw/zinc/55/47/41/1122554741.db2.gz UCYFIAUODXDTLA-LJQANCHMSA-N 1 1 341.411 3.862 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917477103 1122612585 /nfs/dbraw/zinc/61/25/85/1122612585.db2.gz UGIZHFAOZKXCKW-UHFFFAOYSA-N 1 1 338.411 3.857 20 5 EHBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000132140458 1129079182 /nfs/dbraw/zinc/07/91/82/1129079182.db2.gz AAHOKDRFKIZMHL-HNNXBMFYSA-N 1 1 346.358 3.747 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894617 1123171901 /nfs/dbraw/zinc/17/19/01/1123171901.db2.gz CLXAZBCJPHOICK-GOSISDBHSA-N 1 1 342.439 3.754 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)C1 ZINC000195508836 1123494592 /nfs/dbraw/zinc/49/45/92/1123494592.db2.gz AFGQTDSTUBNPGS-CYBMUJFWSA-N 1 1 346.456 3.895 20 5 EHBDMO C[N@H+](Cc1ccc2c(c1)OCCO2)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704880 1123647720 /nfs/dbraw/zinc/64/77/20/1123647720.db2.gz ZQPJJSXCIANEOS-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704880 1123647725 /nfs/dbraw/zinc/64/77/25/1123647725.db2.gz ZQPJJSXCIANEOS-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000609891358 1123687784 /nfs/dbraw/zinc/68/77/84/1123687784.db2.gz AHPAYYPYGNLCNX-BETUJISGSA-N 1 1 340.855 3.813 20 5 EHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610003614 1123711272 /nfs/dbraw/zinc/71/12/72/1123711272.db2.gz BNJCNQBRFPCKOU-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610004144 1123712201 /nfs/dbraw/zinc/71/22/01/1123712201.db2.gz BDXCKDUTKZCWMP-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610004144 1123712204 /nfs/dbraw/zinc/71/22/04/1123712204.db2.gz BDXCKDUTKZCWMP-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000615836102 1123885444 /nfs/dbraw/zinc/88/54/44/1123885444.db2.gz RUKGBZQQDZSVIL-RVDMUPIBSA-N 1 1 338.407 3.805 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301837153 1129169095 /nfs/dbraw/zinc/16/90/95/1129169095.db2.gz MKASNDFHOUXTGE-DZGCQCFKSA-N 1 1 332.791 3.501 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)CCc1ccccc1)C1CC1 ZINC000182554146 1125332867 /nfs/dbraw/zinc/33/28/67/1125332867.db2.gz QCEKDTMXUVHHNW-LJQANCHMSA-N 1 1 340.423 3.553 20 5 EHBDMO Cn1nccc1[C@H]1CCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000619612792 1125370142 /nfs/dbraw/zinc/37/01/42/1125370142.db2.gz KHUZSWLKXFXYMR-XOWYPZSQSA-N 1 1 326.400 3.569 20 5 EHBDMO Cn1nccc1[C@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000619612792 1125370145 /nfs/dbraw/zinc/37/01/45/1125370145.db2.gz KHUZSWLKXFXYMR-XOWYPZSQSA-N 1 1 326.400 3.569 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430033079 1129486135 /nfs/dbraw/zinc/48/61/35/1129486135.db2.gz IXUNDSIQSUVCQC-HYXAFXHYSA-N 1 1 340.276 3.954 20 5 EHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093324610 1129584601 /nfs/dbraw/zinc/58/46/01/1129584601.db2.gz TUXPZXDSCXWWDG-ZKKXHLJNSA-N 1 1 326.396 3.877 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1(O)CCCC1 ZINC000093503093 1129590951 /nfs/dbraw/zinc/59/09/51/1129590951.db2.gz RNPAIJUVIQHVET-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280987 1129658775 /nfs/dbraw/zinc/65/87/75/1129658775.db2.gz UPNMSOQLMODUQD-CABCVRRESA-N 1 1 347.459 3.530 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000156016908 1129688410 /nfs/dbraw/zinc/68/84/10/1129688410.db2.gz MVMGVWLHCOVKHT-IBGZPJMESA-N 1 1 344.386 3.507 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000156016908 1129688412 /nfs/dbraw/zinc/68/84/12/1129688412.db2.gz MVMGVWLHCOVKHT-IBGZPJMESA-N 1 1 344.386 3.507 20 5 EHBDMO COc1cc(C[N@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000125425741 1129691180 /nfs/dbraw/zinc/69/11/80/1129691180.db2.gz VDAAURZHYBCDJY-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000125425741 1129691184 /nfs/dbraw/zinc/69/11/84/1129691184.db2.gz VDAAURZHYBCDJY-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302048239 1129765357 /nfs/dbraw/zinc/76/53/57/1129765357.db2.gz WBNDXYWYDRTLAO-JTQLQIEISA-N 1 1 332.231 3.680 20 5 EHBDMO C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302051574 1129765889 /nfs/dbraw/zinc/76/58/89/1129765889.db2.gz OCOCNFJNRACJEQ-RYUDHWBXSA-N 1 1 338.839 3.708 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]3C3CCCC3)n2)c1 ZINC000055927423 1129790249 /nfs/dbraw/zinc/79/02/49/1129790249.db2.gz OVLWPJLRCGIEKS-INIZCTEOSA-N 1 1 342.399 3.799 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303532712 1129852398 /nfs/dbraw/zinc/85/23/98/1129852398.db2.gz GEDUDFAOOCLTPT-BEFAXECRSA-N 1 1 343.427 3.744 20 5 EHBDMO CCc1ccc([C@H](COC)[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000174479738 1130361771 /nfs/dbraw/zinc/36/17/71/1130361771.db2.gz UEBTUXYUXFFQNN-BVBGJJFLSA-N 1 1 330.384 3.741 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H]2c2cccc3ccccc32)c1 ZINC000174833018 1130386957 /nfs/dbraw/zinc/38/69/57/1130386957.db2.gz DUOMBLPKKHZNSN-LJQANCHMSA-N 1 1 336.395 3.782 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831174 1130387376 /nfs/dbraw/zinc/38/73/76/1130387376.db2.gz PDIBPQNVRMVQPY-GFCCVEGCSA-N 1 1 334.807 3.670 20 5 EHBDMO CC[NH+](CC)[C@H](C(=O)OCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000731907050 1130860357 /nfs/dbraw/zinc/86/03/57/1130860357.db2.gz DNOJMOVKPPSGEE-SFHVURJKSA-N 1 1 342.395 3.721 20 5 EHBDMO CC[NH+](CC)[C@@H](C(=O)OCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000731907048 1130860389 /nfs/dbraw/zinc/86/03/89/1130860389.db2.gz DNOJMOVKPPSGEE-GOSISDBHSA-N 1 1 342.395 3.721 20 5 EHBDMO CC[NH+](CC)C1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918201 1131904134 /nfs/dbraw/zinc/90/41/34/1131904134.db2.gz YXVJFGYUSACLML-GOSISDBHSA-N 1 1 345.487 3.648 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381061 1131914441 /nfs/dbraw/zinc/91/44/41/1131914441.db2.gz TUJABFOPVRSLDP-GOEBONIOSA-N 1 1 343.431 3.711 20 5 EHBDMO CC(C)[N@@H+](CCCCCO)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911729 1131917971 /nfs/dbraw/zinc/91/79/71/1131917971.db2.gz FJCHCDHFGOAADN-GOSISDBHSA-N 1 1 334.460 3.715 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2cccs2)c1F ZINC001173188542 1131994118 /nfs/dbraw/zinc/99/41/18/1131994118.db2.gz GMRNPVRCDZFWKS-LLVKDONJSA-N 1 1 338.404 3.867 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](CF)(C(F)(F)F)C1 ZINC001173221260 1132004238 /nfs/dbraw/zinc/00/42/38/1132004238.db2.gz GSEJDXUPRPRGAE-SMDDNHRTSA-N 1 1 334.313 3.750 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](CC(=O)OC(C)(C)C)C1 ZINC001173230817 1132008997 /nfs/dbraw/zinc/00/89/97/1132008997.db2.gz GXZQIZWNHXLRFP-GDBMZVCRSA-N 1 1 348.443 3.580 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](Cc1ccccc1)CC(C)(C)O ZINC001173233477 1132010746 /nfs/dbraw/zinc/01/07/46/1132010746.db2.gz WWWHLNQGGWCBTB-MRXNPFEDSA-N 1 1 342.439 3.799 20 5 EHBDMO CCCCN1CCC([N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238744 1132027245 /nfs/dbraw/zinc/02/72/45/1132027245.db2.gz XFENHIRWJCVSFV-INIZCTEOSA-N 1 1 333.476 3.722 20 5 EHBDMO CCCCN1CCC([N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238744 1132027250 /nfs/dbraw/zinc/02/72/50/1132027250.db2.gz XFENHIRWJCVSFV-INIZCTEOSA-N 1 1 333.476 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(F)c(F)cc2C1 ZINC001173238450 1132027897 /nfs/dbraw/zinc/02/78/97/1132027897.db2.gz SRZKTLDQYUELGT-GFCCVEGCSA-N 1 1 332.350 3.862 20 5 EHBDMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169045709 1132640863 /nfs/dbraw/zinc/64/08/63/1132640863.db2.gz JTISPAKFDIDFTR-DZGCQCFKSA-N 1 1 330.350 3.973 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2cccc(F)c2)CC1 ZINC001175453410 1132686387 /nfs/dbraw/zinc/68/63/87/1132686387.db2.gz KRPVSDRPUMZTGJ-HNNXBMFYSA-N 1 1 343.402 3.926 20 5 EHBDMO CC[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001169495399 1132771366 /nfs/dbraw/zinc/77/13/66/1132771366.db2.gz RGIBIXISCNJULE-MNOVXSKESA-N 1 1 327.222 3.978 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761575 1133048434 /nfs/dbraw/zinc/04/84/34/1133048434.db2.gz BGMBBGSIXKPNTB-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000767763361 1133048980 /nfs/dbraw/zinc/04/89/80/1133048980.db2.gz NYCKIMSULXIYGD-SFHVURJKSA-N 1 1 342.443 3.853 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941490 1133073732 /nfs/dbraw/zinc/07/37/32/1133073732.db2.gz RWUSEZAKLCKDED-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2cccc(Cl)c2)C2CC2)c1 ZINC000768544274 1133157875 /nfs/dbraw/zinc/15/78/75/1133157875.db2.gz KUXCNTBBHQELRU-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1[nH]c(CNC(=O)c2cc3ccccc3c3cccnc23)c(C)[nH+]1 ZINC001178441601 1133164279 /nfs/dbraw/zinc/16/42/79/1133164279.db2.gz MTZVTWMHCHAGAK-UHFFFAOYSA-N 1 1 330.391 3.658 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000770666408 1133457226 /nfs/dbraw/zinc/45/72/26/1133457226.db2.gz VRDMCBZDTJAZOP-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000770666408 1133457227 /nfs/dbraw/zinc/45/72/27/1133457227.db2.gz VRDMCBZDTJAZOP-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001182327207 1133634165 /nfs/dbraw/zinc/63/41/65/1133634165.db2.gz QCMOPJHWXLYMDT-CQSZACIVSA-N 1 1 345.365 3.528 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774519269 1133702711 /nfs/dbraw/zinc/70/27/11/1133702711.db2.gz WLRZXSHHTDXFCL-UKRRQHHQSA-N 1 1 329.375 3.981 20 5 EHBDMO Cc1cc(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC001185148878 1134047124 /nfs/dbraw/zinc/04/71/24/1134047124.db2.gz IOIYOSFDCHOFQC-CQSZACIVSA-N 1 1 343.402 3.901 20 5 EHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873511 1134089092 /nfs/dbraw/zinc/08/90/92/1134089092.db2.gz JGAUFQWRAYTOEC-CQSZACIVSA-N 1 1 341.367 3.801 20 5 EHBDMO CCOc1cc(NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187063690 1134291709 /nfs/dbraw/zinc/29/17/09/1134291709.db2.gz LXQTVXPCBATOPX-INIZCTEOSA-N 1 1 333.432 3.812 20 5 EHBDMO Cc1cc(N2CC[N@H+](C)C(C)(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001187189666 1134307401 /nfs/dbraw/zinc/30/74/01/1134307401.db2.gz FVHAQDBQWXOQEL-UHFFFAOYSA-N 1 1 345.365 3.843 20 5 EHBDMO C[C@@H]1C[N@H+](CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000791412125 1134547404 /nfs/dbraw/zinc/54/74/04/1134547404.db2.gz BRMQVSUTVWYIKW-BETUJISGSA-N 1 1 341.839 3.550 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326629 1134748431 /nfs/dbraw/zinc/74/84/31/1134748431.db2.gz AVXJPVCKUHXAPD-CQSZACIVSA-N 1 1 326.396 3.593 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCOC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170353159 1134753596 /nfs/dbraw/zinc/75/35/96/1134753596.db2.gz WWRKEEXHVTYJEA-OAHLLOKOSA-N 1 1 348.443 3.570 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170343562 1134758749 /nfs/dbraw/zinc/75/87/49/1134758749.db2.gz QPPZNACNPCTFHY-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346415 1134760053 /nfs/dbraw/zinc/76/00/53/1134760053.db2.gz NMMLDMXVCYYKEB-KSSFIOAISA-N 1 1 341.411 3.767 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])c1 ZINC000804373218 1135049826 /nfs/dbraw/zinc/04/98/26/1135049826.db2.gz QVGLKKITSVVNAM-UHFFFAOYSA-N 1 1 344.371 3.567 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000804564495 1135121539 /nfs/dbraw/zinc/12/15/39/1135121539.db2.gz WWXZAOGNVYCPLP-IUODEOHRSA-N 1 1 335.835 3.701 20 5 EHBDMO C[N@@H+](CCSc1c([N+](=O)[O-])cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000804674193 1135164285 /nfs/dbraw/zinc/16/42/85/1135164285.db2.gz OKNQRONPQYUGEB-UHFFFAOYSA-N 1 1 347.396 3.727 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000805804981 1135334628 /nfs/dbraw/zinc/33/46/28/1135334628.db2.gz XDFUYPOKPFXCOX-WWGRRREGSA-N 1 1 349.431 3.643 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000805804981 1135334632 /nfs/dbraw/zinc/33/46/32/1135334632.db2.gz XDFUYPOKPFXCOX-WWGRRREGSA-N 1 1 349.431 3.643 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC001196450619 1135568196 /nfs/dbraw/zinc/56/81/96/1135568196.db2.gz FNKARSSWVUBFMT-CQSZACIVSA-N 1 1 330.428 3.855 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)c(F)c1 ZINC001197283387 1135672862 /nfs/dbraw/zinc/67/28/62/1135672862.db2.gz BHKRZLWOBZZZHT-OAHLLOKOSA-N 1 1 336.407 3.763 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C1(Cc2ccccc2)CCCC1 ZINC001197565759 1135706761 /nfs/dbraw/zinc/70/67/61/1135706761.db2.gz XYFFPMVMSGNSQX-UHFFFAOYSA-N 1 1 342.443 3.587 20 5 EHBDMO C[N@H+]1C[C@@]23CN(Cc4ccc(Cl)c([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001198821321 1135859645 /nfs/dbraw/zinc/85/96/45/1135859645.db2.gz QTKLPQZHFGASLZ-HDICACEKSA-N 1 1 349.862 3.556 20 5 EHBDMO CCOCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000809689351 1135872133 /nfs/dbraw/zinc/87/21/33/1135872133.db2.gz YQMMVPHBOATUQZ-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO C[N@@H+]1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006291 1135913097 /nfs/dbraw/zinc/91/30/97/1135913097.db2.gz IONOOZLGSUXEGB-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006291 1135913098 /nfs/dbraw/zinc/91/30/98/1135913098.db2.gz IONOOZLGSUXEGB-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO CC(C)c1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810836980 1136011999 /nfs/dbraw/zinc/01/19/99/1136011999.db2.gz JQJQZJOYOGOLAM-HUUCEWRRSA-N 1 1 332.400 3.502 20 5 EHBDMO C[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000811484366 1136091736 /nfs/dbraw/zinc/09/17/36/1136091736.db2.gz VJUBXPBZFORUOO-JOYOIKCWSA-N 1 1 344.242 3.616 20 5 EHBDMO C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484366 1136091739 /nfs/dbraw/zinc/09/17/39/1136091739.db2.gz VJUBXPBZFORUOO-JOYOIKCWSA-N 1 1 344.242 3.616 20 5 EHBDMO CC[C@H]1c2ccsc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275027 1136129156 /nfs/dbraw/zinc/12/91/56/1136129156.db2.gz FOMIBXORJSPDOV-HOTGVXAUSA-N 1 1 332.425 3.699 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274369 1136129395 /nfs/dbraw/zinc/12/93/95/1136129395.db2.gz HFTLOTDYQPDFFQ-GTNSWQLSSA-N 1 1 336.338 3.599 20 5 EHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812854325 1136262686 /nfs/dbraw/zinc/26/26/86/1136262686.db2.gz XEZHGCFAYGZBHH-ACJLOTCBSA-N 1 1 332.375 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c(F)c1 ZINC000747840759 1136306975 /nfs/dbraw/zinc/30/69/75/1136306975.db2.gz SRKSQGUKILHNLQ-MOPGFXCFSA-N 1 1 344.386 3.822 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)CC2)cc1 ZINC000776582460 1136442147 /nfs/dbraw/zinc/44/21/47/1136442147.db2.gz UQSAUXLICLMWSP-YLJYHZDGSA-N 1 1 340.423 3.898 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585016 1136442177 /nfs/dbraw/zinc/44/21/77/1136442177.db2.gz QXZCMFQLLSPSJU-MDYRTPRTSA-N 1 1 340.423 3.815 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586084 1136445515 /nfs/dbraw/zinc/44/55/15/1136445515.db2.gz JLVZGAKNDBVMJS-AZUAARDMSA-N 1 1 342.439 3.971 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588187 1136446007 /nfs/dbraw/zinc/44/60/07/1136446007.db2.gz MDZFVILGWLIJNP-VMDGZTHMSA-N 1 1 344.386 3.850 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000818208265 1136865894 /nfs/dbraw/zinc/86/58/94/1136865894.db2.gz GWIJXPIPNNRRTJ-UHFFFAOYSA-N 1 1 348.374 3.624 20 5 EHBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000844255979 1137208318 /nfs/dbraw/zinc/20/83/18/1137208318.db2.gz UTSJGJGGZPBURE-CQSZACIVSA-N 1 1 339.395 3.543 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872019140 1137564833 /nfs/dbraw/zinc/56/48/33/1137564833.db2.gz TZPMUGNVTGSGPD-NWDGAFQWSA-N 1 1 346.358 3.917 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000872022239 1137565236 /nfs/dbraw/zinc/56/52/36/1137565236.db2.gz IHPGXFXMNTWRCD-MAZHCROVSA-N 1 1 335.473 3.594 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000872024721 1137565515 /nfs/dbraw/zinc/56/55/15/1137565515.db2.gz DMSVBAHCYGUJDE-BFHYXJOUSA-N 1 1 335.473 3.594 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000872024723 1137565594 /nfs/dbraw/zinc/56/55/94/1137565594.db2.gz DMSVBAHCYGUJDE-MELADBBJSA-N 1 1 335.473 3.594 20 5 EHBDMO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039955 1137567050 /nfs/dbraw/zinc/56/70/50/1137567050.db2.gz WVDWBVCZCYYJPO-CZUORRHYSA-N 1 1 332.375 3.898 20 5 EHBDMO COc1ccc(COCC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872046649 1137567586 /nfs/dbraw/zinc/56/75/86/1137567586.db2.gz KBRIDCGJPDKKTB-ZDUSSCGKSA-N 1 1 348.374 3.610 20 5 EHBDMO COc1ccc([C@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C2CC2)cn1 ZINC000872090961 1137570732 /nfs/dbraw/zinc/57/07/32/1137570732.db2.gz GHBAGEIXHQUDTQ-BBATYDOGSA-N 1 1 345.374 3.939 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nccnc2C)cc1[N+](=O)[O-] ZINC000872132423 1137573314 /nfs/dbraw/zinc/57/33/14/1137573314.db2.gz FUVGTGFHTSFFNE-WCQYABFASA-N 1 1 330.388 3.504 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000877553515 1137681072 /nfs/dbraw/zinc/68/10/72/1137681072.db2.gz UPJCMYMJBBAWMB-GOSISDBHSA-N 1 1 330.428 3.603 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690529 1137755323 /nfs/dbraw/zinc/75/53/23/1137755323.db2.gz XVTKUSFISZLCQM-HOCLYGCPSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690529 1137755324 /nfs/dbraw/zinc/75/53/24/1137755324.db2.gz XVTKUSFISZLCQM-HOCLYGCPSA-N 1 1 338.411 3.535 20 5 EHBDMO Cc1csc([C@@H]2CC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)n1 ZINC000880011191 1137765409 /nfs/dbraw/zinc/76/54/09/1137765409.db2.gz IPENCFUGZLSFIT-SNVBAGLBSA-N 1 1 339.367 3.627 20 5 EHBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)n1 ZINC000880011191 1137765410 /nfs/dbraw/zinc/76/54/10/1137765410.db2.gz IPENCFUGZLSFIT-SNVBAGLBSA-N 1 1 339.367 3.627 20 5 EHBDMO C[C@H]1c2sccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376968 1137777027 /nfs/dbraw/zinc/77/70/27/1137777027.db2.gz NBDHJYBJCBLCOW-LBPRGKRZSA-N 1 1 345.424 3.604 20 5 EHBDMO COc1ccc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000106877815 1137884754 /nfs/dbraw/zinc/88/47/54/1137884754.db2.gz ZLPLOZYPIVFDKT-LLVKDONJSA-N 1 1 335.429 3.870 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000106877815 1137884755 /nfs/dbraw/zinc/88/47/55/1137884755.db2.gz ZLPLOZYPIVFDKT-LLVKDONJSA-N 1 1 335.429 3.870 20 5 EHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000106876526 1137884867 /nfs/dbraw/zinc/88/48/67/1137884867.db2.gz FYLJRFXMKUTUMQ-GFCCVEGCSA-N 1 1 335.429 3.740 20 5 EHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287541 1137900153 /nfs/dbraw/zinc/90/01/53/1137900153.db2.gz UUPQLSVEJGNSPO-WPRPVWTQSA-N 1 1 329.278 3.509 20 5 EHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287541 1137900154 /nfs/dbraw/zinc/90/01/54/1137900154.db2.gz UUPQLSVEJGNSPO-WPRPVWTQSA-N 1 1 329.278 3.509 20 5 EHBDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000332200169 1137935362 /nfs/dbraw/zinc/93/53/62/1137935362.db2.gz BYDUUWRGQKTCHK-CYBMUJFWSA-N 1 1 326.824 3.887 20 5 EHBDMO CN(C)C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915562 1137952025 /nfs/dbraw/zinc/95/20/25/1137952025.db2.gz VKQITJVTLWLCER-QGZVFWFLSA-N 1 1 333.819 3.641 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1ccc(Cl)cc1)C1CC1 ZINC000135226348 1137964755 /nfs/dbraw/zinc/96/47/55/1137964755.db2.gz FNCXHPUHIQDXAF-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886112232 1138047892 /nfs/dbraw/zinc/04/78/92/1138047892.db2.gz RYIDENFFAHWDBX-INIZCTEOSA-N 1 1 329.400 3.875 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000886111961 1138047925 /nfs/dbraw/zinc/04/79/25/1138047925.db2.gz LZZAYYYSBGGBPC-LBPRGKRZSA-N 1 1 345.374 3.769 20 5 EHBDMO Cc1csc(C[C@@H]2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000886696266 1138117655 /nfs/dbraw/zinc/11/76/55/1138117655.db2.gz KKBMCWCGAMXKII-LBPRGKRZSA-N 1 1 337.470 3.876 20 5 EHBDMO Cc1csc(C[C@@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000886696266 1138117656 /nfs/dbraw/zinc/11/76/56/1138117656.db2.gz KKBMCWCGAMXKII-LBPRGKRZSA-N 1 1 337.470 3.876 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000078336239 1138148566 /nfs/dbraw/zinc/14/85/66/1138148566.db2.gz QIEPJEJPUKYPFO-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO CC1(C)C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089909057 1138207428 /nfs/dbraw/zinc/20/74/28/1138207428.db2.gz INBLITDWYXCWFE-UHFFFAOYSA-N 1 1 333.413 3.577 20 5 EHBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089909057 1138207430 /nfs/dbraw/zinc/20/74/30/1138207430.db2.gz INBLITDWYXCWFE-UHFFFAOYSA-N 1 1 333.413 3.577 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758834 1138421270 /nfs/dbraw/zinc/42/12/70/1138421270.db2.gz VOSRONDVTTYQQS-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758834 1138421272 /nfs/dbraw/zinc/42/12/72/1138421272.db2.gz VOSRONDVTTYQQS-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1O ZINC000182747610 1139989740 /nfs/dbraw/zinc/98/97/40/1139989740.db2.gz JMRRIISHKBMBTK-CYBMUJFWSA-N 1 1 330.384 3.810 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000191358783 1140458367 /nfs/dbraw/zinc/45/83/67/1140458367.db2.gz QCTOHYTWOFEJFZ-OAHLLOKOSA-N 1 1 348.447 3.550 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CCCc4c[nH]nc43)o2)c1 ZINC000268861395 1141010956 /nfs/dbraw/zinc/01/09/56/1141010956.db2.gz SEZQRQRNEWZPQY-INIZCTEOSA-N 1 1 338.367 3.745 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269672667 1141134329 /nfs/dbraw/zinc/13/43/29/1141134329.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 1 1 329.444 3.605 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684241 1141135590 /nfs/dbraw/zinc/13/55/90/1141135590.db2.gz SHZCKIMIUIZJOO-ROUUACIJSA-N 1 1 330.359 3.604 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891852 1141280447 /nfs/dbraw/zinc/28/04/47/1141280447.db2.gz PGJQAJVQSXMVLO-JSGCOSHPSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891852 1141280453 /nfs/dbraw/zinc/28/04/53/1141280453.db2.gz PGJQAJVQSXMVLO-JSGCOSHPSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891852 1141280457 /nfs/dbraw/zinc/28/04/57/1141280457.db2.gz PGJQAJVQSXMVLO-JSGCOSHPSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891854 1141280813 /nfs/dbraw/zinc/28/08/13/1141280813.db2.gz PGJQAJVQSXMVLO-TZMCWYRMSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891854 1141280820 /nfs/dbraw/zinc/28/08/20/1141280820.db2.gz PGJQAJVQSXMVLO-TZMCWYRMSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891854 1141280823 /nfs/dbraw/zinc/28/08/23/1141280823.db2.gz PGJQAJVQSXMVLO-TZMCWYRMSA-N 1 1 341.415 3.531 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000271650812 1141412389 /nfs/dbraw/zinc/41/23/89/1141412389.db2.gz VBIJGUSTKBHLAS-QWHCGFSZSA-N 1 1 345.374 3.720 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137753 1141506851 /nfs/dbraw/zinc/50/68/51/1141506851.db2.gz GBVYMPDFSRTHBX-DGCLKSJQSA-N 1 1 346.349 3.739 20 5 EHBDMO CN(CCC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccco1 ZINC000348819054 1141587266 /nfs/dbraw/zinc/58/72/66/1141587266.db2.gz VRAGQUXJJOLYPR-WEVVVXLNSA-N 1 1 343.427 3.655 20 5 EHBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])CCC[N@H+](C)Cc1ccco1 ZINC000348819054 1141587271 /nfs/dbraw/zinc/58/72/71/1141587271.db2.gz VRAGQUXJJOLYPR-WEVVVXLNSA-N 1 1 343.427 3.655 20 5 EHBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])CCC[N@@H+](C)Cc1ccco1 ZINC000348819054 1141587274 /nfs/dbraw/zinc/58/72/74/1141587274.db2.gz VRAGQUXJJOLYPR-WEVVVXLNSA-N 1 1 343.427 3.655 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000032801170 1015735626 /nfs/dbraw/zinc/73/56/26/1015735626.db2.gz YHGWVTSDARVQOK-VXGBXAGGSA-N 1 1 347.802 3.926 20 5 EHBDMO COc1cnccc1[C@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000189569562 1016535979 /nfs/dbraw/zinc/53/59/79/1016535979.db2.gz NPICOWJLBWQMIF-ZDUSSCGKSA-N 1 1 329.400 3.973 20 5 EHBDMO Cc1nc([C@H]2CCC[N@@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000189828422 1016735336 /nfs/dbraw/zinc/73/53/36/1016735336.db2.gz HGZWZOGGAVKCQJ-QGZVFWFLSA-N 1 1 347.440 3.966 20 5 EHBDMO Cc1nc([C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000189828422 1016735347 /nfs/dbraw/zinc/73/53/47/1016735347.db2.gz HGZWZOGGAVKCQJ-QGZVFWFLSA-N 1 1 347.440 3.966 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnn2C2CCCC2)c(Cl)c1 ZINC000449249611 1032354611 /nfs/dbraw/zinc/35/46/11/1032354611.db2.gz MGBCTYHXZKDBGD-UHFFFAOYSA-N 1 1 334.807 3.850 20 5 EHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000449280917 1032401208 /nfs/dbraw/zinc/40/12/08/1032401208.db2.gz YIPLSXVSLUIVJF-VXGBXAGGSA-N 1 1 332.404 3.557 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](CO)c1ccccc1 ZINC000449460827 1032577296 /nfs/dbraw/zinc/57/72/96/1032577296.db2.gz ZYNGXDJNWKVRJB-FERCGXDMSA-N 1 1 326.396 3.664 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc4ccccc4[nH]3)C2)cc1 ZINC000449498466 1032670817 /nfs/dbraw/zinc/67/08/17/1032670817.db2.gz KQFRZHRTBMIZHS-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4ccccc4[nH]3)C2)cc1 ZINC000449498466 1032670828 /nfs/dbraw/zinc/67/08/28/1032670828.db2.gz KQFRZHRTBMIZHS-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449503708 1032686121 /nfs/dbraw/zinc/68/61/21/1032686121.db2.gz POYAAWOOLDDRTH-DYVFJYSZSA-N 1 1 330.384 3.712 20 5 EHBDMO CC1(C)C[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414974010 1017365220 /nfs/dbraw/zinc/36/52/20/1017365220.db2.gz NJWMUQGEAKZSIS-QGZVFWFLSA-N 1 1 345.468 3.801 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)o1 ZINC000377237749 1017514299 /nfs/dbraw/zinc/51/42/99/1017514299.db2.gz JFZQRUOEUOTLIW-HUUCEWRRSA-N 1 1 342.395 3.713 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610341087 1018330182 /nfs/dbraw/zinc/33/01/82/1018330182.db2.gz XMZTUPMBXOFANF-RYUDHWBXSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610341087 1018330193 /nfs/dbraw/zinc/33/01/93/1018330193.db2.gz XMZTUPMBXOFANF-RYUDHWBXSA-N 1 1 332.322 3.699 20 5 EHBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054153354 1019061019 /nfs/dbraw/zinc/06/10/19/1019061019.db2.gz YCHJSQFKVIGGOY-UHFFFAOYSA-N 1 1 345.424 3.507 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000255495203 1019248537 /nfs/dbraw/zinc/24/85/37/1019248537.db2.gz BIQNSRBUGIDAHR-VORVDVFJSA-N 1 1 338.407 3.590 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275628 1019495139 /nfs/dbraw/zinc/49/51/39/1019495139.db2.gz HYSAHOFXEUBUCS-RDTXWAMCSA-N 1 1 339.395 3.616 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275628 1019495149 /nfs/dbraw/zinc/49/51/49/1019495149.db2.gz HYSAHOFXEUBUCS-RDTXWAMCSA-N 1 1 339.395 3.616 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412990 1019643612 /nfs/dbraw/zinc/64/36/12/1019643612.db2.gz FQJGSDCNOXFQJS-KRZKXXONSA-N 1 1 348.406 3.905 20 5 EHBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922883 1020243499 /nfs/dbraw/zinc/24/34/99/1020243499.db2.gz GDFGLRSNFKFCJM-LSDHHAIUSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@H]1C[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000602476365 1032897300 /nfs/dbraw/zinc/89/73/00/1032897300.db2.gz OLGYSPIGJQYKQT-FZMZJTMJSA-N 1 1 345.365 3.528 20 5 EHBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602467017 1032903240 /nfs/dbraw/zinc/90/32/40/1032903240.db2.gz CKYQHVQUDZVJQF-GFCCVEGCSA-N 1 1 346.349 3.862 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651992 1020567353 /nfs/dbraw/zinc/56/73/53/1020567353.db2.gz ZGZXJYCHAWXCHH-GOSISDBHSA-N 1 1 345.399 3.641 20 5 EHBDMO CCOCc1ccccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602512803 1032951479 /nfs/dbraw/zinc/95/14/79/1032951479.db2.gz UQHACQHNPAUTJO-UHFFFAOYSA-N 1 1 341.367 3.562 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cs1 ZINC000054173354 1021294081 /nfs/dbraw/zinc/29/40/81/1021294081.db2.gz QLZOBBWINYIHSE-UHFFFAOYSA-N 1 1 349.431 3.503 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506046362 1021812442 /nfs/dbraw/zinc/81/24/42/1021812442.db2.gz VNRZPTZISIUMHT-UHFFFAOYSA-N 1 1 328.368 3.654 20 5 EHBDMO COc1cccc2c1CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000426579134 1021967974 /nfs/dbraw/zinc/96/79/74/1021967974.db2.gz KNLYAZUUHCZSHE-YVMONPNESA-N 1 1 338.407 3.717 20 5 EHBDMO COc1cccc2c1CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000426579133 1021968631 /nfs/dbraw/zinc/96/86/31/1021968631.db2.gz KNLYAZUUHCZSHE-VMPITWQZSA-N 1 1 338.407 3.717 20 5 EHBDMO CC(C)[N@@H+](Cc1cnn(C)c1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891626379 1022148142 /nfs/dbraw/zinc/14/81/42/1022148142.db2.gz XNDQEPPZRHMRKN-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO COc1ccc(C[N@@H+](C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000438252014 1022504905 /nfs/dbraw/zinc/50/49/05/1022504905.db2.gz BEIHGJURLWTNHO-UHFFFAOYSA-N 1 1 326.396 3.767 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000517632150 1022510238 /nfs/dbraw/zinc/51/02/38/1022510238.db2.gz VWVVJZDGSWEXMV-UHFFFAOYSA-N 1 1 348.447 3.543 20 5 EHBDMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989792 1022591803 /nfs/dbraw/zinc/59/18/03/1022591803.db2.gz UPMAWLYMMKCBOQ-TZMCWYRMSA-N 1 1 332.425 3.526 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])cc1F ZINC000550208974 1022736759 /nfs/dbraw/zinc/73/67/59/1022736759.db2.gz DMIINWVJRNDZDV-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])cc1F ZINC000550208974 1022736767 /nfs/dbraw/zinc/73/67/67/1022736767.db2.gz DMIINWVJRNDZDV-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675772 1033078132 /nfs/dbraw/zinc/07/81/32/1033078132.db2.gz NEQNHMIFNNKDIG-ZJUUUORDSA-N 1 1 343.305 3.899 20 5 EHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675772 1033078144 /nfs/dbraw/zinc/07/81/44/1033078144.db2.gz NEQNHMIFNNKDIG-ZJUUUORDSA-N 1 1 343.305 3.899 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@H]43)o2)cc1 ZINC000510665884 1022852099 /nfs/dbraw/zinc/85/20/99/1022852099.db2.gz SQWLWQWDAZEUHB-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@H]43)o2)cc1 ZINC000510665884 1022852119 /nfs/dbraw/zinc/85/21/19/1022852119.db2.gz SQWLWQWDAZEUHB-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c1 ZINC000510694442 1022907646 /nfs/dbraw/zinc/90/76/46/1022907646.db2.gz XYVISZPRJMVFIA-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c1 ZINC000510694442 1022907654 /nfs/dbraw/zinc/90/76/54/1022907654.db2.gz XYVISZPRJMVFIA-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000165790044 1033102151 /nfs/dbraw/zinc/10/21/51/1033102151.db2.gz MEIGGUNSUAUMTD-GOSISDBHSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1cccc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)n21 ZINC000507167657 1023159524 /nfs/dbraw/zinc/15/95/24/1023159524.db2.gz NKPFJCPWLSIFMV-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1cccc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)n21 ZINC000507167657 1023159531 /nfs/dbraw/zinc/15/95/31/1023159531.db2.gz NKPFJCPWLSIFMV-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000610773963 1023495080 /nfs/dbraw/zinc/49/50/80/1023495080.db2.gz YWZYYXNQFOUNCE-MRXNPFEDSA-N 1 1 342.395 3.647 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc(F)cc2[N+](=O)[O-])cc1F ZINC000063254744 1033143551 /nfs/dbraw/zinc/14/35/51/1033143551.db2.gz JHIIOFTVLUXFHP-UHFFFAOYSA-N 1 1 344.321 3.979 20 5 EHBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610845668 1023788160 /nfs/dbraw/zinc/78/81/60/1023788160.db2.gz DASJTARBDBJUOD-JKSUJKDBSA-N 1 1 347.415 3.762 20 5 EHBDMO CCOc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000610865011 1023809883 /nfs/dbraw/zinc/80/98/83/1023809883.db2.gz HRJYBIBVZJYJCH-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000610865011 1023809891 /nfs/dbraw/zinc/80/98/91/1023809891.db2.gz HRJYBIBVZJYJCH-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000119467394 1024287674 /nfs/dbraw/zinc/28/76/74/1024287674.db2.gz MZKHQXOWBUIZSC-ZDUSSCGKSA-N 1 1 347.440 3.814 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000119467394 1024287683 /nfs/dbraw/zinc/28/76/83/1024287683.db2.gz MZKHQXOWBUIZSC-ZDUSSCGKSA-N 1 1 347.440 3.814 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000190698753 1024352615 /nfs/dbraw/zinc/35/26/15/1024352615.db2.gz VBHDDMHAJKEXNN-JTQLQIEISA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000190698753 1024352635 /nfs/dbraw/zinc/35/26/35/1024352635.db2.gz VBHDDMHAJKEXNN-JTQLQIEISA-N 1 1 332.372 3.524 20 5 EHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328656 1033208300 /nfs/dbraw/zinc/20/83/00/1033208300.db2.gz OJUDZPUOKTVGOI-SFHVURJKSA-N 1 1 329.400 3.539 20 5 EHBDMO Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000507796906 1024424433 /nfs/dbraw/zinc/42/44/33/1024424433.db2.gz OJTRLODBPUKXIC-CQSZACIVSA-N 1 1 346.818 3.638 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CC2 ZINC000485217492 1024472003 /nfs/dbraw/zinc/47/20/03/1024472003.db2.gz JKTJUYWQNPIPFN-UHFFFAOYSA-N 1 1 343.349 3.678 20 5 EHBDMO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000342243813 1024543194 /nfs/dbraw/zinc/54/31/94/1024543194.db2.gz OSHPHWCGZGLNJQ-OAHLLOKOSA-N 1 1 346.431 3.604 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000248568822 1024578845 /nfs/dbraw/zinc/57/88/45/1024578845.db2.gz CFDGOWWVLFTIAE-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000248568822 1024578855 /nfs/dbraw/zinc/57/88/55/1024578855.db2.gz CFDGOWWVLFTIAE-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(-c3cc[nH]n3)o2)C2CC2)c1 ZINC000435136290 1024646633 /nfs/dbraw/zinc/64/66/33/1024646633.db2.gz ABKYBJGTFDLMKP-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(-c3cc[nH]n3)o2)C2CC2)c1 ZINC000435136290 1024646644 /nfs/dbraw/zinc/64/66/44/1024646644.db2.gz ABKYBJGTFDLMKP-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792086 1024654231 /nfs/dbraw/zinc/65/42/31/1024654231.db2.gz XTQLEUGSPOEJPM-JQHSSLGASA-N 1 1 336.407 3.640 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2cccc(OC)c2[N+](=O)[O-])c1 ZINC000185231197 1024654538 /nfs/dbraw/zinc/65/45/38/1024654538.db2.gz OGDHOXWYQWQBNI-UHFFFAOYSA-N 1 1 329.400 3.667 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+](C)C2CCCCC2)c1C ZINC000895625066 1024671919 /nfs/dbraw/zinc/67/19/19/1024671919.db2.gz CRPGRCMSGCXFFN-UHFFFAOYSA-N 1 1 347.459 3.596 20 5 EHBDMO COC1(OC)CC2(C[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)[C@@H]2C(C)C)C1 ZINC000895994871 1025062293 /nfs/dbraw/zinc/06/22/93/1025062293.db2.gz HKEPFCOXWGIQQG-QGZVFWFLSA-N 1 1 348.443 3.513 20 5 EHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1N1CCCC1 ZINC000015573715 1025076846 /nfs/dbraw/zinc/07/68/46/1025076846.db2.gz DKCOPURVCSVRDE-UHFFFAOYSA-N 1 1 325.412 3.827 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000185438498 1025076718 /nfs/dbraw/zinc/07/67/18/1025076718.db2.gz UJIPHRYRKCZJAY-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO CCC[N@@H+](CC)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000472209568 1025749011 /nfs/dbraw/zinc/74/90/11/1025749011.db2.gz VDEJUEBLRZCHJD-UHFFFAOYSA-N 1 1 335.451 3.850 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451412186 1025946051 /nfs/dbraw/zinc/94/60/51/1025946051.db2.gz FWFSNZZCDLBFFL-KZNAEPCWSA-N 1 1 348.443 3.507 20 5 EHBDMO CCC[N@@H+](CC)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000516074594 1025955534 /nfs/dbraw/zinc/95/55/34/1025955534.db2.gz UADBDYRUEWRGAA-AWEZNQCLSA-N 1 1 333.354 3.520 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1(C)C ZINC000451554871 1026107224 /nfs/dbraw/zinc/10/72/24/1026107224.db2.gz QLNOZRVZDCMHRB-QGZVFWFLSA-N 1 1 336.432 3.629 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c(F)c1 ZINC000384257718 1026795382 /nfs/dbraw/zinc/79/53/82/1026795382.db2.gz BYZMHUIVZYGEIL-INIZCTEOSA-N 1 1 344.386 3.773 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000501868776 1027611053 /nfs/dbraw/zinc/61/10/53/1027611053.db2.gz FYEOYTXYTVMHAA-QGZVFWFLSA-N 1 1 326.396 3.681 20 5 EHBDMO N[C@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915001 1028049853 /nfs/dbraw/zinc/04/98/53/1028049853.db2.gz AFEQBXDCYLHTAI-OALUTQOASA-N 1 1 325.412 3.652 20 5 EHBDMO CC(C)(C)Oc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-] ZINC000091480156 1028074614 /nfs/dbraw/zinc/07/46/14/1028074614.db2.gz NUICALWUCNXIRI-CYBMUJFWSA-N 1 1 344.415 3.879 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000444698570 1028174221 /nfs/dbraw/zinc/17/42/21/1028174221.db2.gz MFTJUKRWGFZRFA-GFCCVEGCSA-N 1 1 332.322 3.638 20 5 EHBDMO COC(=O)c1cc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375319 1028197155 /nfs/dbraw/zinc/19/71/55/1028197155.db2.gz GVHMPKIVRJBYOK-QWRGUYRKSA-N 1 1 332.356 3.695 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](O)CC34CCC4)o2)cc1 ZINC000421376088 1028337454 /nfs/dbraw/zinc/33/74/54/1028337454.db2.gz RDGHAOPTQZAEHM-MRXNPFEDSA-N 1 1 342.395 3.734 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(F)c1 ZINC000178728371 1028376719 /nfs/dbraw/zinc/37/67/19/1028376719.db2.gz BZJLXOMYBHTLNO-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CCc1ccccc1[C@@H]([NH3+])CN[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505220 1028469403 /nfs/dbraw/zinc/46/94/03/1028469403.db2.gz OCHUTDGQJMZGDA-KDOFPFPSSA-N 1 1 327.428 3.816 20 5 EHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000414749165 1028495882 /nfs/dbraw/zinc/49/58/82/1028495882.db2.gz JYCTVCOWNKMGRM-OAHLLOKOSA-N 1 1 345.468 3.897 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000513750313 1028499871 /nfs/dbraw/zinc/49/98/71/1028499871.db2.gz GHHIXQFELKFNRR-KRWDZBQOSA-N 1 1 341.411 3.583 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCCC[C@@H]1C ZINC000052101536 1028812943 /nfs/dbraw/zinc/81/29/43/1028812943.db2.gz KQMWYBSRTFEJKY-KBPBESRZSA-N 1 1 328.416 3.818 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630564 1028925128 /nfs/dbraw/zinc/92/51/28/1028925128.db2.gz GVUDRGNISXPOED-OAHLLOKOSA-N 1 1 334.416 3.719 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895989 1029042469 /nfs/dbraw/zinc/04/24/69/1029042469.db2.gz WQJPLFVKAOLWEM-HZPDHXFCSA-N 1 1 349.475 3.765 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000504926266 1029072503 /nfs/dbraw/zinc/07/25/03/1029072503.db2.gz HEYVYOIKRBTDGY-OAGGEKHMSA-N 1 1 349.500 3.682 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000504926266 1029072520 /nfs/dbraw/zinc/07/25/20/1029072520.db2.gz HEYVYOIKRBTDGY-OAGGEKHMSA-N 1 1 349.500 3.682 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930043 1029075797 /nfs/dbraw/zinc/07/57/97/1029075797.db2.gz MYVRYQPXFWRVRA-HUUCEWRRSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930043 1029075815 /nfs/dbraw/zinc/07/58/15/1029075815.db2.gz MYVRYQPXFWRVRA-HUUCEWRRSA-N 1 1 335.448 3.519 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925021 1029109440 /nfs/dbraw/zinc/10/94/40/1029109440.db2.gz RSHIXXWFPALGIU-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925021 1029109447 /nfs/dbraw/zinc/10/94/47/1029109447.db2.gz RSHIXXWFPALGIU-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1c(C[NH2+]Cc2nc3ccc(F)cc3s2)cccc1[N+](=O)[O-] ZINC000428576142 1029403397 /nfs/dbraw/zinc/40/33/97/1029403397.db2.gz VTFLUFRORUYLPD-UHFFFAOYSA-N 1 1 331.372 3.942 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262049 1029541988 /nfs/dbraw/zinc/54/19/88/1029541988.db2.gz WTPZFAQEKCRRIG-GJZGRUSLSA-N 1 1 341.411 3.657 20 5 EHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285231 1029574022 /nfs/dbraw/zinc/57/40/22/1029574022.db2.gz XUAKTXAIKNBLPT-OCCSQVGLSA-N 1 1 333.432 3.741 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1C(C)C ZINC000533296489 1029599164 /nfs/dbraw/zinc/59/91/64/1029599164.db2.gz BFNRIEZQDDQLSO-KRWDZBQOSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCCc4c(O)cccc43)nc2c1 ZINC000192359804 1029646932 /nfs/dbraw/zinc/64/69/32/1029646932.db2.gz PVPNHMXNCWZZHL-CQSZACIVSA-N 1 1 339.351 3.609 20 5 EHBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890943 1029842932 /nfs/dbraw/zinc/84/29/32/1029842932.db2.gz RKEAYSJBNSWOIL-QRBZPYHOSA-N 1 1 346.427 3.519 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475648068 1029856778 /nfs/dbraw/zinc/85/67/78/1029856778.db2.gz IKUUDFIKQCGRCL-OAHLLOKOSA-N 1 1 348.447 3.598 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@H]2/C=C/c2ccccc2)n1 ZINC000441173637 1029866913 /nfs/dbraw/zinc/86/69/13/1029866913.db2.gz CNLLEDBNAKUUBN-ZGKFYVQTSA-N 1 1 340.427 3.749 20 5 EHBDMO CC(C)(CO)[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000429711047 1029961205 /nfs/dbraw/zinc/96/12/05/1029961205.db2.gz DDHNGYWKOKPRHA-KRWDZBQOSA-N 1 1 332.375 3.583 20 5 EHBDMO Cc1c(-c2noc([C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246159 1029973670 /nfs/dbraw/zinc/97/36/70/1029973670.db2.gz CRVLYZWHKXJQBY-LOWVWBTDSA-N 1 1 330.388 3.887 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058932685 1030133943 /nfs/dbraw/zinc/13/39/43/1030133943.db2.gz VUVSZXOFIPRTNH-CQSZACIVSA-N 1 1 330.384 3.675 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCc3sccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000441250917 1030135118 /nfs/dbraw/zinc/13/51/18/1030135118.db2.gz AYBLORAWNWMANJ-GFCCVEGCSA-N 1 1 348.424 3.663 20 5 EHBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000447403419 1030172125 /nfs/dbraw/zinc/17/21/25/1030172125.db2.gz ONBLECABKGVTNZ-KRWDZBQOSA-N 1 1 340.395 3.524 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509101 1030256730 /nfs/dbraw/zinc/25/67/30/1030256730.db2.gz LUISUPNLAKOLBL-DNVCBOLYSA-N 1 1 331.460 3.826 20 5 EHBDMO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000482499969 1030481036 /nfs/dbraw/zinc/48/10/36/1030481036.db2.gz HCQYLGBFPGUWIJ-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000482499969 1030481048 /nfs/dbraw/zinc/48/10/48/1030481048.db2.gz HCQYLGBFPGUWIJ-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC001168147714 1030925994 /nfs/dbraw/zinc/92/59/94/1030925994.db2.gz WXUHJTLVPUAJPD-MRXNPFEDSA-N 1 1 347.459 3.990 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483126646 1030988397 /nfs/dbraw/zinc/98/83/97/1030988397.db2.gz VMJOASXJSAFZSE-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000485741351 1031349881 /nfs/dbraw/zinc/34/98/81/1031349881.db2.gz ZBTHEUUAWLXICU-UHFFFAOYSA-N 1 1 326.805 3.950 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000485741351 1031349865 /nfs/dbraw/zinc/34/98/65/1031349865.db2.gz ZBTHEUUAWLXICU-UHFFFAOYSA-N 1 1 326.805 3.950 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCC[N@@H+]1CC(C)C ZINC000483845835 1031362400 /nfs/dbraw/zinc/36/24/00/1031362400.db2.gz CQCHTONOJSFOLG-INIZCTEOSA-N 1 1 348.447 3.535 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCC[N@@H+]1CC(C)C ZINC000483845837 1031363929 /nfs/dbraw/zinc/36/39/29/1031363929.db2.gz CQCHTONOJSFOLG-MRXNPFEDSA-N 1 1 348.447 3.535 20 5 EHBDMO Cc1c(NC(=O)NC[C@@H]2CCCC[N@@H+]2CC(C)C)cccc1[N+](=O)[O-] ZINC000483874486 1031386966 /nfs/dbraw/zinc/38/69/66/1031386966.db2.gz VNQRSFRJJZENTI-HNNXBMFYSA-N 1 1 348.447 3.535 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)n1cc(C[N@@H+](C)C2CCCCC2)nn1 ZINC000603185810 1033424912 /nfs/dbraw/zinc/42/49/12/1033424912.db2.gz NPYSGVIYFRXQIF-CQSZACIVSA-N 1 1 343.431 3.560 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000594994543 1033624521 /nfs/dbraw/zinc/62/45/21/1033624521.db2.gz HWKDZAXKJVBSOE-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c(OC)c1 ZINC000598995652 1033650118 /nfs/dbraw/zinc/65/01/18/1033650118.db2.gz XKZHYEFSOTYAKO-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CC[N@H+]2C2CCCC2)ccc2cnccc21 ZINC000599164788 1033779404 /nfs/dbraw/zinc/77/94/04/1033779404.db2.gz MQIAOQLDVRSXJF-OAHLLOKOSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1noc(C[N@H+](Cc2cccc(F)c2)C2CCCC2)c1[N+](=O)[O-] ZINC000595361340 1033782175 /nfs/dbraw/zinc/78/21/75/1033782175.db2.gz SUPNTMATKQTTFG-UHFFFAOYSA-N 1 1 333.363 3.975 20 5 EHBDMO Cc1noc(C[N@@H+](Cc2cccc(F)c2)C2CCCC2)c1[N+](=O)[O-] ZINC000595361340 1033782188 /nfs/dbraw/zinc/78/21/88/1033782188.db2.gz SUPNTMATKQTTFG-UHFFFAOYSA-N 1 1 333.363 3.975 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3CC[N@H+]3C3CCCC3)c2c1 ZINC000599165283 1033782812 /nfs/dbraw/zinc/78/28/12/1033782812.db2.gz QFCQSKPNYLQMHL-MRXNPFEDSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnc3ccccc3n2)C2CC2)cc1 ZINC000595404962 1033809144 /nfs/dbraw/zinc/80/91/44/1033809144.db2.gz PVXNCRWULVTPQS-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnc3ccccc3n2)C2CC2)cc1 ZINC000595404962 1033809159 /nfs/dbraw/zinc/80/91/59/1033809159.db2.gz PVXNCRWULVTPQS-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489383 1033811108 /nfs/dbraw/zinc/81/11/08/1033811108.db2.gz ABBHJUKMPPXTFV-OAGGEKHMSA-N 1 1 327.384 3.659 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCC1CCC1)[C@H]1CC[C@H](O)CC1 ZINC000595561912 1033862122 /nfs/dbraw/zinc/86/21/22/1033862122.db2.gz GHUHIVBEMIZLMD-IYARVYRRSA-N 1 1 332.444 3.891 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000603867929 1033994721 /nfs/dbraw/zinc/99/47/21/1033994721.db2.gz DGLVQZGLSXWRLT-GOSISDBHSA-N 1 1 330.359 3.950 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910770 1034029156 /nfs/dbraw/zinc/02/91/56/1034029156.db2.gz RRRZRFUKRIOHKQ-CALCHBBNSA-N 1 1 336.819 3.641 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000237928041 1034175046 /nfs/dbraw/zinc/17/50/46/1034175046.db2.gz JWSWVGDMQFOPKO-UHFFFAOYSA-N 1 1 328.340 3.933 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000596478969 1034255351 /nfs/dbraw/zinc/25/53/51/1034255351.db2.gz QNUBWSRFVHCONX-HNNXBMFYSA-N 1 1 333.432 3.560 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000179442148 1034307037 /nfs/dbraw/zinc/30/70/37/1034307037.db2.gz PXYPYLHOKIKYRB-IBGZPJMESA-N 1 1 344.386 3.507 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@@H]2CNCC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000596647961 1034346248 /nfs/dbraw/zinc/34/62/48/1034346248.db2.gz DRSVVTVXLIDBSI-KFKAGJAMSA-N 1 1 339.439 3.700 20 5 EHBDMO Cn1ncc(C2CC2)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137897 1034559925 /nfs/dbraw/zinc/55/99/25/1034559925.db2.gz HOZDSUXCOVVDTL-INIZCTEOSA-N 1 1 340.427 3.585 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000597225033 1034625571 /nfs/dbraw/zinc/62/55/71/1034625571.db2.gz LXIGQLRSVOSRPP-FYXZTFBWSA-N 1 1 330.428 3.889 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCCc4n[nH]cc4C3)o2)c1 ZINC000597258479 1034629161 /nfs/dbraw/zinc/62/91/61/1034629161.db2.gz NPXMMQLKAXJEKB-UHFFFAOYSA-N 1 1 338.367 3.526 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1=CCSC1 ZINC000597246534 1034639160 /nfs/dbraw/zinc/63/91/60/1034639160.db2.gz WMWSNWFHYYUVTQ-UHFFFAOYSA-N 1 1 330.409 3.960 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000053087907 1034670641 /nfs/dbraw/zinc/67/06/41/1034670641.db2.gz PGTRFSCXYIJCHT-CYBMUJFWSA-N 1 1 345.374 3.756 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000053087907 1034670649 /nfs/dbraw/zinc/67/06/49/1034670649.db2.gz PGTRFSCXYIJCHT-CYBMUJFWSA-N 1 1 345.374 3.756 20 5 EHBDMO COCC[C@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928395 1034900984 /nfs/dbraw/zinc/90/09/84/1034900984.db2.gz QBLXSTUKZZYGEG-LJQANCHMSA-N 1 1 328.412 3.847 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000612576882 1035073823 /nfs/dbraw/zinc/07/38/23/1035073823.db2.gz SEHRDNAPPVCKKJ-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000179950820 1035076541 /nfs/dbraw/zinc/07/65/41/1035076541.db2.gz FNKYSVFIBUGZAY-CQSZACIVSA-N 1 1 348.786 3.607 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000580984599 1035468602 /nfs/dbraw/zinc/46/86/02/1035468602.db2.gz OFXFYGGHCMQXGU-NTPDMAOXSA-N 1 1 349.434 3.745 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039193 1035685995 /nfs/dbraw/zinc/68/59/95/1035685995.db2.gz CNZJESPUWZGWOK-GOEBONIOSA-N 1 1 347.459 3.693 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535008209 1035897167 /nfs/dbraw/zinc/89/71/67/1035897167.db2.gz FQVFHSHOOMKKCQ-CQSZACIVSA-N 1 1 335.448 3.914 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535008206 1035897286 /nfs/dbraw/zinc/89/72/86/1035897286.db2.gz FQVFHSHOOMKKCQ-AWEZNQCLSA-N 1 1 335.448 3.914 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000541070510 1035950047 /nfs/dbraw/zinc/95/00/47/1035950047.db2.gz JAYYJGXCJLHKDN-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000541070510 1035950059 /nfs/dbraw/zinc/95/00/59/1035950059.db2.gz JAYYJGXCJLHKDN-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO C[C@H]([N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000535085162 1035981231 /nfs/dbraw/zinc/98/12/31/1035981231.db2.gz KWUFRDWYTVQKBE-ZDUSSCGKSA-N 1 1 330.432 3.862 20 5 EHBDMO CCOc1cc(C[N@@H+](C[C@@H](C)O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492787755 1036293808 /nfs/dbraw/zinc/29/38/08/1036293808.db2.gz GMOSIMRNLDNMLK-CQSZACIVSA-N 1 1 336.432 3.509 20 5 EHBDMO CCC(CC)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000165372980 1036440396 /nfs/dbraw/zinc/44/03/96/1036440396.db2.gz JYDZIMZKNFIHDN-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000026231486 1036441730 /nfs/dbraw/zinc/44/17/30/1036441730.db2.gz SGDPODCFBIMYLW-OAHLLOKOSA-N 1 1 345.424 3.822 20 5 EHBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825988 1036510102 /nfs/dbraw/zinc/51/01/02/1036510102.db2.gz IPDGKFFJYCSDMZ-KSSFIOAISA-N 1 1 334.416 3.567 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000464675720 1036649658 /nfs/dbraw/zinc/64/96/58/1036649658.db2.gz BWJIBTJHTVLICZ-HNNXBMFYSA-N 1 1 344.386 3.807 20 5 EHBDMO Cc1c(Cc2noc([C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211343 1037129581 /nfs/dbraw/zinc/12/95/81/1037129581.db2.gz DNHIBTPKYBEHNG-SCRDCRAPSA-N 1 1 344.415 3.811 20 5 EHBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000590967192 1037145078 /nfs/dbraw/zinc/14/50/78/1037145078.db2.gz FZGGJJWQSNJFGK-OKILXGFUSA-N 1 1 326.352 3.551 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[NH+](Cc2ccsc2)CC1 ZINC000539802732 1037215866 /nfs/dbraw/zinc/21/58/66/1037215866.db2.gz MXZNSPADYJDPMI-OAHLLOKOSA-N 1 1 345.468 3.844 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000041888306 1037342300 /nfs/dbraw/zinc/34/23/00/1037342300.db2.gz ZMYLVBFCYSDALL-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462783694 1037385398 /nfs/dbraw/zinc/38/53/98/1037385398.db2.gz UIVJKGMAYLSYSQ-NSHDSACASA-N 1 1 342.237 3.644 20 5 EHBDMO CCOc1cc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000540023648 1037483482 /nfs/dbraw/zinc/48/34/82/1037483482.db2.gz BWCZIYFCTNBUJJ-OAHLLOKOSA-N 1 1 335.448 3.773 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1)CC1CC1 ZINC000540026800 1037486799 /nfs/dbraw/zinc/48/67/99/1037486799.db2.gz IPNUFOFCIVYIBF-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CC[N@@H+](CC3CCCC3)C2)ccc2ncccc21 ZINC000462947328 1037572286 /nfs/dbraw/zinc/57/22/86/1037572286.db2.gz LGLHZCYKGHYWAR-HNNXBMFYSA-N 1 1 340.427 3.819 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC(C)(C)C ZINC000532549548 1037588306 /nfs/dbraw/zinc/58/83/06/1037588306.db2.gz UGDVWDNTVCHCAK-JTQLQIEISA-N 1 1 327.812 3.553 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051180362 1037747399 /nfs/dbraw/zinc/74/73/99/1037747399.db2.gz MLBKTIFDQIYMPD-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]([C@H]1CC[C@H](O)CC1)[C@@H]1C=CCCC1 ZINC000592131272 1037844360 /nfs/dbraw/zinc/84/43/60/1037844360.db2.gz VXUJZVDXNUWSHG-KZNAEPCWSA-N 1 1 330.428 3.809 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000494196415 1037906742 /nfs/dbraw/zinc/90/67/42/1037906742.db2.gz WRORIHDAFZYOBG-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000494196415 1037906752 /nfs/dbraw/zinc/90/67/52/1037906752.db2.gz WRORIHDAFZYOBG-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592181458 1037910805 /nfs/dbraw/zinc/91/08/05/1037910805.db2.gz DLFZCJVOKWRBFE-OAHLLOKOSA-N 1 1 348.443 3.773 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)[nH]1 ZINC000549407518 1038321897 /nfs/dbraw/zinc/32/18/97/1038321897.db2.gz GCEBEYCQPLPVAL-UHFFFAOYSA-N 1 1 336.395 3.659 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]c(-c2ccccc2)n1 ZINC000549407518 1038321912 /nfs/dbraw/zinc/32/19/12/1038321912.db2.gz GCEBEYCQPLPVAL-UHFFFAOYSA-N 1 1 336.395 3.659 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2CO)cc1[N+](=O)[O-] ZINC000538736627 1038500533 /nfs/dbraw/zinc/50/05/33/1038500533.db2.gz RXWXNFCXDVKKGG-FQEVSTJZSA-N 1 1 340.423 3.810 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCc3ccccc3[C@@H]2CO)cc1[N+](=O)[O-] ZINC000538736627 1038500534 /nfs/dbraw/zinc/50/05/34/1038500534.db2.gz RXWXNFCXDVKKGG-FQEVSTJZSA-N 1 1 340.423 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](O)C34CCCC4)o2)cc1 ZINC000552085208 1038945008 /nfs/dbraw/zinc/94/50/08/1038945008.db2.gz UFWFXSYEVSMERO-GOSISDBHSA-N 1 1 342.395 3.734 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000552137791 1039000242 /nfs/dbraw/zinc/00/02/42/1039000242.db2.gz NAHXLJCRUSDESP-NXIIHZOPSA-N 1 1 332.444 3.729 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000485473038 1039136932 /nfs/dbraw/zinc/13/69/32/1039136932.db2.gz HMALGUOIWVHCKB-RHSMWYFYSA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1Br ZINC000190317063 1039260677 /nfs/dbraw/zinc/26/06/77/1039260677.db2.gz VJBZOMZEOGCYSQ-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO Cc1c(CN[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494827 1039484622 /nfs/dbraw/zinc/48/46/22/1039484622.db2.gz BEICKWFBVRKEGU-APWZRJJASA-N 1 1 339.439 3.828 20 5 EHBDMO Cc1c(CN[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494827 1039484628 /nfs/dbraw/zinc/48/46/28/1039484628.db2.gz BEICKWFBVRKEGU-APWZRJJASA-N 1 1 339.439 3.828 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1ccccc1 ZINC000489126229 1039635557 /nfs/dbraw/zinc/63/55/57/1039635557.db2.gz JWXQAHLTLWZDDL-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO Cc1[nH+]c2cc(Nc3ncnc4sc([N+](=O)[O-])cc43)ccc2n1C ZINC000553153467 1039800937 /nfs/dbraw/zinc/80/09/37/1039800937.db2.gz TXMPPXNUOAVEDW-UHFFFAOYSA-N 1 1 340.368 3.538 20 5 EHBDMO Cc1noc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc12 ZINC000893945964 1039868309 /nfs/dbraw/zinc/86/83/09/1039868309.db2.gz QYLAAIYELVXEGH-UHFFFAOYSA-N 1 1 338.367 3.604 20 5 EHBDMO Cc1noc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cc12 ZINC000893945964 1039868334 /nfs/dbraw/zinc/86/83/34/1039868334.db2.gz QYLAAIYELVXEGH-UHFFFAOYSA-N 1 1 338.367 3.604 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831026 1040047365 /nfs/dbraw/zinc/04/73/65/1040047365.db2.gz UERRIUXWVZNHJE-HNAYVOBHSA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831026 1040047375 /nfs/dbraw/zinc/04/73/75/1040047375.db2.gz UERRIUXWVZNHJE-HNAYVOBHSA-N 1 1 331.460 3.682 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037574 1040301164 /nfs/dbraw/zinc/30/11/64/1040301164.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 1 1 331.460 3.628 20 5 EHBDMO COC(=O)c1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000292073902 1040335619 /nfs/dbraw/zinc/33/56/19/1040335619.db2.gz DVRHAPGRAXNNHQ-UHFFFAOYSA-N 1 1 346.358 3.545 20 5 EHBDMO CN(C)[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130765 1040365041 /nfs/dbraw/zinc/36/50/41/1040365041.db2.gz OJAKAUPAAHNFTQ-VQTJNVASSA-N 1 1 339.439 3.614 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804447 1040471898 /nfs/dbraw/zinc/47/18/98/1040471898.db2.gz YQTBZWDQIKKDOP-CXAGYDPISA-N 1 1 333.432 3.742 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H](CCOC)C1 ZINC000467269247 1040514551 /nfs/dbraw/zinc/51/45/51/1040514551.db2.gz RHINOVZMEKOZAZ-OAHLLOKOSA-N 1 1 336.432 3.632 20 5 EHBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593277 1040622203 /nfs/dbraw/zinc/62/22/03/1040622203.db2.gz VJJPCHYUCBINMU-KPZWWZAWSA-N 1 1 330.359 3.558 20 5 EHBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593277 1040622211 /nfs/dbraw/zinc/62/22/11/1040622211.db2.gz VJJPCHYUCBINMU-KPZWWZAWSA-N 1 1 330.359 3.558 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000490821423 1040766247 /nfs/dbraw/zinc/76/62/47/1040766247.db2.gz OSTMAZIETJGYPU-UHFFFAOYSA-N 1 1 338.407 3.737 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001167752533 1040849440 /nfs/dbraw/zinc/84/94/40/1040849440.db2.gz VROPJDQSQSWJRH-CYBMUJFWSA-N 1 1 346.406 3.959 20 5 EHBDMO CC(=O)c1ccc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710997 1041474165 /nfs/dbraw/zinc/47/41/65/1041474165.db2.gz CHYNDCFCJONRGN-HZSPNIEDSA-N 1 1 333.432 3.576 20 5 EHBDMO Cc1ccc2nc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000278839637 1041682087 /nfs/dbraw/zinc/68/20/87/1041682087.db2.gz USPZNGSHRKMIDN-GOSISDBHSA-N 1 1 336.395 3.718 20 5 EHBDMO C[C@H]1CCSCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549610224 1042835034 /nfs/dbraw/zinc/83/50/34/1042835034.db2.gz KAAAGISYQJWPTB-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549610224 1042835039 /nfs/dbraw/zinc/83/50/39/1042835039.db2.gz KAAAGISYQJWPTB-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@@H]1CSCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549612480 1042852080 /nfs/dbraw/zinc/85/20/80/1042852080.db2.gz RXBVVLFMTHXOSO-JTQLQIEISA-N 1 1 334.363 3.799 20 5 EHBDMO C[C@@H]1CSCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549612480 1042852085 /nfs/dbraw/zinc/85/20/85/1042852085.db2.gz RXBVVLFMTHXOSO-JTQLQIEISA-N 1 1 334.363 3.799 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000585756376 1043025340 /nfs/dbraw/zinc/02/53/40/1043025340.db2.gz GZTONAHSDYSATH-UZLBHIALSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C)[C@@H](Cc2ccccc2)C1 ZINC000585756376 1043025346 /nfs/dbraw/zinc/02/53/46/1043025346.db2.gz GZTONAHSDYSATH-UZLBHIALSA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728896575 1043511935 /nfs/dbraw/zinc/51/19/35/1043511935.db2.gz QGKGGTKYSCDXKI-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728896575 1043511946 /nfs/dbraw/zinc/51/19/46/1043511946.db2.gz QGKGGTKYSCDXKI-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO Cc1ccc(CN2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610384 /nfs/dbraw/zinc/61/03/84/1043610384.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 1 1 345.487 3.990 20 5 EHBDMO Cc1nn(CC[N@H+](C)Cc2ccc(F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000344594690 1044166810 /nfs/dbraw/zinc/16/68/10/1044166810.db2.gz BFVNNBXGEDASOL-UHFFFAOYSA-N 1 1 342.374 3.524 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000279625784 1044328448 /nfs/dbraw/zinc/32/84/48/1044328448.db2.gz HIJVYHRIXUSDAW-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000279673956 1044394664 /nfs/dbraw/zinc/39/46/64/1044394664.db2.gz NQQZHBAYXHDIHD-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO C[N@H+](Cc1ccc(F)c(Cl)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000763836375 1126882626 /nfs/dbraw/zinc/88/26/26/1126882626.db2.gz MRAWKWIKDZFDTG-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1cccc(C2(O)CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)c1C ZINC000741804844 1127492260 /nfs/dbraw/zinc/49/22/60/1127492260.db2.gz PKILLJSJGYPDSM-UHFFFAOYSA-N 1 1 346.452 3.757 20 5 EHBDMO COc1cc(C[N@H+]2CCCC23CCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000444787027 1127527474 /nfs/dbraw/zinc/52/74/74/1127527474.db2.gz PXXCYKHDUOKMII-UHFFFAOYSA-N 1 1 342.342 3.723 20 5 EHBDMO COc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)ccn1 ZINC000347559084 1128086274 /nfs/dbraw/zinc/08/62/74/1128086274.db2.gz PPUAWQUGSBJHNP-ZDUSSCGKSA-N 1 1 345.399 3.636 20 5 EHBDMO COc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)ccn1 ZINC000347559082 1128086466 /nfs/dbraw/zinc/08/64/66/1128086466.db2.gz PPUAWQUGSBJHNP-CYBMUJFWSA-N 1 1 345.399 3.636 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506896 1128484036 /nfs/dbraw/zinc/48/40/36/1128484036.db2.gz CYWKYZJRUCPULH-DNVCBOLYSA-N 1 1 325.412 3.917 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000301602886 1128517088 /nfs/dbraw/zinc/51/70/88/1128517088.db2.gz WQSNJLKTWAHSHV-YJBOKZPZSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819737 1128661353 /nfs/dbraw/zinc/66/13/53/1128661353.db2.gz AQBUEXDDIUHGNW-DZGCQCFKSA-N 1 1 346.452 3.916 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000762138264 1121126201 /nfs/dbraw/zinc/12/62/01/1121126201.db2.gz LECXIYFIUCFQEN-CQSZACIVSA-N 1 1 326.400 3.680 20 5 EHBDMO O=C(C[N@@H+](C1CC1)C1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000064808050 1128965065 /nfs/dbraw/zinc/96/50/65/1128965065.db2.gz GBDLCHOQEOUVOI-UHFFFAOYSA-N 1 1 337.807 3.594 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724054 1128996350 /nfs/dbraw/zinc/99/63/50/1128996350.db2.gz OOUGQRCVZABZGV-DGCLKSJQSA-N 1 1 343.349 3.534 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c(Cl)c1 ZINC000322895817 1121681580 /nfs/dbraw/zinc/68/15/80/1121681580.db2.gz BSPBGKWGCYTILD-DJIMGWMZSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180146 1121798022 /nfs/dbraw/zinc/79/80/22/1121798022.db2.gz GNNJYBDKEINUEP-IUODEOHRSA-N 1 1 330.388 3.655 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000301735109 1129010404 /nfs/dbraw/zinc/01/04/04/1129010404.db2.gz ZPKKDYFANIYQHD-YPMHNXCESA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ccc([N+](=O)[O-])cc1Cl ZINC000301736368 1129010936 /nfs/dbraw/zinc/01/09/36/1129010936.db2.gz BJKOCEWQYFLTNK-UHFFFAOYSA-N 1 1 348.790 3.532 20 5 EHBDMO COc1cc(C[N@@H+](C(C)C)C2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000077357496 1129017009 /nfs/dbraw/zinc/01/70/09/1129017009.db2.gz UMJLQWFPIZZDIS-UHFFFAOYSA-N 1 1 344.358 3.968 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000301104778 1121919629 /nfs/dbraw/zinc/91/96/29/1121919629.db2.gz SWLFDGVIQKMPRV-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1C(F)(F)F ZINC000301117821 1121948880 /nfs/dbraw/zinc/94/88/80/1121948880.db2.gz WIJNNLUEHXPMQI-JSGCOSHPSA-N 1 1 329.322 3.652 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000917409861 1122599317 /nfs/dbraw/zinc/59/93/17/1122599317.db2.gz FENGYOLQBMEDAI-UHFFFAOYSA-N 1 1 349.450 3.822 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917476581 1122612792 /nfs/dbraw/zinc/61/27/92/1122612792.db2.gz OVZHHHSSSLEYLD-UHFFFAOYSA-N 1 1 338.411 3.857 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)C1 ZINC000195509020 1123495334 /nfs/dbraw/zinc/49/53/34/1123495334.db2.gz ZHBACGHSTZGZFD-CYBMUJFWSA-N 1 1 346.456 3.895 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000609384340 1123567809 /nfs/dbraw/zinc/56/78/09/1123567809.db2.gz LGFHUMPQVQTTAS-LBPRGKRZSA-N 1 1 329.322 3.510 20 5 EHBDMO CC(C)[N@H+](CC(=O)NC1CCC(C)CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350380 1123573063 /nfs/dbraw/zinc/57/30/63/1123573063.db2.gz PAHFUZLQEUZLAZ-UHFFFAOYSA-N 1 1 347.459 3.500 20 5 EHBDMO CC(C)[N@@H+](CC(=O)NC1CCC(C)CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350380 1123573066 /nfs/dbraw/zinc/57/30/66/1123573066.db2.gz PAHFUZLQEUZLAZ-UHFFFAOYSA-N 1 1 347.459 3.500 20 5 EHBDMO COc1c(C)c[nH+]c(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000130976306 1129134310 /nfs/dbraw/zinc/13/43/10/1129134310.db2.gz GALVAXKIADGDEW-UHFFFAOYSA-N 1 1 341.411 3.780 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000609705241 1123647530 /nfs/dbraw/zinc/64/75/30/1123647530.db2.gz KNOFVOSMSRGKOZ-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000609705241 1123647531 /nfs/dbraw/zinc/64/75/31/1123647531.db2.gz KNOFVOSMSRGKOZ-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800977 1123664393 /nfs/dbraw/zinc/66/43/93/1123664393.db2.gz ZBMLFZUIZSSCDG-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800977 1123664396 /nfs/dbraw/zinc/66/43/96/1123664396.db2.gz ZBMLFZUIZSSCDG-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)s1 ZINC000609965233 1123699039 /nfs/dbraw/zinc/69/90/39/1123699039.db2.gz MREANZVWVHYMLO-UHFFFAOYSA-N 1 1 349.431 3.680 20 5 EHBDMO CC(C)([NH2+]Cc1nccc2c1CCCC2)c1ccccc1[N+](=O)[O-] ZINC000922143660 1129150929 /nfs/dbraw/zinc/15/09/29/1129150929.db2.gz MSFHWSQWUKCUSQ-UHFFFAOYSA-N 1 1 325.412 3.894 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000615834454 1123883927 /nfs/dbraw/zinc/88/39/27/1123883927.db2.gz VBABGCYVUULLML-SPQRHKFCSA-N 1 1 326.400 3.532 20 5 EHBDMO CC1(C)CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000078516539 1129155853 /nfs/dbraw/zinc/15/58/53/1129155853.db2.gz YVJNKSBNILBYFN-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccc(F)c(F)c1 ZINC000618680018 1125162070 /nfs/dbraw/zinc/16/20/70/1125162070.db2.gz CJZZBOHWFQFQBW-SWLSCSKDSA-N 1 1 339.367 3.792 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@H]1c1ccc(F)c(F)c1 ZINC000618680018 1125162075 /nfs/dbraw/zinc/16/20/75/1125162075.db2.gz CJZZBOHWFQFQBW-SWLSCSKDSA-N 1 1 339.367 3.792 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000619531594 1125358716 /nfs/dbraw/zinc/35/87/16/1125358716.db2.gz LAPGWZWBUGQTCX-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000619531594 1125358717 /nfs/dbraw/zinc/35/87/17/1125358717.db2.gz LAPGWZWBUGQTCX-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181739 1129315915 /nfs/dbraw/zinc/31/59/15/1129315915.db2.gz IYXZSELUSQFTLB-HUUCEWRRSA-N 1 1 331.416 3.518 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000069063764 1129419857 /nfs/dbraw/zinc/41/98/57/1129419857.db2.gz GXZHICVHUDNBNK-VXGBXAGGSA-N 1 1 347.802 3.926 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@@H](C)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403202 1129463036 /nfs/dbraw/zinc/46/30/36/1129463036.db2.gz QIEYXIBTHAGXJS-SOVGHPHASA-N 1 1 346.427 3.836 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000922537551 1129565305 /nfs/dbraw/zinc/56/53/05/1129565305.db2.gz IDHYASFTGJSMCY-GFCCVEGCSA-N 1 1 348.374 3.876 20 5 EHBDMO COc1cccc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000389794508 1129589742 /nfs/dbraw/zinc/58/97/42/1129589742.db2.gz SGRBJJCNIXSKJF-RHSMWYFYSA-N 1 1 341.411 3.536 20 5 EHBDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000499960011 1129592288 /nfs/dbraw/zinc/59/22/88/1129592288.db2.gz ZMYDHGWXDFWYEY-BMIGLBTASA-N 1 1 338.766 3.772 20 5 EHBDMO CC(C)(C)C[N@@H+](CCCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555350636 1129632723 /nfs/dbraw/zinc/63/27/23/1129632723.db2.gz RVEALRJOBRKPCZ-UHFFFAOYSA-N 1 1 348.365 3.844 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(C2CCCC2)n1 ZINC000282410440 1129722926 /nfs/dbraw/zinc/72/29/26/1129722926.db2.gz INLULGCWXQERGK-UHFFFAOYSA-N 1 1 328.416 3.581 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(C2CCCC2)n1 ZINC000282410440 1129722928 /nfs/dbraw/zinc/72/29/28/1129722928.db2.gz INLULGCWXQERGK-UHFFFAOYSA-N 1 1 328.416 3.581 20 5 EHBDMO CC(=O)c1ccc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044416 1129765387 /nfs/dbraw/zinc/76/53/87/1129765387.db2.gz JUNXAXLRHUVHRM-CJNGLKHVSA-N 1 1 345.443 3.862 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226690055 1129864344 /nfs/dbraw/zinc/86/43/44/1129864344.db2.gz GLZVVTHSZLYJMZ-IUODEOHRSA-N 1 1 346.818 3.891 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](CO)C2)s1 ZINC000305230074 1129914688 /nfs/dbraw/zinc/91/46/88/1129914688.db2.gz XRIBHHQLWYAZLU-CYBMUJFWSA-N 1 1 332.425 3.528 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000429208924 1129978809 /nfs/dbraw/zinc/97/88/09/1129978809.db2.gz BGQPZPYABDIEPE-SNVBAGLBSA-N 1 1 332.231 3.680 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000429208923 1129978856 /nfs/dbraw/zinc/97/88/56/1129978856.db2.gz BGQPZPYABDIEPE-JTQLQIEISA-N 1 1 332.231 3.680 20 5 EHBDMO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000173212239 1130196955 /nfs/dbraw/zinc/19/69/55/1130196955.db2.gz BTBXBYQTRUUUIP-AWEZNQCLSA-N 1 1 349.337 3.552 20 5 EHBDMO CC[C@@H]1C[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000245453903 1130212819 /nfs/dbraw/zinc/21/28/19/1130212819.db2.gz ROWMOXKRFSTZEG-BXUZGUMPSA-N 1 1 348.428 3.533 20 5 EHBDMO CC[C@@H]1C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000245453903 1130212822 /nfs/dbraw/zinc/21/28/22/1130212822.db2.gz ROWMOXKRFSTZEG-BXUZGUMPSA-N 1 1 348.428 3.533 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731205593 1130778199 /nfs/dbraw/zinc/77/81/99/1130778199.db2.gz ARVAFOIWTMAXBJ-GFCCVEGCSA-N 1 1 334.445 3.881 20 5 EHBDMO CCCC[N@H+](CCOC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000731660534 1130825776 /nfs/dbraw/zinc/82/57/76/1130825776.db2.gz AVNNIZNMIGNZJP-UHFFFAOYSA-N 1 1 339.417 3.578 20 5 EHBDMO CCCC[N@@H+](CCOC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000731660534 1130825780 /nfs/dbraw/zinc/82/57/80/1130825780.db2.gz AVNNIZNMIGNZJP-UHFFFAOYSA-N 1 1 339.417 3.578 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCCC4(CCCCC4)C3)c2c1 ZINC000732190370 1130892761 /nfs/dbraw/zinc/89/27/61/1130892761.db2.gz GVZHBMGDWHZZNY-UHFFFAOYSA-N 1 1 328.416 3.948 20 5 EHBDMO CCc1cccc(NC(=O)C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000740007018 1131516242 /nfs/dbraw/zinc/51/62/42/1131516242.db2.gz QRLQYDOAHSRCLY-UHFFFAOYSA-N 1 1 347.802 3.539 20 5 EHBDMO C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000742431373 1131730180 /nfs/dbraw/zinc/73/01/80/1131730180.db2.gz XXSLUIYRFCBGOJ-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO 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/nfs/dbraw/zinc/56/36/07/1136563607.db2.gz XBGJVTQPLYRKSI-IBGZPJMESA-N 1 1 340.423 3.774 20 5 EHBDMO Cc1cc(Cl)c(C(=O)OCC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000815405707 1136592642 /nfs/dbraw/zinc/59/26/42/1136592642.db2.gz GLUSLVZYABPPFM-GFCCVEGCSA-N 1 1 340.807 3.588 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001135040885 1136595761 /nfs/dbraw/zinc/59/57/61/1136595761.db2.gz AJXKJKKNXUZSHJ-KRWDZBQOSA-N 1 1 327.384 3.559 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000817281822 1136790896 /nfs/dbraw/zinc/79/08/96/1136790896.db2.gz QBLVHTJYDZPOLE-JTQLQIEISA-N 1 1 347.293 3.667 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000817281822 1136790898 /nfs/dbraw/zinc/79/08/98/1136790898.db2.gz QBLVHTJYDZPOLE-JTQLQIEISA-N 1 1 347.293 3.667 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCCC[C@H]1C ZINC000339002304 1136844931 /nfs/dbraw/zinc/84/49/31/1136844931.db2.gz KQMWYBSRTFEJKY-ZIAGYGMSSA-N 1 1 328.416 3.818 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040798 1136934500 /nfs/dbraw/zinc/93/45/00/1136934500.db2.gz QGEJQCXSUFLQPN-RDJZCZTQSA-N 1 1 341.411 3.821 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483468 1137146729 /nfs/dbraw/zinc/14/67/29/1137146729.db2.gz UPRYHHFOWAQTDM-AQDCRGGLSA-N 1 1 338.407 3.592 20 5 EHBDMO CCCCC[C@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631450 1137221787 /nfs/dbraw/zinc/22/17/87/1137221787.db2.gz AVGCYAUGQSCQCD-ZDUSSCGKSA-N 1 1 333.388 3.505 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631450 1137221789 /nfs/dbraw/zinc/22/17/89/1137221789.db2.gz AVGCYAUGQSCQCD-ZDUSSCGKSA-N 1 1 333.388 3.505 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567284 1137295735 /nfs/dbraw/zinc/29/57/35/1137295735.db2.gz HKFVZVIZGOGWSX-LBPRGKRZSA-N 1 1 327.375 3.701 20 5 EHBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865731375 1137307543 /nfs/dbraw/zinc/30/75/43/1137307543.db2.gz LKDJLCXJWWQBRP-LLVKDONJSA-N 1 1 336.342 3.650 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3cc(F)ccc3n2C)cc1[N+](=O)[O-] ZINC000772994617 1137431629 /nfs/dbraw/zinc/43/16/29/1137431629.db2.gz AQLAWJUIUSKTJM-LBPRGKRZSA-N 1 1 342.374 3.780 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnc2n1CCCC2 ZINC000872067873 1137569391 /nfs/dbraw/zinc/56/93/91/1137569391.db2.gz BELHIWUEDQAFNC-LBPRGKRZSA-N 1 1 346.456 3.700 20 5 EHBDMO COc1cc2c(c(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000873184800 1137593068 /nfs/dbraw/zinc/59/30/68/1137593068.db2.gz ZJBZAHRHZKRDHM-QWHCGFSZSA-N 1 1 342.395 3.778 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000877797518 1137690187 /nfs/dbraw/zinc/69/01/87/1137690187.db2.gz WGRMGYJVAMTLQV-HNNXBMFYSA-N 1 1 344.411 3.838 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+](C2CC2)C2CCCC2)o1 ZINC000878085918 1137701733 /nfs/dbraw/zinc/70/17/33/1137701733.db2.gz SUNQSGOVNWZCKV-UHFFFAOYSA-N 1 1 328.372 3.552 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879234788 1137741749 /nfs/dbraw/zinc/74/17/49/1137741749.db2.gz RCFYXNKRROMYHC-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879234788 1137741750 /nfs/dbraw/zinc/74/17/50/1137741750.db2.gz RCFYXNKRROMYHC-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000879236118 1137741903 /nfs/dbraw/zinc/74/19/03/1137741903.db2.gz ZYYXVGFAZZVKQQ-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000879236118 1137741904 /nfs/dbraw/zinc/74/19/04/1137741904.db2.gz ZYYXVGFAZZVKQQ-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499530 1137749340 /nfs/dbraw/zinc/74/93/40/1137749340.db2.gz XVTKUSFISZLCQM-GOEBONIOSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499530 1137749341 /nfs/dbraw/zinc/74/93/41/1137749341.db2.gz XVTKUSFISZLCQM-GOEBONIOSA-N 1 1 338.411 3.535 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880316350 1137774705 /nfs/dbraw/zinc/77/47/05/1137774705.db2.gz DXOFQYBDETVKKM-ZDUSSCGKSA-N 1 1 347.440 3.828 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824703 1137922085 /nfs/dbraw/zinc/92/20/85/1137922085.db2.gz QAKPTFDMNZWLRR-CXAGYDPISA-N 1 1 328.416 3.843 20 5 EHBDMO C[C@H]1SCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000118417391 1137933708 /nfs/dbraw/zinc/93/37/08/1137933708.db2.gz XCGZTMJVADXCBW-QWHCGFSZSA-N 1 1 347.440 3.618 20 5 EHBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885932823 1138026126 /nfs/dbraw/zinc/02/61/26/1138026126.db2.gz CSGFQVACGXEBJO-KRWDZBQOSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885932823 1138026128 /nfs/dbraw/zinc/02/61/28/1138026128.db2.gz CSGFQVACGXEBJO-KRWDZBQOSA-N 1 1 327.384 3.726 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2cccc(F)c2F)CC1 ZINC000886141152 1138051669 /nfs/dbraw/zinc/05/16/69/1138051669.db2.gz YOLVCHUVQTXWDN-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO NC(=O)N1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000092754161 1138231838 /nfs/dbraw/zinc/23/18/38/1138231838.db2.gz YFFOXDQDCMQZBJ-UHFFFAOYSA-N 1 1 333.435 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c(C(F)(F)F)c1 ZINC000264921052 1138676693 /nfs/dbraw/zinc/67/66/93/1138676693.db2.gz MHIOQYYDOJLFHV-UHFFFAOYSA-N 1 1 340.305 3.721 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174478293 1139423443 /nfs/dbraw/zinc/42/34/43/1139423443.db2.gz MNUYJVADMNDZDL-MRXNPFEDSA-N 1 1 347.462 3.802 20 5 EHBDMO COc1c(C)cnc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000181822950 1139934362 /nfs/dbraw/zinc/93/43/62/1139934362.db2.gz BOBVHTHSBKOXSI-AWEZNQCLSA-N 1 1 329.400 3.774 20 5 EHBDMO CC(C)OC(=O)C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181827418 1139934957 /nfs/dbraw/zinc/93/49/57/1139934957.db2.gz WFCYUGNERAFERZ-KRWDZBQOSA-N 1 1 342.395 3.767 20 5 EHBDMO C[C@@H]1CSCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000190848416 1140421318 /nfs/dbraw/zinc/42/13/18/1140421318.db2.gz AEMSJYNWRJMCDZ-LBPRGKRZSA-N 1 1 349.481 3.903 20 5 EHBDMO CC(C)OC(=O)C[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275499 1141492174 /nfs/dbraw/zinc/49/21/74/1141492174.db2.gz BYVYDFNBGKKQDA-HUUCEWRRSA-N 1 1 334.416 3.710 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000023818590 212395920 /nfs/dbraw/zinc/39/59/20/212395920.db2.gz MMPRPGYMBPMYDF-UHFFFAOYSA-N 1 1 338.367 3.585 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000023818590 212395925 /nfs/dbraw/zinc/39/59/25/212395925.db2.gz MMPRPGYMBPMYDF-UHFFFAOYSA-N 1 1 338.367 3.585 20 5 EHBDMO c1cnc2c(c1)ccc1ccc(N3CC4(C3)CC[N@H+](CC3CC3)C4)nc12 ZINC001164769224 721283425 /nfs/dbraw/zinc/28/34/25/721283425.db2.gz PZPCCDZHGLJRCL-UHFFFAOYSA-N 1 1 344.462 3.705 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1 ZINC000558465429 1014562033 /nfs/dbraw/zinc/56/20/33/1014562033.db2.gz BMNBNCFEQGYLBR-HXUWFJFHSA-N 1 1 338.407 3.607 20 5 EHBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384708 1016122049 /nfs/dbraw/zinc/12/20/49/1016122049.db2.gz KDLXXJFYCIOTSV-SHACYNPGSA-N 1 1 346.452 3.568 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000155291406 1016417257 /nfs/dbraw/zinc/41/72/57/1016417257.db2.gz KBVRERDOXBYPDY-JTQLQIEISA-N 1 1 342.321 3.540 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000155291406 1016417265 /nfs/dbraw/zinc/41/72/65/1016417265.db2.gz KBVRERDOXBYPDY-JTQLQIEISA-N 1 1 342.321 3.540 20 5 EHBDMO CC(C)N(CC[N@@H+](C)Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167178727 1016487586 /nfs/dbraw/zinc/48/75/86/1016487586.db2.gz JOEQETGRUMHOBM-UHFFFAOYSA-N 1 1 341.455 3.937 20 5 EHBDMO CC(C)[N@H+](CCN(C)Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167178727 1016487592 /nfs/dbraw/zinc/48/75/92/1016487592.db2.gz JOEQETGRUMHOBM-UHFFFAOYSA-N 1 1 341.455 3.937 20 5 EHBDMO CC(C)[N@@H+](CCN(C)Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167178727 1016487601 /nfs/dbraw/zinc/48/76/01/1016487601.db2.gz JOEQETGRUMHOBM-UHFFFAOYSA-N 1 1 341.455 3.937 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc(C4CC4)nc3)C2)cc1 ZINC000459582417 1032280335 /nfs/dbraw/zinc/28/03/35/1032280335.db2.gz RFQCDNIFWNGRPS-QGZVFWFLSA-N 1 1 338.411 3.642 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2nc3c(s2)CCC3)ccc1[N+](=O)[O-] ZINC000459630783 1032345994 /nfs/dbraw/zinc/34/59/94/1032345994.db2.gz JTOHSTSLKRVJQM-NSHDSACASA-N 1 1 347.440 3.790 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2nc3c(s2)CCC3)ccc1[N+](=O)[O-] ZINC000459630782 1032346384 /nfs/dbraw/zinc/34/63/84/1032346384.db2.gz JTOHSTSLKRVJQM-LLVKDONJSA-N 1 1 347.440 3.790 20 5 EHBDMO CCOc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083127864 1032403347 /nfs/dbraw/zinc/40/33/47/1032403347.db2.gz TWVNFDKTNAPLJT-UHFFFAOYSA-N 1 1 341.367 3.767 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083127864 1032403354 /nfs/dbraw/zinc/40/33/54/1032403354.db2.gz TWVNFDKTNAPLJT-UHFFFAOYSA-N 1 1 341.367 3.767 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1[N+](=O)[O-] ZINC000449455723 1032572484 /nfs/dbraw/zinc/57/24/84/1032572484.db2.gz AYGAGOZIRAVEET-YQVWRLOYSA-N 1 1 332.444 3.844 20 5 EHBDMO CC(C)n1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494380 1032659630 /nfs/dbraw/zinc/65/96/30/1032659630.db2.gz AOHBXNHZMDTMPE-KRWDZBQOSA-N 1 1 328.416 3.752 20 5 EHBDMO [NH3+][C@H]1CCC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930669 1017326111 /nfs/dbraw/zinc/32/61/11/1017326111.db2.gz TXVKHLAYCHGIDX-NWDGAFQWSA-N 1 1 349.818 3.868 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000177392059 1017660960 /nfs/dbraw/zinc/66/09/60/1017660960.db2.gz HUSQSINEHIXVCK-HNNXBMFYSA-N 1 1 330.409 3.894 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1nccn1-c1ccccc1 ZINC000377406853 1017762294 /nfs/dbraw/zinc/76/22/94/1017762294.db2.gz DOFKCUUXHKZMIQ-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO C[C@@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294688 1017896723 /nfs/dbraw/zinc/89/67/23/1017896723.db2.gz WYRGYSNRZZTMSP-CRAIPNDOSA-N 1 1 336.395 3.883 20 5 EHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610003615 1017983812 /nfs/dbraw/zinc/98/38/12/1017983812.db2.gz BNJCNQBRFPCKOU-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCCC2)CC1 ZINC000610004341 1017984211 /nfs/dbraw/zinc/98/42/11/1017984211.db2.gz DYNZQJWLUNPPGG-CQSZACIVSA-N 1 1 331.416 3.578 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c1 ZINC001167332760 1018225415 /nfs/dbraw/zinc/22/54/15/1018225415.db2.gz RMFFABLLYJSPRF-SFHVURJKSA-N 1 1 340.423 3.928 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368001 1018535223 /nfs/dbraw/zinc/53/52/23/1018535223.db2.gz AQKGNPWQJAHLQC-DZGCQCFKSA-N 1 1 326.400 3.634 20 5 EHBDMO COc1cccc([N+](=O)[O-])c1NCc1cc(C)[nH+]c(N2CCCC2)c1 ZINC000576360075 1018874075 /nfs/dbraw/zinc/87/40/75/1018874075.db2.gz MVSLQUWDRYQOFL-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000182317362 1018967455 /nfs/dbraw/zinc/96/74/55/1018967455.db2.gz KTDCVQSZJOVAEQ-CYBMUJFWSA-N 1 1 338.367 3.804 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637260 1019011733 /nfs/dbraw/zinc/01/17/33/1019011733.db2.gz SHBRLPZFBRZXLD-QFBILLFUSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000379637260 1019011748 /nfs/dbraw/zinc/01/17/48/1019011748.db2.gz SHBRLPZFBRZXLD-QFBILLFUSA-N 1 1 339.439 3.738 20 5 EHBDMO CN(c1ccsc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610431089 1019084142 /nfs/dbraw/zinc/08/41/42/1019084142.db2.gz QAYHKZROZCFXQP-HNNXBMFYSA-N 1 1 331.441 3.757 20 5 EHBDMO CC[N@H+](C)[C@@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000340668057 1019139541 /nfs/dbraw/zinc/13/95/41/1019139541.db2.gz APDFXYCKWQHLCU-QGZVFWFLSA-N 1 1 327.384 3.535 20 5 EHBDMO CC[N@@H+](C)[C@@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000340668057 1019139550 /nfs/dbraw/zinc/13/95/50/1019139550.db2.gz APDFXYCKWQHLCU-QGZVFWFLSA-N 1 1 327.384 3.535 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000513380836 1019584900 /nfs/dbraw/zinc/58/49/00/1019584900.db2.gz MODKPCPFXTYVOC-MRXNPFEDSA-N 1 1 340.379 3.969 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182830018 1019757996 /nfs/dbraw/zinc/75/79/96/1019757996.db2.gz HJXJVCGQFUZNQS-KBPBESRZSA-N 1 1 334.416 3.628 20 5 EHBDMO C[N@H+](Cc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000404218529 1019777397 /nfs/dbraw/zinc/77/73/97/1019777397.db2.gz YOEPJFQRIAFHCP-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO C[N@@H+](Cc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000404218529 1019777415 /nfs/dbraw/zinc/77/74/15/1019777415.db2.gz YOEPJFQRIAFHCP-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])C1 ZINC000109966625 1020173475 /nfs/dbraw/zinc/17/34/75/1020173475.db2.gz LRABUATUZVFTBS-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000129789775 1032886718 /nfs/dbraw/zinc/88/67/18/1032886718.db2.gz KAJITJZZZUHUMV-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000129789775 1032886734 /nfs/dbraw/zinc/88/67/34/1032886734.db2.gz KAJITJZZZUHUMV-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+](C[C@@H]1CCOC1)C1CC1 ZINC000602439516 1032887895 /nfs/dbraw/zinc/88/78/95/1032887895.db2.gz HJAZHRCYOYJJIN-NSHDSACASA-N 1 1 344.333 3.615 20 5 EHBDMO CC[C@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000168006042 1020391252 /nfs/dbraw/zinc/39/12/52/1020391252.db2.gz WMPPUUPDTOSYME-JKSUJKDBSA-N 1 1 343.431 3.886 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000581507902 1021028790 /nfs/dbraw/zinc/02/87/90/1021028790.db2.gz LZYGESNQFORBPT-HNNXBMFYSA-N 1 1 333.432 3.682 20 5 EHBDMO CC[N@@H+]1CCCC[C@H]1CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450807 1021189878 /nfs/dbraw/zinc/18/98/78/1021189878.db2.gz WMUILWHLUICTOJ-KRWDZBQOSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450807 1021189889 /nfs/dbraw/zinc/18/98/89/1021189889.db2.gz WMUILWHLUICTOJ-KRWDZBQOSA-N 1 1 343.427 3.819 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](CCO)Cc1cccc(F)c1 ZINC000426368918 1021395161 /nfs/dbraw/zinc/39/51/61/1021395161.db2.gz CHRNBRSMMGTUMP-GDNBJRDFSA-N 1 1 344.386 3.632 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506564521 1021406480 /nfs/dbraw/zinc/40/64/80/1021406480.db2.gz UXGNKLLOVYMERQ-OAHLLOKOSA-N 1 1 344.386 3.950 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000184405953 1021613688 /nfs/dbraw/zinc/61/36/88/1021613688.db2.gz QVSNDFXRYJTKTQ-ZDUSSCGKSA-N 1 1 337.351 3.588 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)c([N+](=O)[O-])cc1F ZINC000933489417 1021873353 /nfs/dbraw/zinc/87/33/53/1021873353.db2.gz RTVRALKVCLSDQV-LLVKDONJSA-N 1 1 346.358 3.528 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000441419767 1022288468 /nfs/dbraw/zinc/28/84/68/1022288468.db2.gz UIRQLMQUNMNMCR-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1cccc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000310105574 1022584039 /nfs/dbraw/zinc/58/40/39/1022584039.db2.gz AJYWGIFRZRWAPF-CQSZACIVSA-N 1 1 329.400 3.536 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000441433475 1022587533 /nfs/dbraw/zinc/58/75/33/1022587533.db2.gz GPAOPVDDPSRWHO-IBGZPJMESA-N 1 1 348.443 3.787 20 5 EHBDMO CC(C)[N@H+](CC(=O)N(C)C1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000517834662 1022721660 /nfs/dbraw/zinc/72/16/60/1022721660.db2.gz OOSYFQACFWRLMX-UHFFFAOYSA-N 1 1 347.459 3.596 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N(C)C1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000517834662 1022721674 /nfs/dbraw/zinc/72/16/74/1022721674.db2.gz OOSYFQACFWRLMX-UHFFFAOYSA-N 1 1 347.459 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)o1 ZINC000430881513 1022820195 /nfs/dbraw/zinc/82/01/95/1022820195.db2.gz BVADQUVWMHZBIY-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H]3CCC[C@H]32)o1 ZINC000430881513 1022820216 /nfs/dbraw/zinc/82/02/16/1022820216.db2.gz BVADQUVWMHZBIY-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000518065273 1022968176 /nfs/dbraw/zinc/96/81/76/1022968176.db2.gz AWPZETYCBSEWTL-OKILXGFUSA-N 1 1 328.416 3.818 20 5 EHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000507185287 1023170148 /nfs/dbraw/zinc/17/01/48/1023170148.db2.gz WOXCPBXOSKVRPM-INIZCTEOSA-N 1 1 326.396 3.772 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232734 /nfs/dbraw/zinc/23/27/34/1023232734.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 1 1 345.487 3.724 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071074 1023261057 /nfs/dbraw/zinc/26/10/57/1023261057.db2.gz YLNFBJVZKJEEGW-GOSISDBHSA-N 1 1 325.412 3.980 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000546126937 1023265938 /nfs/dbraw/zinc/26/59/38/1023265938.db2.gz PUTZJQDYMLWPSE-GXTWGEPZSA-N 1 1 333.432 3.598 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247529013 1023451243 /nfs/dbraw/zinc/45/12/43/1023451243.db2.gz OBWKOBGVEFIYNQ-XNRPHZJLSA-N 1 1 342.399 3.798 20 5 EHBDMO C[N@H+](CCSc1ccncc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001168045293 1023964746 /nfs/dbraw/zinc/96/47/46/1023964746.db2.gz YPRNIGVVLHWRRE-UHFFFAOYSA-N 1 1 337.832 3.867 20 5 EHBDMO C[N@@H+](CCSc1ccncc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001168045293 1023964761 /nfs/dbraw/zinc/96/47/61/1023964761.db2.gz YPRNIGVVLHWRRE-UHFFFAOYSA-N 1 1 337.832 3.867 20 5 EHBDMO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288569 1024012893 /nfs/dbraw/zinc/01/28/93/1024012893.db2.gz YEGPFBVVNKFQJR-CHWSQXEVSA-N 1 1 336.823 3.569 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605730 1024629136 /nfs/dbraw/zinc/62/91/36/1024629136.db2.gz DIKYQIMJCRIMRE-UKRRQHHQSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605730 1024629145 /nfs/dbraw/zinc/62/91/45/1024629145.db2.gz DIKYQIMJCRIMRE-UKRRQHHQSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383927379 1024633800 /nfs/dbraw/zinc/63/38/00/1024633800.db2.gz RZLKOBUNVLYCMS-WBVHZDCISA-N 1 1 325.412 3.917 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2C[C@H](O)C2(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427871705 1024853668 /nfs/dbraw/zinc/85/36/68/1024853668.db2.gz WQRPYQCHQZEPGM-OKZBNKHCSA-N 1 1 344.411 3.589 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]([C@H]4CCCO4)C3)o2)cc1 ZINC000895843868 1024891688 /nfs/dbraw/zinc/89/16/88/1024891688.db2.gz JESKMVLCRAJWGS-CRAIPNDOSA-N 1 1 342.395 3.856 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000895990776 1025033608 /nfs/dbraw/zinc/03/36/08/1025033608.db2.gz YCUUCNWDAMVMEQ-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185511803 1025372363 /nfs/dbraw/zinc/37/23/63/1025372363.db2.gz MTMLFPCQYMKVRD-UHFFFAOYSA-N 1 1 346.814 3.732 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200900 1025641947 /nfs/dbraw/zinc/64/19/47/1025641947.db2.gz OGEPLPOIFJVRNC-GUYCJALGSA-N 1 1 327.384 3.582 20 5 EHBDMO Cc1ccccc1[C@@H]([C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1)N(C)C ZINC000443012248 1025662368 /nfs/dbraw/zinc/66/23/68/1025662368.db2.gz IQYHPLFWDOGUSL-CXAGYDPISA-N 1 1 333.457 3.746 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccsc2)c(Cl)c1 ZINC000436415083 1025694997 /nfs/dbraw/zinc/69/49/97/1025694997.db2.gz WJCNENIQYAULLW-UHFFFAOYSA-N 1 1 348.815 3.990 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478422743 1026097698 /nfs/dbraw/zinc/09/76/98/1026097698.db2.gz UACVKQVNEPJMDB-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478422743 1026097716 /nfs/dbraw/zinc/09/77/16/1026097716.db2.gz UACVKQVNEPJMDB-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c1 ZINC000338701484 1026176490 /nfs/dbraw/zinc/17/64/90/1026176490.db2.gz PRMSJHHMCNOHRK-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(c3nc4ccccc4s3)C2)cc1 ZINC000342549872 1026251530 /nfs/dbraw/zinc/25/15/30/1026251530.db2.gz SJGOQAMIBVRRQU-UHFFFAOYSA-N 1 1 325.393 3.804 20 5 EHBDMO CC(C)[NH+](CCN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(C)C ZINC000480080392 1026982794 /nfs/dbraw/zinc/98/27/94/1026982794.db2.gz LFHJVVCXMBTUMR-SFHVURJKSA-N 1 1 333.476 3.624 20 5 EHBDMO Cn1cc[nH+]c1[C@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000342786109 1027040257 /nfs/dbraw/zinc/04/02/57/1027040257.db2.gz YMEPPNBKUNRLIO-VIFPVBQESA-N 1 1 341.198 3.629 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000548761145 1027409486 /nfs/dbraw/zinc/40/94/86/1027409486.db2.gz GJBLRZRYKSEPTP-HLLBOEOZSA-N 1 1 345.443 3.824 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420941969 1027882882 /nfs/dbraw/zinc/88/28/82/1027882882.db2.gz GODBTWNUYPXGPV-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420941969 1027882902 /nfs/dbraw/zinc/88/29/02/1027882902.db2.gz GODBTWNUYPXGPV-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804448 1028035641 /nfs/dbraw/zinc/03/56/41/1028035641.db2.gz YQTBZWDQIKKDOP-DYVFJYSZSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1ccc(F)c(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000444744082 1028230018 /nfs/dbraw/zinc/23/00/18/1028230018.db2.gz NVLCRHLBDVMZQP-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444764810 1028249475 /nfs/dbraw/zinc/24/94/75/1028249475.db2.gz CHERDLKYBCZWPJ-HNNXBMFYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358473 1028309791 /nfs/dbraw/zinc/30/97/91/1028309791.db2.gz BZTHAJCRWQMSRS-UONOGXRCSA-N 1 1 346.452 3.774 20 5 EHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCC[NH2+]CC1 ZINC000414749164 1028495889 /nfs/dbraw/zinc/49/58/89/1028495889.db2.gz JYCTVCOWNKMGRM-HNNXBMFYSA-N 1 1 345.468 3.897 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC2(CCCC2)C1 ZINC000445872867 1029202121 /nfs/dbraw/zinc/20/21/21/1029202121.db2.gz ZODQPDZHYNAORP-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC2(C1)CCCCC2 ZINC000533294410 1029590673 /nfs/dbraw/zinc/59/06/73/1029590673.db2.gz XXYOIMOZLBBWSG-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000446488545 1029659468 /nfs/dbraw/zinc/65/94/68/1029659468.db2.gz NVYYDQFDQDUMAW-ZDUSSCGKSA-N 1 1 348.447 3.535 20 5 EHBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525123972 1029696141 /nfs/dbraw/zinc/69/61/41/1029696141.db2.gz VHEMFJXDMGARTG-KUHUBIRLSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525123972 1029696149 /nfs/dbraw/zinc/69/61/49/1029696149.db2.gz VHEMFJXDMGARTG-KUHUBIRLSA-N 1 1 344.386 3.738 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+](C[C@@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686678 1029764183 /nfs/dbraw/zinc/76/41/83/1029764183.db2.gz RQFZJGJQUVCAEM-AWEZNQCLSA-N 1 1 340.370 3.797 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686678 1029764185 /nfs/dbraw/zinc/76/41/85/1029764185.db2.gz RQFZJGJQUVCAEM-AWEZNQCLSA-N 1 1 340.370 3.797 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1 ZINC000441190798 1029895248 /nfs/dbraw/zinc/89/52/48/1029895248.db2.gz SGQOSAWMEHSUGJ-GOSISDBHSA-N 1 1 342.443 3.526 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2CCO)s1 ZINC000428466035 1029908461 /nfs/dbraw/zinc/90/84/61/1029908461.db2.gz URZGXCKTZRTJKH-ZDUSSCGKSA-N 1 1 332.425 3.670 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709363 1030047047 /nfs/dbraw/zinc/04/70/47/1030047047.db2.gz VNFCZCWSPMQWII-UKRRQHHQSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709363 1030047060 /nfs/dbraw/zinc/04/70/60/1030047060.db2.gz VNFCZCWSPMQWII-UKRRQHHQSA-N 1 1 345.468 3.896 20 5 EHBDMO Cc1cc(NC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000546742921 1030136789 /nfs/dbraw/zinc/13/67/89/1030136789.db2.gz XVHLGUOFVHAYCM-OAHLLOKOSA-N 1 1 348.447 3.679 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+]([C@@H]2CCc3ccc(F)cc32)CC1 ZINC000482829362 1030741140 /nfs/dbraw/zinc/74/11/40/1030741140.db2.gz RBQSBDJKSROEFF-QGZVFWFLSA-N 1 1 341.386 3.543 20 5 EHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607384 1030750383 /nfs/dbraw/zinc/75/03/83/1030750383.db2.gz OSCIMSKGPUCKGO-WFASDCNBSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCC1 ZINC000483132574 1030990329 /nfs/dbraw/zinc/99/03/29/1030990329.db2.gz FXLFRPFAIOOSHE-UHFFFAOYSA-N 1 1 329.400 3.914 20 5 EHBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368406 1031019950 /nfs/dbraw/zinc/01/99/50/1031019950.db2.gz UUHUZWZUHKMIIL-LSDHHAIUSA-N 1 1 344.411 3.980 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCO3)o2)c1 ZINC000551586962 1031473827 /nfs/dbraw/zinc/47/38/27/1031473827.db2.gz SOZGVPJBAWIZNS-IEBWSBKVSA-N 1 1 342.395 3.998 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343627828 1031703519 /nfs/dbraw/zinc/70/35/19/1031703519.db2.gz UUDQAYMRTQHKOB-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343627828 1031703537 /nfs/dbraw/zinc/70/35/37/1031703537.db2.gz UUDQAYMRTQHKOB-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737338 1031720175 /nfs/dbraw/zinc/72/01/75/1031720175.db2.gz CLQCLWLIKHFSAP-UTUOFQBUSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737338 1031720181 /nfs/dbraw/zinc/72/01/81/1031720181.db2.gz CLQCLWLIKHFSAP-UTUOFQBUSA-N 1 1 339.823 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000594502667 1033404280 /nfs/dbraw/zinc/40/42/80/1033404280.db2.gz ORYQPHJAVJTDIH-QGZVFWFLSA-N 1 1 326.400 3.684 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000063505231 1033407018 /nfs/dbraw/zinc/40/70/18/1033407018.db2.gz NCDWUCWQCKBMSD-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000063505231 1033407028 /nfs/dbraw/zinc/40/70/28/1033407028.db2.gz NCDWUCWQCKBMSD-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO CCC(=O)c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594597641 1033444216 /nfs/dbraw/zinc/44/42/16/1033444216.db2.gz DGOHZZQYLWFVPN-ZBFHGGJFSA-N 1 1 331.416 3.616 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000761290796 1033485534 /nfs/dbraw/zinc/48/55/34/1033485534.db2.gz RXOPXRFHZHNFIE-UHFFFAOYSA-N 1 1 330.413 3.712 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000761290796 1033485537 /nfs/dbraw/zinc/48/55/37/1033485537.db2.gz RXOPXRFHZHNFIE-UHFFFAOYSA-N 1 1 330.413 3.712 20 5 EHBDMO [NH3+]C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCC1 ZINC000594738118 1033510094 /nfs/dbraw/zinc/51/00/94/1033510094.db2.gz IAJQHUZKSXPTSR-UHFFFAOYSA-N 1 1 331.441 3.684 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993954 1033646750 /nfs/dbraw/zinc/64/67/50/1033646750.db2.gz FKTKLCFMKZGMSC-HNNXBMFYSA-N 1 1 343.427 3.676 20 5 EHBDMO COc1cccc(OC)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000595072642 1033647197 /nfs/dbraw/zinc/64/71/97/1033647197.db2.gz IYSICKPNWSHTIP-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073936 1033717112 /nfs/dbraw/zinc/71/71/12/1033717112.db2.gz NDPCZMGQGRPLNZ-WMLDXEAASA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073936 1033717122 /nfs/dbraw/zinc/71/71/22/1033717122.db2.gz NDPCZMGQGRPLNZ-WMLDXEAASA-N 1 1 347.459 3.661 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC[C@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599074505 1033718136 /nfs/dbraw/zinc/71/81/36/1033718136.db2.gz SWWDEZRYOIBCJQ-MAUKXSAKSA-N 1 1 340.427 3.754 20 5 EHBDMO CC(=O)c1ccc(NC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599126249 1033746704 /nfs/dbraw/zinc/74/67/04/1033746704.db2.gz FERUDIXYDRCYLP-MRXNPFEDSA-N 1 1 331.416 3.616 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599127993 1033748487 /nfs/dbraw/zinc/74/84/87/1033748487.db2.gz TXGVADRGIUEQMM-KRWDZBQOSA-N 1 1 333.432 3.560 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000595389159 1033787558 /nfs/dbraw/zinc/78/75/58/1033787558.db2.gz LWQQTGLXLNKICL-LJQANCHMSA-N 1 1 344.386 3.507 20 5 EHBDMO C[C@@H](CCO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000593693798 1033800894 /nfs/dbraw/zinc/80/08/94/1033800894.db2.gz DVOSIWNXEKQAHA-NSHDSACASA-N 1 1 338.791 3.711 20 5 EHBDMO COc1ccccc1[C@H]1CC[C@@H](C)C[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489415 1033810908 /nfs/dbraw/zinc/81/09/08/1033810908.db2.gz AOOSWTLCHFVISH-IUODEOHRSA-N 1 1 345.399 3.873 20 5 EHBDMO COc1ccccc1[C@H]1CC[C@@H](C)C[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489415 1033810917 /nfs/dbraw/zinc/81/09/17/1033810917.db2.gz AOOSWTLCHFVISH-IUODEOHRSA-N 1 1 345.399 3.873 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1CCO ZINC000595696272 1033950545 /nfs/dbraw/zinc/95/05/45/1033950545.db2.gz KAVRNQYCQWUPBP-NHYWBVRUSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834319 1033959734 /nfs/dbraw/zinc/95/97/34/1033959734.db2.gz QNUWPUOEJHIVET-BBRMVZONSA-N 1 1 326.400 3.634 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCOc1ccccc1C ZINC000603869831 1033997088 /nfs/dbraw/zinc/99/70/88/1033997088.db2.gz OQIZTSZEILWXQT-UHFFFAOYSA-N 1 1 344.411 3.813 20 5 EHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595785542 1034000418 /nfs/dbraw/zinc/00/04/18/1034000418.db2.gz XPULYPDFMMWVPD-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CC1(C)C ZINC000595909475 1034025906 /nfs/dbraw/zinc/02/59/06/1034025906.db2.gz OLRVGBRNXHMSRK-YPMHNXCESA-N 1 1 330.388 3.684 20 5 EHBDMO O=[N+]([O-])c1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1C(F)(F)F ZINC000596082048 1034074555 /nfs/dbraw/zinc/07/45/55/1034074555.db2.gz FIWGYAYUNMGDTK-NEPJUHHUSA-N 1 1 329.322 3.652 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000892431415 1034166516 /nfs/dbraw/zinc/16/65/16/1034166516.db2.gz QBOVXTQKCMPSGS-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC/C=C/c3ccccc3)C2)nc1 ZINC000450556366 1034520348 /nfs/dbraw/zinc/52/03/48/1034520348.db2.gz AVTHHOJQMCSCAH-AUNFYEFLSA-N 1 1 338.411 3.580 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4COC[C@H]4C3)s2)cc1 ZINC000597229665 1034611459 /nfs/dbraw/zinc/61/14/59/1034611459.db2.gz ICPRMVOVVVCWCA-HUUCEWRRSA-N 1 1 344.436 3.792 20 5 EHBDMO O=C(CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccc(F)cc1 ZINC000540865183 1034687771 /nfs/dbraw/zinc/68/77/71/1034687771.db2.gz DHTPETNRFXXTQG-UHFFFAOYSA-N 1 1 342.370 3.971 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411126030 1034795050 /nfs/dbraw/zinc/79/50/50/1034795050.db2.gz NIMQJHVMDDJNKW-SFHVURJKSA-N 1 1 339.395 3.761 20 5 EHBDMO CCOc1cc(Cn2c[nH+]c3c2C[C@@H](C)[C@H](C)C3)ccc1[N+](=O)[O-] ZINC000450997157 1035007597 /nfs/dbraw/zinc/00/75/97/1035007597.db2.gz HZGSGKQWHQYXGR-CHWSQXEVSA-N 1 1 329.400 3.609 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613179302 1035443487 /nfs/dbraw/zinc/44/34/87/1035443487.db2.gz SLKYQLLHTDNKSB-NVXWUHKLSA-N 1 1 325.412 3.924 20 5 EHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204724 1035822947 /nfs/dbraw/zinc/82/29/47/1035822947.db2.gz ASUXXYDDVNSMKR-HNAYVOBHSA-N 1 1 341.411 3.842 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(OC)c(C)c2)ccc1[N+](=O)[O-] ZINC000492603703 1036058125 /nfs/dbraw/zinc/05/81/25/1036058125.db2.gz CAUYYKZDYNTECB-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000589199783 1036306799 /nfs/dbraw/zinc/30/67/99/1036306799.db2.gz IGWXIPJHTDIPTB-LJQANCHMSA-N 1 1 344.411 3.982 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000589281441 1036340426 /nfs/dbraw/zinc/34/04/26/1036340426.db2.gz HFNRDCVUDKWDCV-HNAYVOBHSA-N 1 1 337.423 3.793 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000535329900 1036341405 /nfs/dbraw/zinc/34/14/05/1036341405.db2.gz NDMOLBDPUAMYEY-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000589609001 1036549282 /nfs/dbraw/zinc/54/92/82/1036549282.db2.gz DITRPYPHUCXOFY-SNVBAGLBSA-N 1 1 334.342 3.541 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677557 1036652257 /nfs/dbraw/zinc/65/22/57/1036652257.db2.gz LXLOIXRXELUVMC-MRXNPFEDSA-N 1 1 344.386 3.732 20 5 EHBDMO C[N@@H+](CCOC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590162695 1036778557 /nfs/dbraw/zinc/77/85/57/1036778557.db2.gz BTTLKDMVWWVYKT-UHFFFAOYSA-N 1 1 334.338 3.861 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]3Cc3ccccc3)c2c1 ZINC000026235873 1036842106 /nfs/dbraw/zinc/84/21/06/1036842106.db2.gz OBRXLFOKULTMLD-QGZVFWFLSA-N 1 1 336.395 3.609 20 5 EHBDMO C[C@H]1CC[C@]2(CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169501 1036870972 /nfs/dbraw/zinc/87/09/72/1036870972.db2.gz VLZICBROBABZKZ-UGSOOPFHSA-N 1 1 349.406 3.575 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](c3ccncc3)C2)cc1 ZINC000590741179 1037040540 /nfs/dbraw/zinc/04/05/40/1037040540.db2.gz ZURKGIDWRBDVNZ-QGZVFWFLSA-N 1 1 341.411 3.638 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@H]2CC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601347 1037486287 /nfs/dbraw/zinc/48/62/87/1037486287.db2.gz BOXHHPOAESDGLA-HOCLYGCPSA-N 1 1 336.432 3.631 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000532518770 1037559458 /nfs/dbraw/zinc/55/94/58/1037559458.db2.gz UWNOFEHWLFBNRQ-GJZGRUSLSA-N 1 1 341.411 3.657 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000177504554 1037560169 /nfs/dbraw/zinc/56/01/69/1037560169.db2.gz CTUJMHQALDMWAU-UHFFFAOYSA-N 1 1 348.443 3.775 20 5 EHBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+](C)C ZINC000491599682 1037578732 /nfs/dbraw/zinc/57/87/32/1037578732.db2.gz UHHGDNNIRCIVKR-ZDUSSCGKSA-N 1 1 333.457 3.611 20 5 EHBDMO C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CN(C)C ZINC000491599682 1037578747 /nfs/dbraw/zinc/57/87/47/1037578747.db2.gz UHHGDNNIRCIVKR-ZDUSSCGKSA-N 1 1 333.457 3.611 20 5 EHBDMO CO[C@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390318 1037620518 /nfs/dbraw/zinc/62/05/18/1037620518.db2.gz ZNXWRVLFIYPQAX-LJQANCHMSA-N 1 1 326.396 3.947 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)CC(C)C ZINC000540205575 1037683982 /nfs/dbraw/zinc/68/39/82/1037683982.db2.gz KZAONVNSFWREQD-UHFFFAOYSA-N 1 1 334.464 3.574 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000046037859 1037730181 /nfs/dbraw/zinc/73/01/81/1037730181.db2.gz PLKDVUQYJARRFF-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1cc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000443306725 1037763293 /nfs/dbraw/zinc/76/32/93/1037763293.db2.gz BGDZZORXZCMOIS-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1cc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000443306725 1037763310 /nfs/dbraw/zinc/76/33/10/1037763310.db2.gz BGDZZORXZCMOIS-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266260 1037813954 /nfs/dbraw/zinc/81/39/54/1037813954.db2.gz MMCVKFGFNRHEQZ-BBRMVZONSA-N 1 1 342.399 3.799 20 5 EHBDMO CCC[C@@H](O)C[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000542474376 1037847842 /nfs/dbraw/zinc/84/78/42/1037847842.db2.gz FFLYAIBJMHXYQH-QAPCUYQASA-N 1 1 332.400 3.590 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000463198575 1037864033 /nfs/dbraw/zinc/86/40/33/1037864033.db2.gz NKMMWJVLBOQQFG-NUJGCVRESA-N 1 1 348.443 3.509 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C1CC1)C1CCCC1 ZINC000103466260 1037900444 /nfs/dbraw/zinc/90/04/44/1037900444.db2.gz ZKXGMCZLEIVSEP-UHFFFAOYSA-N 1 1 331.416 3.639 20 5 EHBDMO CC1CCC([N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000053170403 1037919436 /nfs/dbraw/zinc/91/94/36/1037919436.db2.gz QXIGNYNULKSMLT-UHFFFAOYSA-N 1 1 331.416 3.576 20 5 EHBDMO COc1ccc([C@H](C)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481619 1037993154 /nfs/dbraw/zinc/99/31/54/1037993154.db2.gz YEAPNJKMRJKBPT-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC3(C2)CCCCC3)c2c(c1)COCO2 ZINC000408072211 1038634542 /nfs/dbraw/zinc/63/45/42/1038634542.db2.gz NCMHKPYPOWWPKU-UHFFFAOYSA-N 1 1 332.400 3.618 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961578 1038698382 /nfs/dbraw/zinc/69/83/82/1038698382.db2.gz XUMUGMBNYAFZQO-QWRGUYRKSA-N 1 1 331.338 3.817 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974701 1039519418 /nfs/dbraw/zinc/51/94/18/1039519418.db2.gz IVNBWIURMNDNRF-XJKSGUPXSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974701 1039519424 /nfs/dbraw/zinc/51/94/24/1039519424.db2.gz IVNBWIURMNDNRF-XJKSGUPXSA-N 1 1 345.374 3.733 20 5 EHBDMO Cc1cccc(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000569216877 1039699690 /nfs/dbraw/zinc/69/96/90/1039699690.db2.gz CBEWNHOFBSBZRW-QGZVFWFLSA-N 1 1 325.412 3.720 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000417347371 1039710278 /nfs/dbraw/zinc/71/02/78/1039710278.db2.gz HAQHCGVBQVHKQZ-OAUYIBNBSA-N 1 1 326.400 3.854 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298583 1039815756 /nfs/dbraw/zinc/81/57/56/1039815756.db2.gz WZEQYKDAVIBUKV-VXGBXAGGSA-N 1 1 341.839 3.943 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192951760 1040158221 /nfs/dbraw/zinc/15/82/21/1040158221.db2.gz IUOCRVLSPZVWJW-AWEZNQCLSA-N 1 1 346.818 3.577 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128287340 1040287498 /nfs/dbraw/zinc/28/74/98/1040287498.db2.gz BAXAMESXXUOEJA-QWHCGFSZSA-N 1 1 337.395 3.573 20 5 EHBDMO N=C(Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)SCC[NH3+] ZINC001167915688 1040339707 /nfs/dbraw/zinc/33/97/07/1040339707.db2.gz WVWLCPQOKVSFOF-UHFFFAOYSA-N 1 1 348.453 3.785 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000486785935 1040460443 /nfs/dbraw/zinc/46/04/43/1040460443.db2.gz FQJTXCRMPJJNTR-CQSZACIVSA-N 1 1 349.431 3.587 20 5 EHBDMO CC(C)CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000553865294 1040542013 /nfs/dbraw/zinc/54/20/13/1040542013.db2.gz HYVBFNMSNBYMRU-UHFFFAOYSA-N 1 1 333.432 3.824 20 5 EHBDMO CN(c1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000490567682 1040612228 /nfs/dbraw/zinc/61/22/28/1040612228.db2.gz MMNRPXIWBLLBNX-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO CCCn1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000487188440 1040760927 /nfs/dbraw/zinc/76/09/27/1040760927.db2.gz OKYRUKVBPBWIPY-UHFFFAOYSA-N 1 1 342.321 3.510 20 5 EHBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355741 1040767776 /nfs/dbraw/zinc/76/77/76/1040767776.db2.gz WCDDTPNNRMXCRJ-UXHICEINSA-N 1 1 345.446 3.745 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000078336341 1041025469 /nfs/dbraw/zinc/02/54/69/1041025469.db2.gz QPRYPTPHTYRMJJ-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000555721205 1041058789 /nfs/dbraw/zinc/05/87/89/1041058789.db2.gz IRYKRCZGHRZCSG-NVXWUHKLSA-N 1 1 345.443 3.742 20 5 EHBDMO [NH3+]C[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227075 1041365823 /nfs/dbraw/zinc/36/58/23/1041365823.db2.gz GSCNENRNBSEPOP-LBPRGKRZSA-N 1 1 349.818 3.679 20 5 EHBDMO CCCO[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000108392799 1042047096 /nfs/dbraw/zinc/04/70/96/1042047096.db2.gz WXGBAZRQQNUKMO-KRWDZBQOSA-N 1 1 336.432 3.645 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799436 1042700591 /nfs/dbraw/zinc/70/05/91/1042700591.db2.gz ZMGDHQPYHQJVRS-BBRMVZONSA-N 1 1 334.416 3.782 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000051560028 1042782968 /nfs/dbraw/zinc/78/29/68/1042782968.db2.gz KDZBVNLQCZAXAV-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051709648 1042859372 /nfs/dbraw/zinc/85/93/72/1042859372.db2.gz FZLUXNXTXAWEBD-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051709648 1042859380 /nfs/dbraw/zinc/85/93/80/1042859380.db2.gz FZLUXNXTXAWEBD-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCCCC[C@H]3CCO)o2)c1 ZINC000585767887 1043030412 /nfs/dbraw/zinc/03/04/12/1043030412.db2.gz XQHFCCFJTCYKMB-INIZCTEOSA-N 1 1 344.411 3.982 20 5 EHBDMO COc1ncccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279109775 1043361539 /nfs/dbraw/zinc/36/15/39/1043361539.db2.gz PAWSKMJJYPAHNK-INIZCTEOSA-N 1 1 327.384 3.511 20 5 EHBDMO C[N@H+](Cc1ccc(F)c(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000763823644 1126877232 /nfs/dbraw/zinc/87/72/32/1126877232.db2.gz JHXJVZLJADNXEW-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCCSCC3)cs2)c1 ZINC000272868152 1127025070 /nfs/dbraw/zinc/02/50/70/1127025070.db2.gz VUSUERABWDHYOR-UHFFFAOYSA-N 1 1 335.454 3.657 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCSCC3)cs2)c1 ZINC000272868152 1127025074 /nfs/dbraw/zinc/02/50/74/1127025074.db2.gz VUSUERABWDHYOR-UHFFFAOYSA-N 1 1 335.454 3.657 20 5 EHBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@H]1CCCC[N@H+]1C ZINC000765525274 1127640396 /nfs/dbraw/zinc/64/03/96/1127640396.db2.gz CJZPAOZZUGFURQ-DLBZAZTESA-N 1 1 348.443 3.581 20 5 EHBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000301427762 1127764920 /nfs/dbraw/zinc/76/49/20/1127764920.db2.gz IHNLBXWKZGOINZ-SUMWQHHRSA-N 1 1 346.456 3.855 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000196789675 1128212101 /nfs/dbraw/zinc/21/21/01/1128212101.db2.gz JPHMBAZUJIXNPD-UHFFFAOYSA-N 1 1 342.370 3.902 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1 ZINC000326686161 1128430328 /nfs/dbraw/zinc/43/03/28/1128430328.db2.gz IUXMHICALQSZCN-GUDVDZBRSA-N 1 1 332.444 3.543 20 5 EHBDMO COc1cc(N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609980 1128520286 /nfs/dbraw/zinc/52/02/86/1128520286.db2.gz BUCFYTUYAXOSQV-YOEHRIQHSA-N 1 1 341.411 3.678 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)C1 ZINC000338747784 1128831863 /nfs/dbraw/zinc/83/18/63/1128831863.db2.gz VAJZKJMYIIKJPS-HNNXBMFYSA-N 1 1 343.349 3.536 20 5 EHBDMO Cc1nc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651009 1128846045 /nfs/dbraw/zinc/84/60/45/1128846045.db2.gz JUODLXGCXRDQAN-GUYCJALGSA-N 1 1 346.456 3.855 20 5 EHBDMO COC(=O)Nc1cccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000495686435 1121361703 /nfs/dbraw/zinc/36/17/03/1121361703.db2.gz HHQSLAWGVNCLFB-UHFFFAOYSA-N 1 1 349.774 3.716 20 5 EHBDMO CC(C)CC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272561353 1121701519 /nfs/dbraw/zinc/70/15/19/1121701519.db2.gz UCNMGUYQBFMDFV-QGZVFWFLSA-N 1 1 342.443 3.834 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180133 1121797770 /nfs/dbraw/zinc/79/77/70/1121797770.db2.gz GNNJYBDKEINUEP-WFASDCNBSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000301753107 1129035833 /nfs/dbraw/zinc/03/58/33/1129035833.db2.gz VYIOCCCOXUEYNZ-LBPRGKRZSA-N 1 1 334.807 3.576 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154306678 1122548498 /nfs/dbraw/zinc/54/84/98/1122548498.db2.gz UJZHNCHPUPMABP-BJZITVGISA-N 1 1 326.396 3.506 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301217130 1122741854 /nfs/dbraw/zinc/74/18/54/1122741854.db2.gz ZNWJOWLTXHKQCZ-SFHVURJKSA-N 1 1 339.439 3.880 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301784061 1129076128 /nfs/dbraw/zinc/07/61/28/1129076128.db2.gz OEOZOOLUUZUVOF-OAHLLOKOSA-N 1 1 342.443 3.923 20 5 EHBDMO C[N@H+](CCCC(=O)OC(C)(C)C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000524593853 1129112695 /nfs/dbraw/zinc/11/26/95/1129112695.db2.gz UZCZMDNJGGKENZ-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000524593853 1129112697 /nfs/dbraw/zinc/11/26/97/1129112697.db2.gz UZCZMDNJGGKENZ-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO CC(C)CN(C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C(C)C ZINC000064350765 1123573803 /nfs/dbraw/zinc/57/38/03/1123573803.db2.gz XSHBEIXQXLMGBK-UHFFFAOYSA-N 1 1 349.475 3.698 20 5 EHBDMO CC(C)CN(C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)C(C)C ZINC000064350765 1123573806 /nfs/dbraw/zinc/57/38/06/1123573806.db2.gz XSHBEIXQXLMGBK-UHFFFAOYSA-N 1 1 349.475 3.698 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609425631 1123577015 /nfs/dbraw/zinc/57/70/15/1123577015.db2.gz NMKIQEZANOCVQH-OAHLLOKOSA-N 1 1 348.447 3.679 20 5 EHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001845 1123710944 /nfs/dbraw/zinc/71/09/44/1123710944.db2.gz DSIHTARBBOQNJP-SUMWQHHRSA-N 1 1 334.416 3.862 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000081572246 1123848257 /nfs/dbraw/zinc/84/82/57/1123848257.db2.gz QDKHKBRRLPWTCN-MRXNPFEDSA-N 1 1 349.475 3.546 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000301907130 1129305721 /nfs/dbraw/zinc/30/57/21/1129305721.db2.gz NTGFNXQPFFTBEI-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000301907130 1129305726 /nfs/dbraw/zinc/30/57/26/1129305726.db2.gz NTGFNXQPFFTBEI-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247735 1129370990 /nfs/dbraw/zinc/37/09/90/1129370990.db2.gz HYTRUVCPMJZSAN-KGLIPLIRSA-N 1 1 333.432 3.598 20 5 EHBDMO CCOc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971350 1129465977 /nfs/dbraw/zinc/46/59/77/1129465977.db2.gz GFQJSYWUWVDUKL-VQIMIIECSA-N 1 1 341.411 3.851 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000328113000 1129548583 /nfs/dbraw/zinc/54/85/83/1129548583.db2.gz UYTPKRJJDIVYOW-JZXOWHBKSA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000389446736 1129574964 /nfs/dbraw/zinc/57/49/64/1129574964.db2.gz VBBZXPNYBONRHB-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CCOCC1 ZINC000093284287 1129582444 /nfs/dbraw/zinc/58/24/44/1129582444.db2.gz YEIYBCVWQPPOCE-UHFFFAOYSA-N 1 1 347.440 3.577 20 5 EHBDMO Cc1c(C[NH2+][C@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000499950297 1129586291 /nfs/dbraw/zinc/58/62/91/1129586291.db2.gz FLVTUUSKEQGMGP-CQSZACIVSA-N 1 1 338.766 3.519 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000093387555 1129586468 /nfs/dbraw/zinc/58/64/68/1129586468.db2.gz BIQNSRBUGIDAHR-MUPIXQSSSA-N 1 1 338.407 3.590 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000735871625 1131384489 /nfs/dbraw/zinc/38/44/89/1131384489.db2.gz LZFDXLUIUBBTLI-LJQANCHMSA-N 1 1 346.402 3.753 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000330961008 1129649778 /nfs/dbraw/zinc/64/97/78/1129649778.db2.gz JMLMJWGCHJEKBS-CYBMUJFWSA-N 1 1 332.322 3.766 20 5 EHBDMO Cc1ccc([C@H]2CCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000073986975 1129881204 /nfs/dbraw/zinc/88/12/04/1129881204.db2.gz KZQNYENKCOOYRD-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccc([C@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000073986975 1129881210 /nfs/dbraw/zinc/88/12/10/1129881210.db2.gz KZQNYENKCOOYRD-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO CC(C)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000507737492 1129974137 /nfs/dbraw/zinc/97/41/37/1129974137.db2.gz AYUDULWNMOCZKH-UHFFFAOYSA-N 1 1 334.416 3.862 20 5 EHBDMO CC(C)N(C(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000429229193 1130093646 /nfs/dbraw/zinc/09/36/46/1130093646.db2.gz GYRRCUCYYOXXOF-UHFFFAOYSA-N 1 1 347.459 3.599 20 5 EHBDMO CC(C)n1cnnc1[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191471 1130354231 /nfs/dbraw/zinc/35/42/31/1130354231.db2.gz UBSOWEIZGBFNTQ-ZBFHGGJFSA-N 1 1 343.431 3.708 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000730454181 1130711800 /nfs/dbraw/zinc/71/18/00/1130711800.db2.gz IONRHSXAXOMGDC-CYBMUJFWSA-N 1 1 340.358 3.531 20 5 EHBDMO C[N@@H+](CCNc1nc2ccc([N+](=O)[O-])cc2s1)Cc1ccccc1 ZINC000731209237 1130779059 /nfs/dbraw/zinc/77/90/59/1130779059.db2.gz NJGCJTFBMOAION-UHFFFAOYSA-N 1 1 342.424 3.748 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892954 1130857327 /nfs/dbraw/zinc/85/73/27/1130857327.db2.gz LDMRXZVQNJNGRD-QINHECLXSA-N 1 1 340.423 3.988 20 5 EHBDMO CC[NH+](CC)[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000731908653 1130859870 /nfs/dbraw/zinc/85/98/70/1130859870.db2.gz OXOLYTHDUGOKDG-GOSISDBHSA-N 1 1 342.395 3.721 20 5 EHBDMO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885976 1131554335 /nfs/dbraw/zinc/55/43/35/1131554335.db2.gz BJZQEJJGDOTRNS-GJZGRUSLSA-N 1 1 326.824 3.884 20 5 EHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885976 1131554338 /nfs/dbraw/zinc/55/43/38/1131554338.db2.gz BJZQEJJGDOTRNS-GJZGRUSLSA-N 1 1 326.824 3.884 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1Cc3cccc(F)c3C1)CC2 ZINC001172914465 1131903055 /nfs/dbraw/zinc/90/30/55/1131903055.db2.gz GWFHBLAYHZYLJS-MRXNPFEDSA-N 1 1 326.371 3.997 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381055 1131914099 /nfs/dbraw/zinc/91/40/99/1131914099.db2.gz SZYDYGVHTNKFKH-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCC[C@@H](F)C(F)(F)C1)CC2 ZINC001172909603 1131916489 /nfs/dbraw/zinc/91/64/89/1131916489.db2.gz UBEKSAFZRUCDPM-GDBMZVCRSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H](F)C(F)(F)C1)CC2 ZINC001172909603 1131916493 /nfs/dbraw/zinc/91/64/93/1131916493.db2.gz UBEKSAFZRUCDPM-GDBMZVCRSA-N 1 1 342.361 3.911 20 5 EHBDMO CC(C)[N@@H+](CCCCCO)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911734 1131918020 /nfs/dbraw/zinc/91/80/20/1131918020.db2.gz FJCHCDHFGOAADN-SFHVURJKSA-N 1 1 334.460 3.715 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC3(CCC3)C2)c1F ZINC001173191657 1131995717 /nfs/dbraw/zinc/99/57/17/1131995717.db2.gz FORQIYVTBWHAII-ZDUSSCGKSA-N 1 1 336.407 3.940 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001173225012 1132005164 /nfs/dbraw/zinc/00/51/64/1132005164.db2.gz ARUOZBIDDPDJDI-NVXWUHKLSA-N 1 1 325.412 3.800 20 5 EHBDMO CCOC[C@@]12CCC[C@@H]1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173223758 1132005880 /nfs/dbraw/zinc/00/58/80/1132005880.db2.gz HIRYMDSRIUGPAP-WDYCEAGBSA-N 1 1 332.444 3.664 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCC[C@H](C)CC1 ZINC000745170674 1132212723 /nfs/dbraw/zinc/21/27/23/1132212723.db2.gz ISKIINHBHZQPBE-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCC[C@H](C)CC1 ZINC000745170674 1132212726 /nfs/dbraw/zinc/21/27/26/1132212726.db2.gz ISKIINHBHZQPBE-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057842 1132646654 /nfs/dbraw/zinc/64/66/54/1132646654.db2.gz XZYGCMJLHFNDNO-LALPHHSUSA-N 1 1 341.249 3.887 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[NH+](Cc2cccs2)CC1 ZINC000804329838 1132783492 /nfs/dbraw/zinc/78/34/92/1132783492.db2.gz ZSTCTNLZELMPSE-UHFFFAOYSA-N 1 1 337.832 3.632 20 5 EHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C1(Cc2ccccc2)CCCC1 ZINC001175945365 1132790956 /nfs/dbraw/zinc/79/09/56/1132790956.db2.gz DLSAVPOPFXUPJR-UHFFFAOYSA-N 1 1 325.412 3.977 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)o1 ZINC001169667692 1132814400 /nfs/dbraw/zinc/81/44/00/1132814400.db2.gz VBZKIDXMWBNOFB-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC001169723329 1132835906 /nfs/dbraw/zinc/83/59/06/1132835906.db2.gz BZGPQKDBIBMYKM-HNNXBMFYSA-N 1 1 347.459 3.990 20 5 EHBDMO CCCCC[C@@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000767762439 1133049432 /nfs/dbraw/zinc/04/94/32/1133049432.db2.gz PFSGIFUWGJTOHS-CYBMUJFWSA-N 1 1 333.388 3.505 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000767762439 1133049438 /nfs/dbraw/zinc/04/94/38/1133049438.db2.gz PFSGIFUWGJTOHS-CYBMUJFWSA-N 1 1 333.388 3.505 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](CCCO)Cc2ccccc2)c1 ZINC000767902401 1133069991 /nfs/dbraw/zinc/06/99/91/1133069991.db2.gz OSCNTSRAIQOWEG-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](CCCO)Cc2ccccc2)c1 ZINC000767902401 1133069996 /nfs/dbraw/zinc/06/99/96/1133069996.db2.gz OSCNTSRAIQOWEG-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000769514967 1133307904 /nfs/dbraw/zinc/30/79/04/1133307904.db2.gz MUZHXKUGVMVRJV-LLVKDONJSA-N 1 1 325.206 3.589 20 5 EHBDMO CC[C@@H](C[N@@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000774708670 1133891689 /nfs/dbraw/zinc/89/16/89/1133891689.db2.gz YSUHSFPNLLRTKL-INIZCTEOSA-N 1 1 330.432 3.881 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000746671974 1133990864 /nfs/dbraw/zinc/99/08/64/1133990864.db2.gz CYRYNVPJZPODHK-SWLSCSKDSA-N 1 1 325.840 3.553 20 5 EHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774905544 1134114210 /nfs/dbraw/zinc/11/42/10/1134114210.db2.gz QMMPREZVCNWCGA-CQSZACIVSA-N 1 1 343.383 3.874 20 5 EHBDMO Cc1cc(N2CC[C@@H]([N@@H+](C)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001186963690 1134278015 /nfs/dbraw/zinc/27/80/15/1134278015.db2.gz DQYVNQJKYWONNP-LJQANCHMSA-N 1 1 339.439 3.656 20 5 EHBDMO CC[N@@H+](CC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000789597370 1134303987 /nfs/dbraw/zinc/30/39/87/1134303987.db2.gz ULHDKNIOLTUTFI-UHFFFAOYSA-N 1 1 326.827 3.954 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390246 1134334178 /nfs/dbraw/zinc/33/41/78/1134334178.db2.gz FMGLOCPSZNTMRQ-OAHLLOKOSA-N 1 1 346.818 3.638 20 5 EHBDMO CC[N@@H+]1[C@H](C)CN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H]1C ZINC001187445104 1134336301 /nfs/dbraw/zinc/33/63/01/1134336301.db2.gz GIJNFVIKVQCTAZ-PHIMTYICSA-N 1 1 331.338 3.533 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604452 1134581861 /nfs/dbraw/zinc/58/18/61/1134581861.db2.gz JPRXSFICEPHISE-YLJYHZDGSA-N 1 1 340.423 3.735 20 5 EHBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC001190582185 1134722214 /nfs/dbraw/zinc/72/22/14/1134722214.db2.gz ROVKIAYDYONYFZ-CQSZACIVSA-N 1 1 346.431 3.582 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597234 1134725282 /nfs/dbraw/zinc/72/52/82/1134725282.db2.gz KXABDFKOJAHTDH-INIZCTEOSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170326928 1134748551 /nfs/dbraw/zinc/74/85/51/1134748551.db2.gz CNKVCOIRHNTKGI-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC001170352062 1134760551 /nfs/dbraw/zinc/76/05/51/1134760551.db2.gz KPPARGQHSWPOOP-CYBMUJFWSA-N 1 1 342.395 3.559 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC001170352062 1134760556 /nfs/dbraw/zinc/76/05/56/1134760556.db2.gz KPPARGQHSWPOOP-CYBMUJFWSA-N 1 1 342.395 3.559 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001191069300 1134786267 /nfs/dbraw/zinc/78/62/67/1134786267.db2.gz GLVOZPMMMNVWSN-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000775538349 1135037209 /nfs/dbraw/zinc/03/72/09/1135037209.db2.gz ULXUIEHGRMPQBU-UHFFFAOYSA-N 1 1 333.319 3.667 20 5 EHBDMO CC1=C(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001193913971 1135204490 /nfs/dbraw/zinc/20/44/90/1135204490.db2.gz PJGCFKHUAPKFSO-UHFFFAOYSA-N 1 1 325.206 3.899 20 5 EHBDMO CC1=C(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001193913971 1135204494 /nfs/dbraw/zinc/20/44/94/1135204494.db2.gz PJGCFKHUAPKFSO-UHFFFAOYSA-N 1 1 325.206 3.899 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC001193954720 1135205716 /nfs/dbraw/zinc/20/57/16/1135205716.db2.gz LDUBLLPGWHSNBP-YQVWRLOYSA-N 1 1 332.444 3.809 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1Cl ZINC001194261195 1135251229 /nfs/dbraw/zinc/25/12/29/1135251229.db2.gz GWOCQOFKEBHCOB-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC001194818262 1135326244 /nfs/dbraw/zinc/32/62/44/1135326244.db2.gz VAUAUOFRWBFSSO-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO CCCC[C@@H](C)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194874974 1135334271 /nfs/dbraw/zinc/33/42/71/1135334271.db2.gz WBSBRWUURADYBK-LLVKDONJSA-N 1 1 327.812 3.697 20 5 EHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761687 1135729494 /nfs/dbraw/zinc/72/94/94/1135729494.db2.gz QNAMVDLEQMFLHH-MOPGFXCFSA-N 1 1 344.411 3.720 20 5 EHBDMO C[C@]1(Cc2cccs2)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301961 1135797174 /nfs/dbraw/zinc/79/71/74/1135797174.db2.gz ZCKWGIQDQIPLQM-ZWKOTPCHSA-N 1 1 346.452 3.787 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(Cl)nc2ccccn21 ZINC000809688875 1135871995 /nfs/dbraw/zinc/87/19/95/1135871995.db2.gz QLXLZTNPXGMKQY-UHFFFAOYSA-N 1 1 344.802 3.570 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(Cl)nc2ccccn21 ZINC000809688875 1135871998 /nfs/dbraw/zinc/87/19/98/1135871998.db2.gz QLXLZTNPXGMKQY-UHFFFAOYSA-N 1 1 344.802 3.570 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1Cl ZINC000809758411 1135888030 /nfs/dbraw/zinc/88/80/30/1135888030.db2.gz MFVUIQLNSTXQAX-ZFWWWQNUSA-N 1 1 338.835 3.887 20 5 EHBDMO CC(C)(C)c1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810847379 1136014758 /nfs/dbraw/zinc/01/47/58/1136014758.db2.gz OHCIFOMJJGDRAO-CABCVRRESA-N 1 1 346.427 3.676 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000811474564 1136096254 /nfs/dbraw/zinc/09/62/54/1136096254.db2.gz LVQMHQZRVZDYEH-CHWSQXEVSA-N 1 1 344.242 3.618 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190399 1136341510 /nfs/dbraw/zinc/34/15/10/1136341510.db2.gz OADQQRRUZPCSFL-SWLSCSKDSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H](c4ccccc4)C3)c2c1 ZINC000814226335 1136425699 /nfs/dbraw/zinc/42/56/99/1136425699.db2.gz VIQITTZAYISYIL-QGZVFWFLSA-N 1 1 336.395 3.782 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC000776582428 1136442222 /nfs/dbraw/zinc/44/22/22/1136442222.db2.gz QAGBUAICFGHAOT-YLJYHZDGSA-N 1 1 340.423 3.583 20 5 EHBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581349 1136444832 /nfs/dbraw/zinc/44/48/32/1136444832.db2.gz DANDHHOCWWSLMT-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1ccc(F)cc1Cl)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581349 1136444836 /nfs/dbraw/zinc/44/48/36/1136444836.db2.gz DANDHHOCWWSLMT-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000776586830 1136448822 /nfs/dbraw/zinc/44/88/22/1136448822.db2.gz ISDGNUZBTPJYCA-WOJBJXKFSA-N 1 1 338.407 3.780 20 5 EHBDMO CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591403 1136453777 /nfs/dbraw/zinc/45/37/77/1136453777.db2.gz MECOHKIAHSLRCG-ZWKOTPCHSA-N 1 1 326.396 3.711 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)c1cccc3ccccc31)C2 ZINC000815075798 1136547955 /nfs/dbraw/zinc/54/79/55/1136547955.db2.gz MSVGHBZUFKEYRE-NRFANRHFSA-N 1 1 348.402 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)co2)cc1 ZINC000844438609 1137223188 /nfs/dbraw/zinc/22/31/88/1137223188.db2.gz FDUWGVCPPKXWRD-MRXNPFEDSA-N 1 1 349.337 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)co2)cc1 ZINC000844438609 1137223189 /nfs/dbraw/zinc/22/31/89/1137223189.db2.gz FDUWGVCPPKXWRD-MRXNPFEDSA-N 1 1 349.337 3.871 20 5 EHBDMO C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308939 1137408664 /nfs/dbraw/zinc/40/86/64/1137408664.db2.gz VDKSTEAYKZWVOI-DZGCQCFKSA-N 1 1 334.416 3.537 20 5 EHBDMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+](C2CCC2)C1 ZINC000795118812 1137490225 /nfs/dbraw/zinc/49/02/25/1137490225.db2.gz AHRZXTBNURWROE-CYBMUJFWSA-N 1 1 337.851 3.554 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000872024724 1137565574 /nfs/dbraw/zinc/56/55/74/1137565574.db2.gz DMSVBAHCYGUJDE-MJBXVCDLSA-N 1 1 335.473 3.594 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CO)c1ccsc1 ZINC000872064028 1137569227 /nfs/dbraw/zinc/56/92/27/1137569227.db2.gz VKWXWMRIEWGDGM-HZMBPMFUSA-N 1 1 338.454 3.762 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1nccnc1C ZINC000872130592 1137573051 /nfs/dbraw/zinc/57/30/51/1137573051.db2.gz JJYSPIPFTJLSJZ-ZYHUDNBSSA-N 1 1 332.429 3.827 20 5 EHBDMO Cc1nccnc1[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000872133489 1137573388 /nfs/dbraw/zinc/57/33/88/1137573388.db2.gz NDVKYUNUMYPWHM-LRDDRELGSA-N 1 1 326.400 3.766 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](OC4CCC4)CC3)nc2c1 ZINC000872281816 1137577914 /nfs/dbraw/zinc/57/79/14/1137577914.db2.gz WDVQLDAXZZJEJA-OAHLLOKOSA-N 1 1 345.399 3.660 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000877934089 1137696231 /nfs/dbraw/zinc/69/62/31/1137696231.db2.gz AZMPNMFXNQVFGS-SNVBAGLBSA-N 1 1 336.779 3.530 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962705 1138044636 /nfs/dbraw/zinc/04/46/36/1138044636.db2.gz DWOLRLGBZNDWPL-SJCJKPOMSA-N 1 1 334.803 3.975 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136983609 1138044962 /nfs/dbraw/zinc/04/49/62/1138044962.db2.gz FIMICOGEEJEPRP-OALUTQOASA-N 1 1 326.396 3.774 20 5 EHBDMO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122748 1138049268 /nfs/dbraw/zinc/04/92/68/1138049268.db2.gz JOANPULIIDJUGO-CXAGYDPISA-N 1 1 327.384 3.582 20 5 EHBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122748 1138049270 /nfs/dbraw/zinc/04/92/70/1138049270.db2.gz JOANPULIIDJUGO-CXAGYDPISA-N 1 1 327.384 3.582 20 5 EHBDMO CCOCC[N@H+](CC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000092537578 1138229344 /nfs/dbraw/zinc/22/93/44/1138229344.db2.gz YXIWMUFPWLPMJJ-UHFFFAOYSA-N 1 1 335.429 3.577 20 5 EHBDMO CCOCC[N@@H+](CC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000092537578 1138229345 /nfs/dbraw/zinc/22/93/45/1138229345.db2.gz YXIWMUFPWLPMJJ-UHFFFAOYSA-N 1 1 335.429 3.577 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(-n2cccn2)cc1)C1CC1 ZINC000338351053 1138847060 /nfs/dbraw/zinc/84/70/60/1138847060.db2.gz QXCGFTNOWRHNKB-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(-n2cccn2)cc1)C1CC1 ZINC000338351053 1138847064 /nfs/dbraw/zinc/84/70/64/1138847064.db2.gz QXCGFTNOWRHNKB-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000179408886 1139755633 /nfs/dbraw/zinc/75/56/33/1139755633.db2.gz RBFXCLXCSXMZNH-ZDUSSCGKSA-N 1 1 329.400 3.520 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552520 1140701696 /nfs/dbraw/zinc/70/16/96/1140701696.db2.gz UYUQMSWONFHLRB-KGLIPLIRSA-N 1 1 349.431 3.502 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000267463492 1140793949 /nfs/dbraw/zinc/79/39/49/1140793949.db2.gz TVBWOBSWKPVSCE-HZPDHXFCSA-N 1 1 332.425 3.744 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000269635601 1141130054 /nfs/dbraw/zinc/13/00/54/1141130054.db2.gz HJBHHNZIJWSCTR-SJORKVTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000269635601 1141130057 /nfs/dbraw/zinc/13/00/57/1141130057.db2.gz HJBHHNZIJWSCTR-SJORKVTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000339166174 1141515935 /nfs/dbraw/zinc/51/59/35/1141515935.db2.gz CVKREIBEBXZTMJ-HUUCEWRRSA-N 1 1 344.333 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000339166174 1141515939 /nfs/dbraw/zinc/51/59/39/1141515939.db2.gz CVKREIBEBXZTMJ-HUUCEWRRSA-N 1 1 344.333 3.757 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000157713987 1015283383 /nfs/dbraw/zinc/28/33/83/1015283383.db2.gz IKPDLIOTMPHJCM-LBPRGKRZSA-N 1 1 334.807 3.670 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000157713987 1015283392 /nfs/dbraw/zinc/28/33/92/1015283392.db2.gz IKPDLIOTMPHJCM-LBPRGKRZSA-N 1 1 334.807 3.670 20 5 EHBDMO Cc1nc(NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311219128 1016386675 /nfs/dbraw/zinc/38/66/75/1016386675.db2.gz TXBUVVVIACAFPX-LJQANCHMSA-N 1 1 340.427 3.622 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835038 1032330224 /nfs/dbraw/zinc/33/02/24/1032330224.db2.gz ZGSGKAUHUBYGMZ-DLBZAZTESA-N 1 1 333.476 3.922 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCC3CCOCC3)C2)cc1 ZINC000449501929 1032678192 /nfs/dbraw/zinc/67/81/92/1032678192.db2.gz QKOZPRKALCSZSO-SFHVURJKSA-N 1 1 332.444 3.981 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449503707 1032687612 /nfs/dbraw/zinc/68/76/12/1032687612.db2.gz POYAAWOOLDDRTH-CXAGYDPISA-N 1 1 330.384 3.712 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)o1 ZINC000377237748 1017514201 /nfs/dbraw/zinc/51/42/01/1017514201.db2.gz JFZQRUOEUOTLIW-GJZGRUSLSA-N 1 1 342.395 3.713 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134946167 1017654428 /nfs/dbraw/zinc/65/44/28/1017654428.db2.gz FNOSIDDXGZQZIQ-CXAGYDPISA-N 1 1 349.862 3.697 20 5 EHBDMO C[C@H]1c2ccc(F)cc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610003930 1017984505 /nfs/dbraw/zinc/98/45/05/1017984505.db2.gz QRBIWJAZCPIHBV-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610003930 1017984517 /nfs/dbraw/zinc/98/45/17/1017984517.db2.gz QRBIWJAZCPIHBV-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610341088 1018331578 /nfs/dbraw/zinc/33/15/78/1018331578.db2.gz XMZTUPMBXOFANF-VXGBXAGGSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610341088 1018331588 /nfs/dbraw/zinc/33/15/88/1018331588.db2.gz XMZTUPMBXOFANF-VXGBXAGGSA-N 1 1 332.322 3.699 20 5 EHBDMO CC(=O)c1ccc(NCCC[N@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000058666363 1032788416 /nfs/dbraw/zinc/78/84/16/1032788416.db2.gz XFZPCWSQSFWYRS-UHFFFAOYSA-N 1 1 333.432 3.864 20 5 EHBDMO Cc1ccc(COc2c(C)cc(C[N@H+](C)CC[N+](=O)[O-])cc2C)cc1 ZINC001167402384 1019388984 /nfs/dbraw/zinc/38/89/84/1019388984.db2.gz TZUIEHMUSCJMHM-UHFFFAOYSA-N 1 1 342.439 3.899 20 5 EHBDMO Cc1ccc(COc2c(C)cc(C[N@@H+](C)CC[N+](=O)[O-])cc2C)cc1 ZINC001167402384 1019389001 /nfs/dbraw/zinc/38/90/01/1019389001.db2.gz TZUIEHMUSCJMHM-UHFFFAOYSA-N 1 1 342.439 3.899 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001167425279 1019765874 /nfs/dbraw/zinc/76/58/74/1019765874.db2.gz PUHZMGHCBDEDTJ-HOTGVXAUSA-N 1 1 347.459 3.988 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000580843407 1020128568 /nfs/dbraw/zinc/12/85/68/1020128568.db2.gz DIPBJWCERLQGNQ-CYBMUJFWSA-N 1 1 337.301 3.786 20 5 EHBDMO C[C@H]1C[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000602476368 1032897859 /nfs/dbraw/zinc/89/78/59/1032897859.db2.gz OLGYSPIGJQYKQT-SMDDNHRTSA-N 1 1 345.365 3.528 20 5 EHBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])s1 ZINC000337016024 1020541387 /nfs/dbraw/zinc/54/13/87/1020541387.db2.gz LRDMJSKOASGQSM-AWEZNQCLSA-N 1 1 334.445 3.620 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000142826888 1033026685 /nfs/dbraw/zinc/02/66/85/1033026685.db2.gz DZASKKSYUPASEA-AWEZNQCLSA-N 1 1 331.441 3.980 20 5 EHBDMO COc1cc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(C)n1 ZINC000341550969 1022283635 /nfs/dbraw/zinc/28/36/35/1022283635.db2.gz FBAAHOYBWBPQSL-UHFFFAOYSA-N 1 1 335.791 3.558 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336452 1022375104 /nfs/dbraw/zinc/37/51/04/1022375104.db2.gz JTMBQUVGXPWYQY-CABCVRRESA-N 1 1 340.427 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nccn3C3CC3)C2)cc1 ZINC000894720317 1022790229 /nfs/dbraw/zinc/79/02/29/1022790229.db2.gz VBQPLUTZGPNIFD-HNNXBMFYSA-N 1 1 326.400 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nccn3C3CC3)C2)cc1 ZINC000894720317 1022790241 /nfs/dbraw/zinc/79/02/41/1022790241.db2.gz VBQPLUTZGPNIFD-HNNXBMFYSA-N 1 1 326.400 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H](c4cccc(F)c4)C3)c2c1 ZINC000729469540 1022865289 /nfs/dbraw/zinc/86/52/89/1022865289.db2.gz MNQSLYDASIWGEY-OAHLLOKOSA-N 1 1 340.358 3.531 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000602715924 1033102451 /nfs/dbraw/zinc/10/24/51/1033102451.db2.gz HWFJRWBOWXAPDS-MNOVXSKESA-N 1 1 332.322 3.613 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003548 1023081256 /nfs/dbraw/zinc/08/12/56/1023081256.db2.gz WLQJUULOZPGUBZ-HIFRSBDPSA-N 1 1 329.375 3.981 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[C@H]1C ZINC000510793487 1023169925 /nfs/dbraw/zinc/16/99/25/1023169925.db2.gz YKZXDIKRJRZSLY-BZNIZROVSA-N 1 1 328.359 3.510 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[C@H]1C ZINC000510793487 1023169928 /nfs/dbraw/zinc/16/99/28/1023169928.db2.gz YKZXDIKRJRZSLY-BZNIZROVSA-N 1 1 328.359 3.510 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@@H](C(C)C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000518268015 1023178580 /nfs/dbraw/zinc/17/85/80/1023178580.db2.gz CIIZNVRQVZJMJB-IBGZPJMESA-N 1 1 333.476 3.749 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1C ZINC000602729222 1033117483 /nfs/dbraw/zinc/11/74/83/1033117483.db2.gz UXWMSHSDAPSQFJ-CSKARUKUSA-N 1 1 328.416 3.573 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](O)C[C@@H]1c1ccccc1 ZINC000602730805 1033122754 /nfs/dbraw/zinc/12/27/54/1033122754.db2.gz IUIMUHWFAMLNII-GIJSUHDKSA-N 1 1 338.407 3.806 20 5 EHBDMO CC[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494854 1023352361 /nfs/dbraw/zinc/35/23/61/1023352361.db2.gz HIZJUVAOCIPLJF-GHMZBOCLSA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000158886127 1033148338 /nfs/dbraw/zinc/14/83/38/1033148338.db2.gz UNGCKJPWFFDCCG-FOIQADDNSA-N 1 1 338.407 3.830 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000158886127 1033148345 /nfs/dbraw/zinc/14/83/45/1033148345.db2.gz UNGCKJPWFFDCCG-FOIQADDNSA-N 1 1 338.407 3.830 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000065202009 1023890778 /nfs/dbraw/zinc/89/07/78/1023890778.db2.gz GXGSJZBOIVCUJQ-HNNXBMFYSA-N 1 1 331.441 3.980 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310314755 1024475546 /nfs/dbraw/zinc/47/55/46/1024475546.db2.gz UVVJYXRHXVNUIT-OAHLLOKOSA-N 1 1 329.375 3.668 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000435124544 1024635558 /nfs/dbraw/zinc/63/55/58/1024635558.db2.gz QLRMQOFHJLZPHC-UHFFFAOYSA-N 1 1 340.383 3.989 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@@H]21 ZINC000248454664 1024768014 /nfs/dbraw/zinc/76/80/14/1024768014.db2.gz ZOMHRVPJMGIDPC-DAXOMENPSA-N 1 1 342.399 3.655 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3cccnc3s2)cc1[N+](=O)[O-] ZINC000342319785 1024858342 /nfs/dbraw/zinc/85/83/42/1024858342.db2.gz FKUCRDMQADLPQK-NSHDSACASA-N 1 1 328.397 3.759 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]([C@H]4CCCO4)C3)o2)c1 ZINC000895842257 1024887583 /nfs/dbraw/zinc/88/75/83/1024887583.db2.gz CXSNEHVLSPXVNY-CRAIPNDOSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)o1 ZINC000895843992 1024892155 /nfs/dbraw/zinc/89/21/55/1024892155.db2.gz KXBZGBSLIKLNMI-KBXCAEBGSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1cc(NCCCC[N@H+]2CCCC[C@H]2C)c(F)cc1[N+](=O)[O-] ZINC000508264018 1024994452 /nfs/dbraw/zinc/99/44/52/1024994452.db2.gz JVWPBTYMNAZZNO-CYBMUJFWSA-N 1 1 339.411 3.809 20 5 EHBDMO COc1cc(NCCCC[N@H+]2CCC[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000508272944 1025013212 /nfs/dbraw/zinc/01/32/12/1025013212.db2.gz WIKRUJYLQJSVEQ-ZDUSSCGKSA-N 1 1 339.411 3.667 20 5 EHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccco1 ZINC000602924161 1033271656 /nfs/dbraw/zinc/27/16/56/1033271656.db2.gz BGZYHAAZRWLHFN-QGZVFWFLSA-N 1 1 343.383 3.600 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000515501433 1025292533 /nfs/dbraw/zinc/29/25/33/1025292533.db2.gz GLEHBXTWFYPSJK-MRXNPFEDSA-N 1 1 330.359 3.950 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(CCF)CC3)co2)cc1 ZINC000602948107 1033275392 /nfs/dbraw/zinc/27/53/92/1033275392.db2.gz OCPKMEIRNBGLEQ-UHFFFAOYSA-N 1 1 333.363 3.821 20 5 EHBDMO CC[C@H]1[C@H](C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606552 1025455534 /nfs/dbraw/zinc/45/55/34/1025455534.db2.gz CLJFPMMCJQSLOL-CJNGLKHVSA-N 1 1 329.400 3.913 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1nc2ccccc2n1C ZINC000185635922 1025481441 /nfs/dbraw/zinc/48/14/41/1025481441.db2.gz WYWFIBRQYXVBKN-UHFFFAOYSA-N 1 1 338.411 3.815 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)s1 ZINC000544368699 1025507807 /nfs/dbraw/zinc/50/78/07/1025507807.db2.gz RUCXBYBMDPXONR-MJEQTWJJSA-N 1 1 344.436 3.526 20 5 EHBDMO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000436307288 1025572991 /nfs/dbraw/zinc/57/29/91/1025572991.db2.gz KIUPCLDMCZQHHO-WDEREUQCSA-N 1 1 346.353 3.541 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2C)C1 ZINC000521982338 1025852920 /nfs/dbraw/zinc/85/29/20/1025852920.db2.gz JSXQTTGSOWCTNT-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505870419 1026089959 /nfs/dbraw/zinc/08/99/59/1026089959.db2.gz WZMIACGYTYQRSO-OAHLLOKOSA-N 1 1 342.395 3.504 20 5 EHBDMO CC1CCN(CC[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548074 1026097604 /nfs/dbraw/zinc/09/76/04/1026097604.db2.gz MIKHBQYVUQROIW-GOSISDBHSA-N 1 1 331.460 3.506 20 5 EHBDMO CC1CCN(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548074 1026097620 /nfs/dbraw/zinc/09/76/20/1026097620.db2.gz MIKHBQYVUQROIW-GOSISDBHSA-N 1 1 331.460 3.506 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000530627687 1026153255 /nfs/dbraw/zinc/15/32/55/1026153255.db2.gz SPVLQULKQZSTTE-LJQANCHMSA-N 1 1 328.412 3.674 20 5 EHBDMO CSCC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235042944 1026263888 /nfs/dbraw/zinc/26/38/88/1026263888.db2.gz BJESGQUSCOEABU-SNVBAGLBSA-N 1 1 347.278 3.931 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235042944 1026263900 /nfs/dbraw/zinc/26/39/00/1026263900.db2.gz BJESGQUSCOEABU-SNVBAGLBSA-N 1 1 347.278 3.931 20 5 EHBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000339000373 1026334980 /nfs/dbraw/zinc/33/49/80/1026334980.db2.gz LRNAODBBBOLARG-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000137512790 1026369372 /nfs/dbraw/zinc/36/93/72/1026369372.db2.gz KNTSUMGVDXLVHI-CABCVRRESA-N 1 1 326.400 3.546 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274981 1026424673 /nfs/dbraw/zinc/42/46/73/1026424673.db2.gz KPRFQBBYSYBIIB-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO Cn1nccc1C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000475331993 1026484951 /nfs/dbraw/zinc/48/49/51/1026484951.db2.gz LZBNQJHFJYHBOS-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1nccc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000475331993 1026484957 /nfs/dbraw/zinc/48/49/57/1026484957.db2.gz LZBNQJHFJYHBOS-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542698 1026841371 /nfs/dbraw/zinc/84/13/71/1026841371.db2.gz IDABGWASBRMWFE-KRWDZBQOSA-N 1 1 347.459 3.568 20 5 EHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000384275060 1026846940 /nfs/dbraw/zinc/84/69/40/1026846940.db2.gz CZUITBHDAVWVAS-UHFFFAOYSA-N 1 1 332.375 3.773 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)cc1 ZINC000347332010 1027722557 /nfs/dbraw/zinc/72/25/57/1027722557.db2.gz IPPGQLARFYNDTN-WBVHZDCISA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)cc1 ZINC000347332010 1027722576 /nfs/dbraw/zinc/72/25/76/1027722576.db2.gz IPPGQLARFYNDTN-WBVHZDCISA-N 1 1 344.436 3.596 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435390 1027873102 /nfs/dbraw/zinc/87/31/02/1027873102.db2.gz WJKGYXCQRINMJF-HUUCEWRRSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421009896 1027961654 /nfs/dbraw/zinc/96/16/54/1027961654.db2.gz NYJHDAZPIBATBN-LBPRGKRZSA-N 1 1 347.440 3.727 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421009896 1027961666 /nfs/dbraw/zinc/96/16/66/1027961666.db2.gz NYJHDAZPIBATBN-LBPRGKRZSA-N 1 1 347.440 3.727 20 5 EHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000444686843 1028132993 /nfs/dbraw/zinc/13/29/93/1028132993.db2.gz UGPUFONVAGBZJM-OAHLLOKOSA-N 1 1 336.395 3.769 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444672112 1028143263 /nfs/dbraw/zinc/14/32/63/1028143263.db2.gz FHCYCZBPZZHFEF-UHFFFAOYSA-N 1 1 326.396 3.637 20 5 EHBDMO Cc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444746181 1028233366 /nfs/dbraw/zinc/23/33/66/1028233366.db2.gz VADPJBNAFFWQQC-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444746181 1028233384 /nfs/dbraw/zinc/23/33/84/1028233384.db2.gz VADPJBNAFFWQQC-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO C[C@@H](NC[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202080 1028269031 /nfs/dbraw/zinc/26/90/31/1028269031.db2.gz ALHMPRDMDCBAIC-KGLIPLIRSA-N 1 1 345.468 3.974 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178729464 1028375723 /nfs/dbraw/zinc/37/57/23/1028375723.db2.gz NNJUPJFWUUJBKF-LBPRGKRZSA-N 1 1 345.355 3.671 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000347376209 1028805067 /nfs/dbraw/zinc/80/50/67/1028805067.db2.gz ZXLMWYKYWMGKIP-SCOADAFUSA-N 1 1 326.400 3.601 20 5 EHBDMO C[C@@H]1CC[C@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592998 1028883361 /nfs/dbraw/zinc/88/33/61/1028883361.db2.gz RHUGFYJFCTXPGQ-HIFRSBDPSA-N 1 1 329.400 3.913 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC001167653373 1028895358 /nfs/dbraw/zinc/89/53/58/1028895358.db2.gz LPQGFBRPHXMWFH-UHFFFAOYSA-N 1 1 329.375 3.584 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532918386 1029068927 /nfs/dbraw/zinc/06/89/27/1029068927.db2.gz TVWJNQJALFDRQG-FDQGKXFDSA-N 1 1 345.443 3.742 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923546 1029108712 /nfs/dbraw/zinc/10/87/12/1029108712.db2.gz BKHPYAMWTHGORM-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923546 1029108719 /nfs/dbraw/zinc/10/87/19/1029108719.db2.gz BKHPYAMWTHGORM-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446080044 1029394060 /nfs/dbraw/zinc/39/40/60/1029394060.db2.gz QXDZAGBTSXXJCU-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000533241785 1029503226 /nfs/dbraw/zinc/50/32/26/1029503226.db2.gz QLJNJNFEPFIOFE-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271929 1029765967 /nfs/dbraw/zinc/76/59/67/1029765967.db2.gz VNGKAPBOZWYRSO-IBGZPJMESA-N 1 1 325.412 3.998 20 5 EHBDMO COC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000537626885 1029931833 /nfs/dbraw/zinc/93/18/33/1029931833.db2.gz HKLCSOQNMWRGGP-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000453335131 1030116202 /nfs/dbraw/zinc/11/62/02/1030116202.db2.gz CXOLTJLIXRRPRQ-LYRGGWFBSA-N 1 1 326.400 3.809 20 5 EHBDMO COc1cccnc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453347419 1030135320 /nfs/dbraw/zinc/13/53/20/1030135320.db2.gz CDSALRXVFVDXKB-OAHLLOKOSA-N 1 1 327.384 3.511 20 5 EHBDMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CCCC1 ZINC000159428749 1030188648 /nfs/dbraw/zinc/18/86/48/1030188648.db2.gz FNXRQKQSMFLWPQ-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000159448691 1030203341 /nfs/dbraw/zinc/20/33/41/1030203341.db2.gz FAZQYTPBLRUVKC-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@H](c2ccccc2)N2CCCC2)cs1 ZINC000237974262 1030547283 /nfs/dbraw/zinc/54/72/83/1030547283.db2.gz NLGUNPCOAXWGBS-MRXNPFEDSA-N 1 1 331.441 3.583 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683456 1030639103 /nfs/dbraw/zinc/63/91/03/1030639103.db2.gz YHPIYHGQCKDBTM-OAHLLOKOSA-N 1 1 338.411 3.924 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCC[C@H]1O ZINC000537687567 1030981790 /nfs/dbraw/zinc/98/17/90/1030981790.db2.gz HYTDQOLQYIBJPM-WMLDXEAASA-N 1 1 346.452 3.916 20 5 EHBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000583904214 1031089677 /nfs/dbraw/zinc/08/96/77/1031089677.db2.gz IXWGASWADFCLBV-LBPRGKRZSA-N 1 1 349.456 3.660 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)s1 ZINC000584232786 1031987501 /nfs/dbraw/zinc/98/75/01/1031987501.db2.gz XWHFAMDRMNVZHO-DYVFJYSZSA-N 1 1 344.436 3.934 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000574690115 1033356470 /nfs/dbraw/zinc/35/64/70/1033356470.db2.gz CHEWKVRFJRELAO-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H](OC1CCCC1)C(F)(F)F ZINC000594967260 1033604933 /nfs/dbraw/zinc/60/49/33/1033604933.db2.gz JSXMQERJYJBDAM-CQSZACIVSA-N 1 1 332.322 3.575 20 5 EHBDMO C[N@@H+]1CCCC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068690 1033709301 /nfs/dbraw/zinc/70/93/01/1033709301.db2.gz CJHMXCIVKJMZTQ-KBXCAEBGSA-N 1 1 331.460 3.639 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068690 1033709315 /nfs/dbraw/zinc/70/93/15/1033709315.db2.gz CJHMXCIVKJMZTQ-KBXCAEBGSA-N 1 1 331.460 3.639 20 5 EHBDMO Cc1noc(C[N@@H+](CCc2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595297653 1033721495 /nfs/dbraw/zinc/72/14/95/1033721495.db2.gz YACSEIVBKLJPDR-UHFFFAOYSA-N 1 1 329.400 3.879 20 5 EHBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCCCC1 ZINC000603580870 1033778007 /nfs/dbraw/zinc/77/80/07/1033778007.db2.gz HUIOJFPOOHOQFR-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]([C@H]4CCCCO4)C3)nc2c1 ZINC000595788872 1034000072 /nfs/dbraw/zinc/00/00/72/1034000072.db2.gz KLCBQPZGWDYROW-CZUORRHYSA-N 1 1 345.399 3.517 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679784 1034106618 /nfs/dbraw/zinc/10/66/18/1034106618.db2.gz OVYJVFDHZXZOJV-HNNXBMFYSA-N 1 1 330.359 3.732 20 5 EHBDMO COc1ccc([C@@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1F ZINC000599679767 1034107417 /nfs/dbraw/zinc/10/74/17/1034107417.db2.gz OJDLLFLVNINPHC-CYBMUJFWSA-N 1 1 336.388 3.794 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1F ZINC000599679767 1034107430 /nfs/dbraw/zinc/10/74/30/1034107430.db2.gz OJDLLFLVNINPHC-CYBMUJFWSA-N 1 1 336.388 3.794 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000596161773 1034114454 /nfs/dbraw/zinc/11/44/54/1034114454.db2.gz KGXYYXJDIGYTGH-GFCCVEGCSA-N 1 1 327.375 3.922 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000596309295 1034165103 /nfs/dbraw/zinc/16/51/03/1034165103.db2.gz XTHSRAQWEGCKGH-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596478483 1034255633 /nfs/dbraw/zinc/25/56/33/1034255633.db2.gz NXAQIWDHYXDOJG-HNNXBMFYSA-N 1 1 331.416 3.616 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597219151 1034600879 /nfs/dbraw/zinc/60/08/79/1034600879.db2.gz ZDAAHMIWIKVTAY-SFHVURJKSA-N 1 1 342.395 3.850 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597219151 1034600892 /nfs/dbraw/zinc/60/08/92/1034600892.db2.gz ZDAAHMIWIKVTAY-SFHVURJKSA-N 1 1 342.395 3.850 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000597224775 1034624994 /nfs/dbraw/zinc/62/49/94/1034624994.db2.gz JYMMISWTBZCMSS-OLZOCXBDSA-N 1 1 347.440 3.718 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000597224775 1034625000 /nfs/dbraw/zinc/62/50/00/1034625000.db2.gz JYMMISWTBZCMSS-OLZOCXBDSA-N 1 1 347.440 3.718 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278791505 1034787630 /nfs/dbraw/zinc/78/76/30/1034787630.db2.gz GYJJLNBDDUGWRB-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO CC(C)(C)Oc1cccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000580345472 1035430059 /nfs/dbraw/zinc/43/00/59/1035430059.db2.gz JTVXTPRHQNDDNI-MRXNPFEDSA-N 1 1 341.411 3.944 20 5 EHBDMO CC(C)(C)C1=CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000534693864 1035509376 /nfs/dbraw/zinc/50/93/76/1035509376.db2.gz ZRZNFGJYEMZGSW-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000534693864 1035509389 /nfs/dbraw/zinc/50/93/89/1035509389.db2.gz ZRZNFGJYEMZGSW-UHFFFAOYSA-N 1 1 342.399 3.823 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000595429695 1035685534 /nfs/dbraw/zinc/68/55/34/1035685534.db2.gz TZEDJLSPMLLNFE-CYBMUJFWSA-N 1 1 333.363 3.800 20 5 EHBDMO CC(C)c1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381396 1036423383 /nfs/dbraw/zinc/42/33/83/1036423383.db2.gz IHTRECUFMZVADI-GOSISDBHSA-N 1 1 328.416 3.752 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1csnn1 ZINC000414295548 1036508931 /nfs/dbraw/zinc/50/89/31/1036508931.db2.gz FLEAVQOKEQGDGR-WDEREUQCSA-N 1 1 338.458 3.668 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000051352752 1036833386 /nfs/dbraw/zinc/83/33/86/1036833386.db2.gz KGLFTAAAKUJCGZ-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO C[C@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210535 1036861070 /nfs/dbraw/zinc/86/10/70/1036861070.db2.gz ITTOXXHLTGWVBJ-ACJLOTCBSA-N 1 1 344.436 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000180468748 1036871547 /nfs/dbraw/zinc/87/15/47/1036871547.db2.gz SYFKUUHGIKWTBX-UHFFFAOYSA-N 1 1 337.379 3.828 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000180468748 1036871566 /nfs/dbraw/zinc/87/15/66/1036871566.db2.gz SYFKUUHGIKWTBX-UHFFFAOYSA-N 1 1 337.379 3.828 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601500 1036965847 /nfs/dbraw/zinc/96/58/47/1036965847.db2.gz CMFLOQUQYJZZCG-CJNGLKHVSA-N 1 1 328.416 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)Cc2ccccc2)cc1Cl ZINC000761511499 1037084665 /nfs/dbraw/zinc/08/46/65/1037084665.db2.gz KZDCDTHPJGQJOC-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000030153957 1037633926 /nfs/dbraw/zinc/63/39/26/1037633926.db2.gz AQFIIXUEPOCPRL-UHFFFAOYSA-N 1 1 339.439 3.611 20 5 EHBDMO COc1ccc([C@@H](NCc2cc([O-])ccc2[N+](=O)[O-])C(C)C)cc1 ZINC000549927879 1037642551 /nfs/dbraw/zinc/64/25/51/1037642551.db2.gz HPAZZDGTMCUDGJ-SFHVURJKSA-N 1 1 330.384 3.796 20 5 EHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587417 1037708573 /nfs/dbraw/zinc/70/85/73/1037708573.db2.gz ZHWWHSHKFOILSK-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764371 /nfs/dbraw/zinc/76/43/71/1037764371.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764388 /nfs/dbraw/zinc/76/43/88/1037764388.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764407 /nfs/dbraw/zinc/76/44/07/1037764407.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780504 /nfs/dbraw/zinc/78/05/04/1037780504.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780516 /nfs/dbraw/zinc/78/05/16/1037780516.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780530 /nfs/dbraw/zinc/78/05/30/1037780530.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 1 1 343.427 3.627 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000152894307 1037825611 /nfs/dbraw/zinc/82/56/11/1037825611.db2.gz BCGNVKZJUCFKDQ-UHFFFAOYSA-N 1 1 346.431 3.804 20 5 EHBDMO COc1ccc(C[NH2+]C2(c3ccccc3F)CCC2)cc1[N+](=O)[O-] ZINC000592144866 1037864890 /nfs/dbraw/zinc/86/48/90/1037864890.db2.gz PLQWEAJDDQHQNK-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000463200471 1037886601 /nfs/dbraw/zinc/88/66/01/1037886601.db2.gz UEYNQBMGLSOFOT-KZNAEPCWSA-N 1 1 348.443 3.509 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000541391394 1038541701 /nfs/dbraw/zinc/54/17/01/1038541701.db2.gz VVQGTKYOYNPXSA-CQSZACIVSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000027554459 1038587317 /nfs/dbraw/zinc/58/73/17/1038587317.db2.gz BOFJLHKQHYKCDA-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)c1cccs1 ZINC000027554459 1038587332 /nfs/dbraw/zinc/58/73/32/1038587332.db2.gz BOFJLHKQHYKCDA-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO CCC(=O)c1ccc(N[C@H]2CC[N@H+](C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000479970957 1038967379 /nfs/dbraw/zinc/96/73/79/1038967379.db2.gz QMSXLSUAIUKGOO-AWEZNQCLSA-N 1 1 331.416 3.616 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C2CC2)cc1 ZINC000485749028 1039509333 /nfs/dbraw/zinc/50/93/33/1039509333.db2.gz XLEUQDUYAYALJP-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000489181958 1039712162 /nfs/dbraw/zinc/71/21/62/1039712162.db2.gz BRCOMFCWDCYKCI-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145534 1040022091 /nfs/dbraw/zinc/02/20/91/1040022091.db2.gz OEFKWKVBBIYNSF-QWHCGFSZSA-N 1 1 330.388 3.828 20 5 EHBDMO CC(C)OCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549861102 1040066617 /nfs/dbraw/zinc/06/66/17/1040066617.db2.gz YVOZPGGESQSMOH-UHFFFAOYSA-N 1 1 334.338 3.861 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2cccs2)CC1 ZINC000490084794 1040351696 /nfs/dbraw/zinc/35/16/96/1040351696.db2.gz CSUQMGRZWBCHFL-CQSZACIVSA-N 1 1 331.441 3.848 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787134 1040444755 /nfs/dbraw/zinc/44/47/55/1040444755.db2.gz HEDIZDDHMCMDDG-YOEHRIQHSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1OC ZINC000178730334 1040773923 /nfs/dbraw/zinc/77/39/23/1040773923.db2.gz POBRZNRBKPYOTG-MRXNPFEDSA-N 1 1 330.384 3.853 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735760 1040886238 /nfs/dbraw/zinc/88/62/38/1040886238.db2.gz SHPRGLJINCGHBX-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000555665339 1040974761 /nfs/dbraw/zinc/97/47/61/1040974761.db2.gz AYERRSPRJHJVBQ-CQSZACIVSA-N 1 1 338.407 3.959 20 5 EHBDMO CCC[N@@H+]1CC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173349 1040991046 /nfs/dbraw/zinc/99/10/46/1040991046.db2.gz GHBAZFJDXQENIC-KDOFPFPSSA-N 1 1 331.460 3.639 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173349 1040991067 /nfs/dbraw/zinc/99/10/67/1040991067.db2.gz GHBAZFJDXQENIC-KDOFPFPSSA-N 1 1 331.460 3.639 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1Cc2ccccc2C1 ZINC000511658258 1041040443 /nfs/dbraw/zinc/04/04/43/1041040443.db2.gz WAQCQZNYCNSMCP-UHFFFAOYSA-N 1 1 326.396 3.593 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799439 1042700822 /nfs/dbraw/zinc/70/08/22/1042700822.db2.gz ZMGDHQPYHQJVRS-XJKSGUPXSA-N 1 1 334.416 3.782 20 5 EHBDMO COc1cccc(NCc2ccc(C)[nH+]c2N2CCCC2)c1[N+](=O)[O-] ZINC000613889617 1042704072 /nfs/dbraw/zinc/70/40/72/1042704072.db2.gz UUHZKJKXBDGXAV-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000159231216 1042764856 /nfs/dbraw/zinc/76/48/56/1042764856.db2.gz MZBZEVAEPSEPLJ-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])CCO2 ZINC000893639457 1043375826 /nfs/dbraw/zinc/37/58/26/1043375826.db2.gz DJDUAYNZNJZRIW-HNNXBMFYSA-N 1 1 348.786 3.870 20 5 EHBDMO C[N@H+](Cc1ccc(F)c(Cl)c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000763836376 1126882362 /nfs/dbraw/zinc/88/23/62/1126882362.db2.gz MRAWKWIKDZFDTG-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1ccnc(NCc2ccccc2C[N@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000301309804 1127736095 /nfs/dbraw/zinc/73/60/95/1127736095.db2.gz YDZUXEUYRZNDMF-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO C[C@@H]1CCN(c2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301467681 1128451936 /nfs/dbraw/zinc/45/19/36/1128451936.db2.gz YLKQJZHBRWPDSK-OAHLLOKOSA-N 1 1 343.402 3.835 20 5 EHBDMO Cc1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301545489 1128495815 /nfs/dbraw/zinc/49/58/15/1128495815.db2.gz OSLFSWVMLAQOJF-RDJZCZTQSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564053 1128497938 /nfs/dbraw/zinc/49/79/38/1128497938.db2.gz VRNPDEUWRPYHDB-WBVHZDCISA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000301599729 1128509203 /nfs/dbraw/zinc/50/92/03/1128509203.db2.gz UOTNMZGRCSCEEB-DOTOQJQBSA-N 1 1 340.427 3.621 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000153796151 1128690452 /nfs/dbraw/zinc/69/04/52/1128690452.db2.gz HDTSLWLXMBMSQP-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000172619122 1128736799 /nfs/dbraw/zinc/73/67/99/1128736799.db2.gz JHKLFYKYDKZEEI-WBVHZDCISA-N 1 1 347.462 3.943 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC001648832759 1120050565 /nfs/dbraw/zinc/05/05/65/1120050565.db2.gz LDLRYGLFWQZQHJ-IAQYHMDHSA-N 1 1 333.413 3.754 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253073330 1120116640 /nfs/dbraw/zinc/11/66/40/1120116640.db2.gz OTENNZRWTPXREB-WDEREUQCSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253073330 1120116642 /nfs/dbraw/zinc/11/66/42/1120116642.db2.gz OTENNZRWTPXREB-WDEREUQCSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cccnc1 ZINC000162128533 1120197929 /nfs/dbraw/zinc/19/79/29/1120197929.db2.gz HBQSQAGJXSWOJJ-SNVBAGLBSA-N 1 1 336.189 3.603 20 5 EHBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000494266757 1120524298 /nfs/dbraw/zinc/52/42/98/1120524298.db2.gz AQWJPCQALMSSAV-NTCAYCPXSA-N 1 1 339.395 3.569 20 5 EHBDMO C/C(=C\c1ccccc1)C[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000494266757 1120524301 /nfs/dbraw/zinc/52/43/01/1120524301.db2.gz AQWJPCQALMSSAV-NTCAYCPXSA-N 1 1 339.395 3.569 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+](CCO)CC1CCCCC1 ZINC000494672535 1120717035 /nfs/dbraw/zinc/71/70/35/1120717035.db2.gz ZMCVEQOAXPQCOU-UHFFFAOYSA-N 1 1 326.824 3.623 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+](CCO)CC1CCCCC1 ZINC000494672535 1120717039 /nfs/dbraw/zinc/71/70/39/1120717039.db2.gz ZMCVEQOAXPQCOU-UHFFFAOYSA-N 1 1 326.824 3.623 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301057355 1121203325 /nfs/dbraw/zinc/20/33/25/1121203325.db2.gz BBYYIQWOAXWXMS-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000311001842 1128975703 /nfs/dbraw/zinc/97/57/03/1128975703.db2.gz INDGZJRTCYIUPE-MSOLQXFVSA-N 1 1 337.423 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC000762634427 1121392992 /nfs/dbraw/zinc/39/29/92/1121392992.db2.gz PBBUJTREURDSHB-OALUTQOASA-N 1 1 326.396 3.855 20 5 EHBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])c2cnccc12)C1CCCCC1 ZINC000301080932 1121464479 /nfs/dbraw/zinc/46/44/79/1121464479.db2.gz COVOBCMUGYDASA-UHFFFAOYSA-N 1 1 328.416 3.819 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000301104693 1121919610 /nfs/dbraw/zinc/91/96/10/1121919610.db2.gz VMIAJXLYRFLMSP-CHWSQXEVSA-N 1 1 329.322 3.652 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)cc1[N+](=O)[O-] ZINC000763393061 1122225573 /nfs/dbraw/zinc/22/55/73/1122225573.db2.gz LHYXCGGVTVBZBB-KRWDZBQOSA-N 1 1 342.443 3.745 20 5 EHBDMO Cc1nn(C[N@@H+]2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)cc1[N+](=O)[O-] ZINC000763393061 1122225578 /nfs/dbraw/zinc/22/55/78/1122225578.db2.gz LHYXCGGVTVBZBB-KRWDZBQOSA-N 1 1 342.443 3.745 20 5 EHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373077 1122586338 /nfs/dbraw/zinc/58/63/38/1122586338.db2.gz RYXQVYFTNQFPSG-ZNOIYHFQSA-N 1 1 344.386 3.850 20 5 EHBDMO CCCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)CC ZINC000917436379 1122601540 /nfs/dbraw/zinc/60/15/40/1122601540.db2.gz BZTRFPQUHDPKOT-CQSZACIVSA-N 1 1 331.420 3.711 20 5 EHBDMO CC[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000556945848 1123226787 /nfs/dbraw/zinc/22/67/87/1123226787.db2.gz DKRKLIWTQHOVDQ-ZDUSSCGKSA-N 1 1 348.374 3.729 20 5 EHBDMO CCC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCCO1 ZINC000609314338 1123354916 /nfs/dbraw/zinc/35/49/16/1123354916.db2.gz DNXVISRUMCSBLO-SFHVURJKSA-N 1 1 336.432 3.645 20 5 EHBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916575 1123691641 /nfs/dbraw/zinc/69/16/41/1123691641.db2.gz YCTABOITTRVVHU-GOEBONIOSA-N 1 1 344.386 3.991 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610004494 1123712031 /nfs/dbraw/zinc/71/20/31/1123712031.db2.gz MQCRJUGNLRCLKG-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610004494 1123712035 /nfs/dbraw/zinc/71/20/35/1123712035.db2.gz MQCRJUGNLRCLKG-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000301820950 1129144130 /nfs/dbraw/zinc/14/41/30/1129144130.db2.gz JRTZWJMBDCHHID-MWLCHTKSSA-N 1 1 329.322 3.651 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000114494589 1129152285 /nfs/dbraw/zinc/15/22/85/1129152285.db2.gz YOWJKMFTCGJXMQ-LJQANCHMSA-N 1 1 343.427 3.664 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000114494589 1129152288 /nfs/dbraw/zinc/15/22/88/1129152288.db2.gz YOWJKMFTCGJXMQ-LJQANCHMSA-N 1 1 343.427 3.664 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216826 1124100495 /nfs/dbraw/zinc/10/04/95/1124100495.db2.gz ZQJWZVYOHHMWIH-NVXWUHKLSA-N 1 1 348.443 3.632 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccco2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000066436393 1129169593 /nfs/dbraw/zinc/16/95/93/1129169593.db2.gz FNHCSDBGYXQQAV-QGZVFWFLSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000066436393 1129169598 /nfs/dbraw/zinc/16/95/98/1129169598.db2.gz FNHCSDBGYXQQAV-QGZVFWFLSA-N 1 1 330.384 3.677 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000078625292 1129174250 /nfs/dbraw/zinc/17/42/50/1129174250.db2.gz YUMXOCPYYNLACX-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000181815970 1125048406 /nfs/dbraw/zinc/04/84/06/1125048406.db2.gz ZPQBEYNZGNZZCL-LBPRGKRZSA-N 1 1 346.358 3.680 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000618980874 1125255901 /nfs/dbraw/zinc/25/59/01/1125255901.db2.gz QSAUTSUPNKUBAB-UHFFFAOYSA-N 1 1 332.429 3.573 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000078704597 1129185136 /nfs/dbraw/zinc/18/51/36/1129185136.db2.gz WRRBBFCFKMLGID-SJLPKXTDSA-N 1 1 331.460 3.681 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ncccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000301859697 1129215729 /nfs/dbraw/zinc/21/57/29/1129215729.db2.gz DDPDIHBRKGKUCE-DZGCQCFKSA-N 1 1 332.791 3.501 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000301859697 1129215732 /nfs/dbraw/zinc/21/57/32/1129215732.db2.gz DDPDIHBRKGKUCE-DZGCQCFKSA-N 1 1 332.791 3.501 20 5 EHBDMO C[C@H]1CO[C@H](c2ccccc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851864 1129216457 /nfs/dbraw/zinc/21/64/57/1129216457.db2.gz IFPUYHOMJJFCKJ-KXBFYZLASA-N 1 1 326.396 3.599 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C(F)(F)F ZINC000369968322 1129225137 /nfs/dbraw/zinc/22/51/37/1129225137.db2.gz YUEBOHNZJPHRLF-VXGBXAGGSA-N 1 1 329.322 3.652 20 5 EHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255902961 1129225556 /nfs/dbraw/zinc/22/55/56/1129225556.db2.gz TUXPZXDSCXWWDG-PKYBCLHXSA-N 1 1 326.396 3.877 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301884961 1129265634 /nfs/dbraw/zinc/26/56/34/1129265634.db2.gz ZFBICBNHWZSNRL-HNNXBMFYSA-N 1 1 340.427 3.801 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000301989613 1129486531 /nfs/dbraw/zinc/48/65/31/1129486531.db2.gz ONAIKAYHNDNOCD-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000154947054 1129600969 /nfs/dbraw/zinc/60/09/69/1129600969.db2.gz UUBVJQWKFHQRGD-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCCc3c2cnn3C)cc1[N+](=O)[O-] ZINC000093864066 1129606056 /nfs/dbraw/zinc/60/60/56/1129606056.db2.gz KOILOZZKVWQDRX-KRWDZBQOSA-N 1 1 342.443 3.961 20 5 EHBDMO CCC1CCC([N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000330627268 1129642017 /nfs/dbraw/zinc/64/20/17/1129642017.db2.gz JWWQUEXDTKIURV-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCCc3ccccc3)CC2)cs1 ZINC000125692311 1129710278 /nfs/dbraw/zinc/71/02/78/1129710278.db2.gz KKHZQHWGLUCQGG-UHFFFAOYSA-N 1 1 346.452 3.880 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000302207310 1129772875 /nfs/dbraw/zinc/77/28/75/1129772875.db2.gz XJHPIQVARRZXLT-AWEZNQCLSA-N 1 1 328.416 3.595 20 5 EHBDMO CCC[N@@H+]1CC[C@@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302207310 1129772880 /nfs/dbraw/zinc/77/28/80/1129772880.db2.gz XJHPIQVARRZXLT-AWEZNQCLSA-N 1 1 328.416 3.595 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302207310 1129772884 /nfs/dbraw/zinc/77/28/84/1129772884.db2.gz XJHPIQVARRZXLT-AWEZNQCLSA-N 1 1 328.416 3.595 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000303471965 1129848128 /nfs/dbraw/zinc/84/81/28/1129848128.db2.gz QWWWSXWTASTBIP-KRWDZBQOSA-N 1 1 338.473 3.971 20 5 EHBDMO CC[C@H]1C[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000245453904 1130212599 /nfs/dbraw/zinc/21/25/99/1130212599.db2.gz ROWMOXKRFSTZEG-RISCZKNCSA-N 1 1 348.428 3.533 20 5 EHBDMO CC[C@H]1C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000245453904 1130212604 /nfs/dbraw/zinc/21/26/04/1130212604.db2.gz ROWMOXKRFSTZEG-RISCZKNCSA-N 1 1 348.428 3.533 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794893 1131082526 /nfs/dbraw/zinc/08/25/26/1131082526.db2.gz HITFVLDUVBCBSW-HZPDHXFCSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@]4(CC=CCC4)C3)c2c1 ZINC000733991507 1131179975 /nfs/dbraw/zinc/17/99/75/1131179975.db2.gz FYUQSLQCDUYBOQ-GOSISDBHSA-N 1 1 326.400 3.724 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738243100 1131466845 /nfs/dbraw/zinc/46/68/45/1131466845.db2.gz OCWRLWXASUIMAR-CYBMUJFWSA-N 1 1 347.415 3.608 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738243100 1131466848 /nfs/dbraw/zinc/46/68/48/1131466848.db2.gz OCWRLWXASUIMAR-CYBMUJFWSA-N 1 1 347.415 3.608 20 5 EHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146881 1131690933 /nfs/dbraw/zinc/69/09/33/1131690933.db2.gz QUTPUKJPDRUQSA-HNNXBMFYSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](F)C(F)(F)CC1)CC2 ZINC001172907904 1131887207 /nfs/dbraw/zinc/88/72/07/1131887207.db2.gz JJPLPXJAMUCTLY-HOCLYGCPSA-N 1 1 342.361 3.911 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381102 1131914145 /nfs/dbraw/zinc/91/41/45/1131914145.db2.gz VZVFOFQIPWOCED-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](c3ccncc3)C1)CC2 ZINC001172911303 1131917464 /nfs/dbraw/zinc/91/74/64/1131917464.db2.gz SECGJTKBRZQOTF-MOPGFXCFSA-N 1 1 337.423 3.727 20 5 EHBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184461 1131993939 /nfs/dbraw/zinc/99/39/39/1131993939.db2.gz NLNGUFBXLZLSFZ-CYBMUJFWSA-N 1 1 347.390 3.591 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223482 1132005212 /nfs/dbraw/zinc/00/52/12/1132005212.db2.gz ANFJYUGABFRLNS-OXJNMPFZSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001173225507 1132006952 /nfs/dbraw/zinc/00/69/52/1132006952.db2.gz CTAUERXGTCDXFH-RHSMWYFYSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001173225507 1132006960 /nfs/dbraw/zinc/00/69/60/1132006960.db2.gz CTAUERXGTCDXFH-RHSMWYFYSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)c1cccs1 ZINC001173230804 1132009693 /nfs/dbraw/zinc/00/96/93/1132009693.db2.gz GQEFQAZTXISVET-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN(C)Cc1ccccc1 ZINC001173232609 1132009889 /nfs/dbraw/zinc/00/98/89/1132009889.db2.gz RWYLIRAVAFJXKM-QGZVFWFLSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CC[N@H+](C)Cc1ccccc1 ZINC001173232609 1132009897 /nfs/dbraw/zinc/00/98/97/1132009897.db2.gz RWYLIRAVAFJXKM-QGZVFWFLSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CC[N@@H+](C)Cc1ccccc1 ZINC001173232609 1132009906 /nfs/dbraw/zinc/00/99/06/1132009906.db2.gz RWYLIRAVAFJXKM-QGZVFWFLSA-N 1 1 341.455 3.590 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@@H]1c1ccccc1 ZINC000746382058 1132504524 /nfs/dbraw/zinc/50/45/24/1132504524.db2.gz LLHYMIIRJVZQLA-AEFFLSMTSA-N 1 1 342.443 3.881 20 5 EHBDMO CC(=O)N=C1C=C[N@@H+](c2cc3ccccc3c3ccccc32)C=C1N ZINC001175111419 1132557326 /nfs/dbraw/zinc/55/73/26/1132557326.db2.gz ACPKFUYYMYVVOK-UHFFFAOYSA-N 1 1 327.387 3.813 20 5 EHBDMO CC(=O)N=C1C=C[N@H+](c2cc3ccccc3c3ccccc32)C=C1N ZINC001175111419 1132557330 /nfs/dbraw/zinc/55/73/30/1132557330.db2.gz ACPKFUYYMYVVOK-UHFFFAOYSA-N 1 1 327.387 3.813 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037125 1132637339 /nfs/dbraw/zinc/63/73/39/1132637339.db2.gz JBPHTXISHRIDJD-KCXAZCMYSA-N 1 1 340.876 3.875 20 5 EHBDMO CC[N@@H+](Cc1ccc(Br)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040064 1132637983 /nfs/dbraw/zinc/63/79/83/1132637983.db2.gz XLGICOTYVBMQIY-UKRRQHHQSA-N 1 1 341.249 3.716 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC001175688941 1132738546 /nfs/dbraw/zinc/73/85/46/1132738546.db2.gz QVIWUJIEBPVSTR-KRWDZBQOSA-N 1 1 348.443 3.632 20 5 EHBDMO CCOc1ccc(CC[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001176832599 1133004144 /nfs/dbraw/zinc/00/41/44/1133004144.db2.gz FKCNJTZTFPDQPJ-UHFFFAOYSA-N 1 1 328.412 3.976 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765742 1133050257 /nfs/dbraw/zinc/05/02/57/1133050257.db2.gz RWZYZTWFGXRRHN-INIZCTEOSA-N 1 1 343.431 3.856 20 5 EHBDMO CCCC[N@@H+]1CCCC[C@H]1CNCc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741715 1133098101 /nfs/dbraw/zinc/09/81/01/1133098101.db2.gz CHZLCYBMGKNVBN-KRWDZBQOSA-N 1 1 333.476 3.956 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNCc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741715 1133098107 /nfs/dbraw/zinc/09/81/07/1133098107.db2.gz CHZLCYBMGKNVBN-KRWDZBQOSA-N 1 1 333.476 3.956 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc2c(cc[nH]c2=O)o1)c1cccc([N+](=O)[O-])c1 ZINC001178203198 1133142559 /nfs/dbraw/zinc/14/25/59/1133142559.db2.gz ATVWUVAIZVZWAN-OAHLLOKOSA-N 1 1 327.340 3.683 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769856148 1133351858 /nfs/dbraw/zinc/35/18/58/1133351858.db2.gz SXOKDDOVEZFGCV-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1F)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769856148 1133351862 /nfs/dbraw/zinc/35/18/62/1133351862.db2.gz SXOKDDOVEZFGCV-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001183831465 1133862288 /nfs/dbraw/zinc/86/22/88/1133862288.db2.gz BZMHXEFLQMXRBP-ZDUSSCGKSA-N 1 1 334.363 3.691 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCS[C@H](C(F)(F)F)C1 ZINC001183831465 1133862292 /nfs/dbraw/zinc/86/22/92/1133862292.db2.gz BZMHXEFLQMXRBP-ZDUSSCGKSA-N 1 1 334.363 3.691 20 5 EHBDMO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001184839179 1133996473 /nfs/dbraw/zinc/99/64/73/1133996473.db2.gz DIWOTZCYRAENNB-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO CC[N@H+](Cc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774834064 1134035799 /nfs/dbraw/zinc/03/57/99/1134035799.db2.gz TVAZVWATBPDVQW-UHFFFAOYSA-N 1 1 329.356 3.834 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774834064 1134035806 /nfs/dbraw/zinc/03/58/06/1134035806.db2.gz TVAZVWATBPDVQW-UHFFFAOYSA-N 1 1 329.356 3.834 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000774883955 1134091729 /nfs/dbraw/zinc/09/17/29/1134091729.db2.gz FTCFWZAMIJRFEL-ZDUSSCGKSA-N 1 1 345.330 3.632 20 5 EHBDMO C[C@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)OC(C)(C)C ZINC000788489121 1134131140 /nfs/dbraw/zinc/13/11/40/1134131140.db2.gz VMQJJJBYFLYAOM-LLVKDONJSA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)OC(C)(C)C ZINC000788489121 1134131143 /nfs/dbraw/zinc/13/11/43/1134131143.db2.gz VMQJJJBYFLYAOM-LLVKDONJSA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@@H](NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804146 1134171065 /nfs/dbraw/zinc/17/10/65/1134171065.db2.gz VBTXNANVUQWXDV-PBHICJAKSA-N 1 1 346.475 3.625 20 5 EHBDMO C[C@@H]([NH2+]C[C@@H]1CCCN1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804146 1134171068 /nfs/dbraw/zinc/17/10/68/1134171068.db2.gz VBTXNANVUQWXDV-PBHICJAKSA-N 1 1 346.475 3.625 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350556 1134760613 /nfs/dbraw/zinc/76/06/13/1134760613.db2.gz BCKOBKZPJAPXAH-KSSFIOAISA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214064 1134818722 /nfs/dbraw/zinc/81/87/22/1134818722.db2.gz MAZLJVQMBFBLOU-MSOLQXFVSA-N 1 1 342.443 3.676 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3cccnc3F)o2)c1 ZINC000793290740 1134896266 /nfs/dbraw/zinc/89/62/66/1134896266.db2.gz XCWYYWBTYFZVOK-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1 ZINC000804812737 1135202256 /nfs/dbraw/zinc/20/22/56/1135202256.db2.gz SHZWFUFIHVRMKF-FQEVSTJZSA-N 1 1 337.423 3.697 20 5 EHBDMO CN(c1c(Cl)cc([N+](=O)[O-])cc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000804815694 1135202988 /nfs/dbraw/zinc/20/29/88/1135202988.db2.gz YABZUFQDOPZGDU-ZACCUICWSA-N 1 1 344.242 3.963 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](C3CC3)C2)ccc1Br ZINC000808777066 1135735217 /nfs/dbraw/zinc/73/52/17/1135735217.db2.gz VKTCAMFYLOHOTH-CYBMUJFWSA-N 1 1 339.233 3.979 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](C3CC3)C2)ccc1Br ZINC000808777066 1135735219 /nfs/dbraw/zinc/73/52/19/1135735219.db2.gz VKTCAMFYLOHOTH-CYBMUJFWSA-N 1 1 339.233 3.979 20 5 EHBDMO CCC(CC)[C@@H](CNC/C(C)=C/c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC001199170654 1135884497 /nfs/dbraw/zinc/88/44/97/1135884497.db2.gz LZCHRVRIPWXFKP-FERCGXDMSA-N 1 1 333.476 3.954 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1Cl ZINC000809758408 1135887828 /nfs/dbraw/zinc/88/78/28/1135887828.db2.gz MFVUIQLNSTXQAX-DZGCQCFKSA-N 1 1 338.835 3.887 20 5 EHBDMO C[C@@H](Cc1[nH]cc[nH+]1)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809960565 1135906966 /nfs/dbraw/zinc/90/69/66/1135906966.db2.gz QJMDYCUWOAJQBF-QMMMGPOBSA-N 1 1 330.171 3.773 20 5 EHBDMO C[C@@H](CO)[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999424 1135912612 /nfs/dbraw/zinc/91/26/12/1135912612.db2.gz HLFBNPMPKMLSDK-JTQLQIEISA-N 1 1 347.242 3.885 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274467 1136129688 /nfs/dbraw/zinc/12/96/88/1136129688.db2.gz DHHTXZGLEQQZPK-SJCJKPOMSA-N 1 1 334.803 3.975 20 5 EHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCO1 ZINC000338942166 1136435997 /nfs/dbraw/zinc/43/59/97/1136435997.db2.gz DPXQDGYYEIBTFW-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585018 1136442405 /nfs/dbraw/zinc/44/24/05/1136442405.db2.gz QXZCMFQLLSPSJU-WRWLIDTKSA-N 1 1 340.423 3.815 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC000776582426 1136442566 /nfs/dbraw/zinc/44/25/66/1136442566.db2.gz QAGBUAICFGHAOT-XLIONFOSSA-N 1 1 340.423 3.583 20 5 EHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588185 1136446073 /nfs/dbraw/zinc/44/60/73/1136446073.db2.gz MDZFVILGWLIJNP-UPRAQXHNSA-N 1 1 344.386 3.850 20 5 EHBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592493 1136454373 /nfs/dbraw/zinc/45/43/73/1136454373.db2.gz OXCPKEBBPPXBKE-ZTNFWEORSA-N 1 1 340.423 3.581 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)c1cccc2ccccc21 ZINC000815009711 1136536845 /nfs/dbraw/zinc/53/68/45/1136536845.db2.gz KRGNQRCPWUFFBK-FQEVSTJZSA-N 1 1 336.391 3.913 20 5 EHBDMO C[C@@H](OC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445443 1136596375 /nfs/dbraw/zinc/59/63/75/1136596375.db2.gz YSCJKCLJXBIIKR-RDTXWAMCSA-N 1 1 346.427 3.996 20 5 EHBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000339000371 1136825176 /nfs/dbraw/zinc/82/51/76/1136825176.db2.gz LRNAODBBBOLARG-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839897 1136895027 /nfs/dbraw/zinc/89/50/27/1136895027.db2.gz UENAJHQRQGOMMZ-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO CCCC[N@H+](C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819438227 1136939440 /nfs/dbraw/zinc/93/94/40/1136939440.db2.gz RQFYSGSLTOUFRE-IBGZPJMESA-N 1 1 343.427 3.977 20 5 EHBDMO CCCC[N@@H+](C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819438227 1136939442 /nfs/dbraw/zinc/93/94/42/1136939442.db2.gz RQFYSGSLTOUFRE-IBGZPJMESA-N 1 1 343.427 3.977 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@](C)(O)c1ccccc1 ZINC000823590559 1137105161 /nfs/dbraw/zinc/10/51/61/1137105161.db2.gz DZJIOROMBNIBRQ-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO COc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)nc1 ZINC000844352127 1137214495 /nfs/dbraw/zinc/21/44/95/1137214495.db2.gz UABMSVCRCBXQTR-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865731376 1137307673 /nfs/dbraw/zinc/30/76/73/1137307673.db2.gz LKDJLCXJWWQBRP-NSHDSACASA-N 1 1 336.342 3.650 20 5 EHBDMO CCCn1c2ccccc2nc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000865786498 1137311703 /nfs/dbraw/zinc/31/17/03/1137311703.db2.gz OLLVRKVLPMFGIN-UHFFFAOYSA-N 1 1 338.411 3.953 20 5 EHBDMO C[C@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1F ZINC000846013163 1137326117 /nfs/dbraw/zinc/32/61/17/1137326117.db2.gz KOEKBMHOFLKMOY-QFYYESIMSA-N 1 1 338.766 3.599 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846118235 1137334008 /nfs/dbraw/zinc/33/40/08/1137334008.db2.gz WEMDMCYKWPTGED-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846118235 1137334010 /nfs/dbraw/zinc/33/40/10/1137334010.db2.gz WEMDMCYKWPTGED-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO C[C@H]1CC[C@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100778 1137484672 /nfs/dbraw/zinc/48/46/72/1137484672.db2.gz VCGUXVDPVGHTRM-NHYWBVRUSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1sc(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000888570819 1137542269 /nfs/dbraw/zinc/54/22/69/1137542269.db2.gz RLKMFIPHRUJTDO-UHFFFAOYSA-N 1 1 346.412 3.602 20 5 EHBDMO COc1ccncc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872072587 1137569797 /nfs/dbraw/zinc/56/97/97/1137569797.db2.gz IHHRUPZWQYFMDD-NSHDSACASA-N 1 1 333.413 3.571 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc2c1CCOC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872093714 1137570940 /nfs/dbraw/zinc/57/09/40/1137570940.db2.gz WHDYQNCUCVHOOP-GFCCVEGCSA-N 1 1 330.359 3.657 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1nccnc1C ZINC000872130590 1137573140 /nfs/dbraw/zinc/57/31/40/1137573140.db2.gz JJYSPIPFTJLSJZ-JQWIXIFHSA-N 1 1 332.429 3.827 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872262103 1137576804 /nfs/dbraw/zinc/57/68/04/1137576804.db2.gz PNIOXVMNJKSEOZ-INIZCTEOSA-N 1 1 334.416 3.527 20 5 EHBDMO Cc1c(C[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000873101708 1137590173 /nfs/dbraw/zinc/59/01/73/1137590173.db2.gz HUMAKPQEWNIBOF-MRXNPFEDSA-N 1 1 328.416 3.848 20 5 EHBDMO C[C@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccccc1[N+](=O)[O-] ZINC000873183765 1137592972 /nfs/dbraw/zinc/59/29/72/1137592972.db2.gz HCCFLEMDTGIVAL-ZDUSSCGKSA-N 1 1 328.368 3.607 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccns1 ZINC000877659638 1137684564 /nfs/dbraw/zinc/68/45/64/1137684564.db2.gz YILKYUYPWXAVEB-ZCFIWIBFSA-N 1 1 348.247 3.726 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877797491 1137690284 /nfs/dbraw/zinc/69/02/84/1137690284.db2.gz VOONVPACVOOTNC-CQSZACIVSA-N 1 1 344.411 3.838 20 5 EHBDMO Cc1csc([C@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813824 1137691119 /nfs/dbraw/zinc/69/11/19/1137691119.db2.gz PKNJCVQOEWWUBX-DRDHIDPGSA-N 1 1 329.425 3.862 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCCC3(CC3)C2)o1 ZINC000878444369 1137716397 /nfs/dbraw/zinc/71/63/97/1137716397.db2.gz BUAAXYXKXQXKFI-UHFFFAOYSA-N 1 1 348.790 3.674 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCCC3(CC3)C2)o1 ZINC000878444369 1137716398 /nfs/dbraw/zinc/71/63/98/1137716398.db2.gz BUAAXYXKXQXKFI-UHFFFAOYSA-N 1 1 348.790 3.674 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879497581 1137749330 /nfs/dbraw/zinc/74/93/30/1137749330.db2.gz CSCUYTHNNQNJOS-RDTXWAMCSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879497581 1137749331 /nfs/dbraw/zinc/74/93/31/1137749331.db2.gz CSCUYTHNNQNJOS-RDTXWAMCSA-N 1 1 338.411 3.535 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000879731134 1137756895 /nfs/dbraw/zinc/75/68/95/1137756895.db2.gz IGGZMOORCVILPO-AWEZNQCLSA-N 1 1 345.399 3.670 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@H]2c2cncc(C)c2)cc1[N+](=O)[O-] ZINC000879747983 1137757627 /nfs/dbraw/zinc/75/76/27/1137757627.db2.gz VTQUTISOACIUNN-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2cncc(C)c2)cc1[N+](=O)[O-] ZINC000879747983 1137757628 /nfs/dbraw/zinc/75/76/28/1137757628.db2.gz VTQUTISOACIUNN-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cccc([C@@H]2CC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2(C)C)c1 ZINC000880284597 1137773235 /nfs/dbraw/zinc/77/32/35/1137773235.db2.gz AYJWMOSIBCLGBM-HNNXBMFYSA-N 1 1 345.399 3.668 20 5 EHBDMO 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EHBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137756 1141507102 /nfs/dbraw/zinc/50/71/02/1141507102.db2.gz GBVYMPDFSRTHBX-YPMHNXCESA-N 1 1 346.349 3.739 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]1c1ccccc1 ZINC000348527562 1141546129 /nfs/dbraw/zinc/54/61/29/1141546129.db2.gz TWHSHQNAUOMCAU-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348541160 1141548601 /nfs/dbraw/zinc/54/86/01/1141548601.db2.gz QQLHZEYAMTZNLR-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000047265486 201108285 /nfs/dbraw/zinc/10/82/85/201108285.db2.gz HLZIZTAJUDKONK-CQSZACIVSA-N 1 1 345.424 3.507 20 5 EHBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000047265486 201108289 /nfs/dbraw/zinc/10/82/89/201108289.db2.gz HLZIZTAJUDKONK-CQSZACIVSA-N 1 1 345.424 3.507 20 5 EHBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 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XCSUMBNFQMHZMZ-MRXNPFEDSA-N 1 1 343.402 3.835 20 5 EHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCCN(c2ccccc2)C1 ZINC000471166507 1015180771 /nfs/dbraw/zinc/18/07/71/1015180771.db2.gz XCSUMBNFQMHZMZ-MRXNPFEDSA-N 1 1 343.402 3.835 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000246922508 1016083729 /nfs/dbraw/zinc/08/37/29/1016083729.db2.gz GOCYNTSAKDXIKP-VQIMIIECSA-N 1 1 345.487 3.626 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177575772 1016387051 /nfs/dbraw/zinc/38/70/51/1016387051.db2.gz HONQGCBRCMILFQ-AEGPPILISA-N 1 1 342.399 3.828 20 5 EHBDMO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000538278705 1032266997 /nfs/dbraw/zinc/26/69/97/1032266997.db2.gz AJTQVDQTBRXRIV-ZIAGYGMSSA-N 1 1 327.384 3.581 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000597664909 1032597990 /nfs/dbraw/zinc/59/79/90/1032597990.db2.gz AIBVAXOYSOLDKD-OAHLLOKOSA-N 1 1 345.443 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O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](CNc2ccccn2)C1 ZINC000119197875 1018127940 /nfs/dbraw/zinc/12/79/40/1018127940.db2.gz FMOSNVHTNVOKKY-ZDUSSCGKSA-N 1 1 346.818 3.577 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)Cc1cnccn1 ZINC000092591190 1018437903 /nfs/dbraw/zinc/43/79/03/1018437903.db2.gz OWFYMNVDKMCHIW-UHFFFAOYSA-N 1 1 340.408 3.745 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)Cc1cnccn1 ZINC000092591190 1018437911 /nfs/dbraw/zinc/43/79/11/1018437911.db2.gz OWFYMNVDKMCHIW-UHFFFAOYSA-N 1 1 340.408 3.745 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000468629503 1018530633 /nfs/dbraw/zinc/53/06/33/1018530633.db2.gz FDXSLNZJHGEFJZ-GANRHZMWSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000468629503 1018530644 /nfs/dbraw/zinc/53/06/44/1018530644.db2.gz FDXSLNZJHGEFJZ-GANRHZMWSA-N 1 1 331.460 3.708 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371725 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1 334.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2nccnc2c1)C1CC1 ZINC000602440272 1032890646 /nfs/dbraw/zinc/89/06/46/1032890646.db2.gz PNUZMIBWTBKOSK-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000602476366 1032897964 /nfs/dbraw/zinc/89/79/64/1032897964.db2.gz OLGYSPIGJQYKQT-RISCZKNCSA-N 1 1 345.365 3.528 20 5 EHBDMO C[C@@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188760 1020546360 /nfs/dbraw/zinc/54/63/60/1020546360.db2.gz DKNFGLYDYGIMST-HLLBOEOZSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188760 1020546369 /nfs/dbraw/zinc/54/63/69/1020546369.db2.gz DKNFGLYDYGIMST-HLLBOEOZSA-N 1 1 331.460 3.898 20 5 EHBDMO Cc1csc(C[C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000933127123 1020631611 /nfs/dbraw/zinc/63/16/11/1020631611.db2.gz WDUPGOLZQIRAGZ-GFCCVEGCSA-N 1 1 335.404 3.563 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403172 1020767666 /nfs/dbraw/zinc/76/76/66/1020767666.db2.gz UDIOURXSBPUGRQ-KSSFIOAISA-N 1 1 336.395 3.953 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507667348 1021425504 /nfs/dbraw/zinc/42/55/04/1021425504.db2.gz URZYPFCWOPBDPA-QGZVFWFLSA-N 1 1 326.396 3.668 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccccc2OC)C1 ZINC000157922696 1021717999 /nfs/dbraw/zinc/71/79/99/1021717999.db2.gz UNBPSGMSOBISAB-AWEZNQCLSA-N 1 1 342.395 3.602 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000891499839 1021772978 /nfs/dbraw/zinc/77/29/78/1021772978.db2.gz YUZNXAAEMGBTGB-GFCCVEGCSA-N 1 1 334.397 3.708 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000891499839 1021772993 /nfs/dbraw/zinc/77/29/93/1021772993.db2.gz YUZNXAAEMGBTGB-GFCCVEGCSA-N 1 1 334.397 3.708 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000055911174 1021890654 /nfs/dbraw/zinc/89/06/54/1021890654.db2.gz PHLIVGZRRXECCT-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000055911174 1021890668 /nfs/dbraw/zinc/89/06/68/1021890668.db2.gz PHLIVGZRRXECCT-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO CC(C)[N@@H+](CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506768239 1021969040 /nfs/dbraw/zinc/96/90/40/1021969040.db2.gz STSRTJVGQUMMHA-UHFFFAOYSA-N 1 1 348.374 3.729 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000441223907 1022076927 /nfs/dbraw/zinc/07/69/27/1022076927.db2.gz ZBUSOUCQMSXNOL-MRXNPFEDSA-N 1 1 334.416 3.637 20 5 EHBDMO CC(C)[N@@H+](Cc1cnn(C2CCC2)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891625273 1022144957 /nfs/dbraw/zinc/14/49/57/1022144957.db2.gz NTADCYPGNCSDCS-UHFFFAOYSA-N 1 1 328.416 3.927 20 5 EHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140912 1022177280 /nfs/dbraw/zinc/17/72/80/1022177280.db2.gz LMSANYKSWDPYEN-VURMDHGXSA-N 1 1 330.359 3.758 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000780374021 1022415049 /nfs/dbraw/zinc/41/50/49/1022415049.db2.gz MHASYYGBWWBKKZ-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000780374021 1022415054 /nfs/dbraw/zinc/41/50/54/1022415054.db2.gz MHASYYGBWWBKKZ-CQSZACIVSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000602656829 1033056698 /nfs/dbraw/zinc/05/66/98/1033056698.db2.gz YNZXFUBVIRLZCU-ZFWWWQNUSA-N 1 1 344.333 3.757 20 5 EHBDMO COc1cc(C[NH2+][C@H](c2ncccc2C)C(C)C)c([N+](=O)[O-])cc1F ZINC000184260252 1022661038 /nfs/dbraw/zinc/66/10/38/1022661038.db2.gz UKMHPFXGFZPCEC-KRWDZBQOSA-N 1 1 347.390 3.933 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](CCO)[C@@H]2CCCc3ccccc32)cc1 ZINC000510653279 1022831376 /nfs/dbraw/zinc/83/13/76/1022831376.db2.gz YTVOHVJBMLPYAX-HXUWFJFHSA-N 1 1 340.423 3.509 20 5 EHBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000310199588 1023065862 /nfs/dbraw/zinc/06/58/62/1023065862.db2.gz BPHVEZMWXKODKW-HNNXBMFYSA-N 1 1 346.456 3.766 20 5 EHBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000129482430 1023092583 /nfs/dbraw/zinc/09/25/83/1023092583.db2.gz CBFLGOYXQLMUOY-QGZVFWFLSA-N 1 1 332.425 3.670 20 5 EHBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC000729471722 1023118886 /nfs/dbraw/zinc/11/88/86/1023118886.db2.gz GCOSQKRKWUVCIQ-QGZVFWFLSA-N 1 1 346.406 3.602 20 5 EHBDMO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000507123226 1023141586 /nfs/dbraw/zinc/14/15/86/1023141586.db2.gz XPNXBRFISFVFMN-UHFFFAOYSA-N 1 1 327.428 3.679 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[C@@H]1C ZINC000510793488 1023170463 /nfs/dbraw/zinc/17/04/63/1023170463.db2.gz YKZXDIKRJRZSLY-MEDUHNTESA-N 1 1 328.359 3.510 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[C@@H]1C ZINC000510793488 1023170467 /nfs/dbraw/zinc/17/04/67/1023170467.db2.gz YKZXDIKRJRZSLY-MEDUHNTESA-N 1 1 328.359 3.510 20 5 EHBDMO CCC[C@]1(COC)CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510798532 1023178286 /nfs/dbraw/zinc/17/82/86/1023178286.db2.gz PXATVLVBWRWAFE-MRXNPFEDSA-N 1 1 328.359 3.654 20 5 EHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510798532 1023178292 /nfs/dbraw/zinc/17/82/92/1023178292.db2.gz PXATVLVBWRWAFE-MRXNPFEDSA-N 1 1 328.359 3.654 20 5 EHBDMO CC(C)C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C ZINC000518270150 1023179774 /nfs/dbraw/zinc/17/97/74/1023179774.db2.gz XDYWENXAEHWAAN-KRWDZBQOSA-N 1 1 345.443 3.921 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000063257330 1033135031 /nfs/dbraw/zinc/13/50/31/1033135031.db2.gz WDRJGQDSSZKDES-UHFFFAOYSA-N 1 1 335.404 3.508 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000063257330 1033135041 /nfs/dbraw/zinc/13/50/41/1033135041.db2.gz WDRJGQDSSZKDES-UHFFFAOYSA-N 1 1 335.404 3.508 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1F ZINC000063254798 1033144642 /nfs/dbraw/zinc/14/46/42/1033144642.db2.gz CCTZYOATXLLJNY-UHFFFAOYSA-N 1 1 344.321 3.979 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@](C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000535840815 1023845734 /nfs/dbraw/zinc/84/57/34/1023845734.db2.gz AINKGDXYBNGWLU-KRWDZBQOSA-N 1 1 334.347 3.797 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@](C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000535840815 1023845740 /nfs/dbraw/zinc/84/57/40/1023845740.db2.gz AINKGDXYBNGWLU-KRWDZBQOSA-N 1 1 334.347 3.797 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000060889731 1033174682 /nfs/dbraw/zinc/17/46/82/1033174682.db2.gz AKCUIXDACWJACH-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602804536 1033179233 /nfs/dbraw/zinc/17/92/33/1033179233.db2.gz JGNYGJVHXWESPF-MRXNPFEDSA-N 1 1 346.431 3.604 20 5 EHBDMO Cn1cc(C[N@H+]2CCCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121126065 1024242593 /nfs/dbraw/zinc/24/25/93/1024242593.db2.gz QHMSBTWCIOINPD-UHFFFAOYSA-N 1 1 328.416 3.617 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000434664232 1024276969 /nfs/dbraw/zinc/27/69/69/1024276969.db2.gz TZTCKUNYMYFGQO-UHFFFAOYSA-N 1 1 345.443 3.885 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ncc(C)s2)CC1 ZINC000277288338 1024467169 /nfs/dbraw/zinc/46/71/69/1024467169.db2.gz CQNZEPHASNGUAH-UHFFFAOYSA-N 1 1 347.440 3.748 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957240 1024525446 /nfs/dbraw/zinc/52/54/46/1024525446.db2.gz ZMKBBUVSXQAOEL-WFASDCNBSA-N 1 1 346.818 3.891 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000435055008 1024584572 /nfs/dbraw/zinc/58/45/72/1024584572.db2.gz GKGPVGSPMFWEJU-FERCGXDMSA-N 1 1 339.395 3.546 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](CF)C3)cs2)c1 ZINC000895545931 1024603674 /nfs/dbraw/zinc/60/36/74/1024603674.db2.gz IVVWQGARSJZDLL-GFCCVEGCSA-N 1 1 335.404 3.900 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](CF)C3)cs2)c1 ZINC000895545931 1024603679 /nfs/dbraw/zinc/60/36/79/1024603679.db2.gz IVVWQGARSJZDLL-GFCCVEGCSA-N 1 1 335.404 3.900 20 5 EHBDMO C[NH2+]C[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372023 1024856621 /nfs/dbraw/zinc/85/66/21/1024856621.db2.gz QEOLQUWUJLBKJC-AWEZNQCLSA-N 1 1 345.468 3.755 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](COC(F)F)C2)cc1[N+](=O)[O-] ZINC000582030517 1025057957 /nfs/dbraw/zinc/05/79/57/1025057957.db2.gz VBEKYWITMFJQMT-ZDUSSCGKSA-N 1 1 328.359 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000053232648 1025193270 /nfs/dbraw/zinc/19/32/70/1025193270.db2.gz KYNJOTKUFOIWAG-LJQANCHMSA-N 1 1 326.396 3.776 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000602955052 1033277786 /nfs/dbraw/zinc/27/77/86/1033277786.db2.gz KLSRVXCMPWTQPZ-UHFFFAOYSA-N 1 1 347.440 3.515 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)ccc1[N+](=O)[O-] ZINC000934333231 1025494911 /nfs/dbraw/zinc/49/49/11/1025494911.db2.gz OIFQTJGVNQHCSH-AWEZNQCLSA-N 1 1 347.440 3.515 20 5 EHBDMO COc1c(C)c[nH+]c(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1C ZINC000126936950 1025691320 /nfs/dbraw/zinc/69/13/20/1025691320.db2.gz ZFYABEFLMUBMRF-UHFFFAOYSA-N 1 1 338.367 3.527 20 5 EHBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000439694268 1025705440 /nfs/dbraw/zinc/70/54/40/1025705440.db2.gz VMTBQKJDWMPMFZ-SFHVURJKSA-N 1 1 339.439 3.943 20 5 EHBDMO C[N@@H+](CCCCOc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511098000 1025761781 /nfs/dbraw/zinc/76/17/81/1025761781.db2.gz YWYQVTNSCDCKHA-UHFFFAOYSA-N 1 1 328.412 3.928 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000121234754 1025936846 /nfs/dbraw/zinc/93/68/46/1025936846.db2.gz SRWZPNABAVQJCL-OAHLLOKOSA-N 1 1 328.416 3.821 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441488995 1026001753 /nfs/dbraw/zinc/00/17/53/1026001753.db2.gz INDGGQUCWCADKQ-KBPBESRZSA-N 1 1 336.432 3.881 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000523005622 1026276721 /nfs/dbraw/zinc/27/67/21/1026276721.db2.gz DNRGMWFHSYSYMC-INIZCTEOSA-N 1 1 344.386 3.677 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451845308 1026339821 /nfs/dbraw/zinc/33/98/21/1026339821.db2.gz UPBYLBDEZLBMDP-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451845308 1026339832 /nfs/dbraw/zinc/33/98/32/1026339832.db2.gz UPBYLBDEZLBMDP-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C2CC2)O1 ZINC000475296335 1026448930 /nfs/dbraw/zinc/44/89/30/1026448930.db2.gz UJFKVNNUMBAHNJ-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C2CC2)O1 ZINC000475296335 1026448934 /nfs/dbraw/zinc/44/89/34/1026448934.db2.gz UJFKVNNUMBAHNJ-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000479918073 1026884824 /nfs/dbraw/zinc/88/48/24/1026884824.db2.gz BZJFNHGQTLEDHP-LJQANCHMSA-N 1 1 340.423 3.853 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000611555131 1027058658 /nfs/dbraw/zinc/05/86/58/1027058658.db2.gz OGYXOOLLEDOBFX-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000611555131 1027058669 /nfs/dbraw/zinc/05/86/69/1027058669.db2.gz OGYXOOLLEDOBFX-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO Cc1nccn1CCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125638206 1027103744 /nfs/dbraw/zinc/10/37/44/1027103744.db2.gz NNGRHKGISXPQDC-UHFFFAOYSA-N 1 1 328.416 3.545 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2cc(OC)c([N+](=O)[O-])cc2F)c1 ZINC000091457229 1027889458 /nfs/dbraw/zinc/88/94/58/1027889458.db2.gz VJRCZWHJAZXHJE-UHFFFAOYSA-N 1 1 347.390 3.806 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444622250 1028095852 /nfs/dbraw/zinc/09/58/52/1028095852.db2.gz UXHATJRYQDJCGQ-UHFFFAOYSA-N 1 1 330.413 3.597 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648641 1028112004 /nfs/dbraw/zinc/11/20/04/1028112004.db2.gz HKHOHHZCBJCWGN-UKRRQHHQSA-N 1 1 336.395 3.849 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774637 1028262085 /nfs/dbraw/zinc/26/20/85/1028262085.db2.gz XIPOTSPPRPLUJG-HUUCEWRRSA-N 1 1 333.432 3.598 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000178728676 1028375761 /nfs/dbraw/zinc/37/57/61/1028375761.db2.gz XKIHVDWCQITYNO-MRXNPFEDSA-N 1 1 346.358 3.746 20 5 EHBDMO CC[C@H](NC[C@@H]1[NH2+]CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437952 1028446033 /nfs/dbraw/zinc/44/60/33/1028446033.db2.gz URCVDPDIFXEXQY-OALUTQOASA-N 1 1 325.412 3.523 20 5 EHBDMO COCC[N@@H+](CCc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000508517427 1028485351 /nfs/dbraw/zinc/48/53/51/1028485351.db2.gz GLMXHFJILSSZAS-UHFFFAOYSA-N 1 1 328.412 3.594 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000504495213 1028675586 /nfs/dbraw/zinc/67/55/86/1028675586.db2.gz YUQFKJDEMIGUBM-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000421752132 1028752345 /nfs/dbraw/zinc/75/23/45/1028752345.db2.gz QCHPECXNPZBCAC-INIZCTEOSA-N 1 1 347.459 3.596 20 5 EHBDMO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[N@@H+](C)C1 ZINC000508529782 1028792071 /nfs/dbraw/zinc/79/20/71/1028792071.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@H](C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000508529782 1028792115 /nfs/dbraw/zinc/79/21/15/1028792115.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@H](C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000508529782 1028792121 /nfs/dbraw/zinc/79/21/21/1028792121.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903860 1028831896 /nfs/dbraw/zinc/83/18/96/1028831896.db2.gz TWJLSMGOTFYMHD-MRXNPFEDSA-N 1 1 333.432 3.864 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]CCN2CCCCCC2)cc1[N+](=O)[O-] ZINC000504899139 1029027240 /nfs/dbraw/zinc/02/72/40/1029027240.db2.gz BFDDQOUVEYHAOL-OAHLLOKOSA-N 1 1 335.448 3.520 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000532969075 1029115982 /nfs/dbraw/zinc/11/59/82/1029115982.db2.gz BWYPBOUOZIRMAH-GRYCIOLGSA-N 1 1 348.428 3.532 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000532969075 1029115987 /nfs/dbraw/zinc/11/59/87/1029115987.db2.gz BWYPBOUOZIRMAH-GRYCIOLGSA-N 1 1 348.428 3.532 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445850967 1029186080 /nfs/dbraw/zinc/18/60/80/1029186080.db2.gz XQDMPDSNEJVYQN-OAHLLOKOSA-N 1 1 345.443 3.886 20 5 EHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524894991 1029588275 /nfs/dbraw/zinc/58/82/75/1029588275.db2.gz ZHDFBNKVZALTKC-CGTJXYLNSA-N 1 1 332.444 3.929 20 5 EHBDMO C[N@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)n[nH]1 ZINC000447075156 1029922104 /nfs/dbraw/zinc/92/21/04/1029922104.db2.gz BNUCVAQRDRZPHC-CLFYSBASSA-N 1 1 328.416 3.761 20 5 EHBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)n[nH]1 ZINC000447075156 1029922114 /nfs/dbraw/zinc/92/21/14/1029922114.db2.gz BNUCVAQRDRZPHC-CLFYSBASSA-N 1 1 328.416 3.761 20 5 EHBDMO CC(C)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC(C)(C)C ZINC000531888824 1029984083 /nfs/dbraw/zinc/98/40/83/1029984083.db2.gz ZVEZMCNBCKWSJV-UHFFFAOYSA-N 1 1 336.432 3.965 20 5 EHBDMO Cc1cc(-c2noc([C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299253 1030049738 /nfs/dbraw/zinc/04/97/38/1030049738.db2.gz WZUKBQZBRLIXAJ-FRRDWIJNSA-N 1 1 330.388 3.887 20 5 EHBDMO CC(C)C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000159424449 1030195320 /nfs/dbraw/zinc/19/53/20/1030195320.db2.gz AYPNIHDCKSCLKB-UHFFFAOYSA-N 1 1 327.222 3.978 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CC[C@@H](C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453405604 1030213787 /nfs/dbraw/zinc/21/37/87/1030213787.db2.gz JLWGSEAGZBVLNA-OMWUSAIZSA-N 1 1 344.411 3.997 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1F ZINC000593061243 1030299045 /nfs/dbraw/zinc/29/90/45/1030299045.db2.gz QMPRDCCMWFLMJH-INIZCTEOSA-N 1 1 346.358 3.761 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCCO1 ZINC000482282896 1030307492 /nfs/dbraw/zinc/30/74/92/1030307492.db2.gz IOBIMOFEFKUBAZ-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000052488267 1030362492 /nfs/dbraw/zinc/36/24/92/1030362492.db2.gz DHZPNPRAWJMVHD-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCc3ccccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000482846941 1030749119 /nfs/dbraw/zinc/74/91/19/1030749119.db2.gz VIUMTGNZROYDAR-AWEZNQCLSA-N 1 1 342.395 3.602 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000537695044 1031081846 /nfs/dbraw/zinc/08/18/46/1031081846.db2.gz WKPYBIAGIZHFQK-BLLLJJGKSA-N 1 1 332.425 3.526 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000537695047 1031081880 /nfs/dbraw/zinc/08/18/80/1031081880.db2.gz WKPYBIAGIZHFQK-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000537698509 1031139087 /nfs/dbraw/zinc/13/90/87/1031139087.db2.gz VUCLSPDYJCHPQR-BLLLJJGKSA-N 1 1 332.425 3.526 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721014 1031529189 /nfs/dbraw/zinc/52/91/89/1031529189.db2.gz ZQTCPRFYHHFFOQ-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(Br)ccc2F)c1 ZINC000041065485 1031629919 /nfs/dbraw/zinc/62/99/19/1031629919.db2.gz FDUCVKZFLXFEEX-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](CC(F)(F)F)C3)nc2c1 ZINC000278623103 1031704049 /nfs/dbraw/zinc/70/40/49/1031704049.db2.gz FZNAEDIDEHRQDJ-VIFPVBQESA-N 1 1 329.278 3.510 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](CC(F)(F)F)C3)nc2c1 ZINC000278623103 1031704074 /nfs/dbraw/zinc/70/40/74/1031704074.db2.gz FZNAEDIDEHRQDJ-VIFPVBQESA-N 1 1 329.278 3.510 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737337 1031719623 /nfs/dbraw/zinc/71/96/23/1031719623.db2.gz CLQCLWLIKHFSAP-IJLUTSLNSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737337 1031719639 /nfs/dbraw/zinc/71/96/39/1031719639.db2.gz CLQCLWLIKHFSAP-IJLUTSLNSA-N 1 1 339.823 3.553 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487836 1033369187 /nfs/dbraw/zinc/36/91/87/1033369187.db2.gz NYBDKGJUYQAWRW-DZGCQCFKSA-N 1 1 334.445 3.508 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)C2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000063482944 1033390740 /nfs/dbraw/zinc/39/07/40/1033390740.db2.gz IYGNGYLGGNAFBD-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3ccccc3Cl)CC2)cc1 ZINC000059372700 1033591679 /nfs/dbraw/zinc/59/16/79/1033591679.db2.gz HMNWIHMMBILLBQ-UHFFFAOYSA-N 1 1 345.830 3.613 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000595040485 1033659901 /nfs/dbraw/zinc/65/99/01/1033659901.db2.gz LJURFBSCEGBZMU-BZNIZROVSA-N 1 1 346.358 3.917 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)ccc2cnccc21 ZINC000599097334 1033732690 /nfs/dbraw/zinc/73/26/90/1033732690.db2.gz BTIBFRCCZYXRKE-RDJZCZTQSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1noc(C[N@@H+](CC(C)C)[C@H]2CCCc3cccnc32)c1[N+](=O)[O-] ZINC000595442583 1033806768 /nfs/dbraw/zinc/80/67/68/1033806768.db2.gz VACCFDBHSNKQLD-HNNXBMFYSA-N 1 1 344.415 3.822 20 5 EHBDMO Cc1noc(C[N@H+](CC(C)C)[C@H]2CCCc3cccnc32)c1[N+](=O)[O-] ZINC000595442583 1033806777 /nfs/dbraw/zinc/80/67/77/1033806777.db2.gz VACCFDBHSNKQLD-HNNXBMFYSA-N 1 1 344.415 3.822 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489381 1033811228 /nfs/dbraw/zinc/81/12/28/1033811228.db2.gz ABBHJUKMPPXTFV-ARFHVFGLSA-N 1 1 327.384 3.659 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843268 1033966448 /nfs/dbraw/zinc/96/64/48/1033966448.db2.gz LOIBNZDOXFXGMA-QGZVFWFLSA-N 1 1 342.395 3.819 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)c(OC)c1 ZINC000603867940 1033993936 /nfs/dbraw/zinc/99/39/36/1033993936.db2.gz DVFPMMRNSWYHBN-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)cc1 ZINC000603893074 1034013912 /nfs/dbraw/zinc/01/39/12/1034013912.db2.gz VOMBHHSLHQEWSV-LJQANCHMSA-N 1 1 328.387 3.984 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCC3CC3)CC3CC3)o2)cc1 ZINC000595870821 1034031342 /nfs/dbraw/zinc/03/13/42/1034031342.db2.gz GQDFDDLQRIJFNK-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095283 1034077782 /nfs/dbraw/zinc/07/77/82/1034077782.db2.gz OOSGJCXCQWEPIK-VQIMIIECSA-N 1 1 331.460 3.758 20 5 EHBDMO CC[C@@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095283 1034077798 /nfs/dbraw/zinc/07/77/98/1034077798.db2.gz OOSGJCXCQWEPIK-VQIMIIECSA-N 1 1 331.460 3.758 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059438 1034086731 /nfs/dbraw/zinc/08/67/31/1034086731.db2.gz OEXFUMALCSBQDM-ZBFHGGJFSA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059438 1034086736 /nfs/dbraw/zinc/08/67/36/1034086736.db2.gz OEXFUMALCSBQDM-ZBFHGGJFSA-N 1 1 346.818 3.809 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679259 1034108156 /nfs/dbraw/zinc/10/81/56/1034108156.db2.gz LXWQWPSQRDXMII-HNNXBMFYSA-N 1 1 330.359 3.732 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604013122 1034138698 /nfs/dbraw/zinc/13/86/98/1034138698.db2.gz LZKMCUMGLRLEGW-QGZVFWFLSA-N 1 1 344.386 3.820 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccco2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000064483060 1034241107 /nfs/dbraw/zinc/24/11/07/1034241107.db2.gz FNHCSDBGYXQQAV-KRWDZBQOSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000064483060 1034241122 /nfs/dbraw/zinc/24/11/22/1034241122.db2.gz FNHCSDBGYXQQAV-KRWDZBQOSA-N 1 1 330.384 3.677 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c2ncccc12 ZINC000596571257 1034294260 /nfs/dbraw/zinc/29/42/60/1034294260.db2.gz RPXZJNRYONJDEO-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO C[C@H](NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413038 1034299834 /nfs/dbraw/zinc/29/98/34/1034299834.db2.gz SKMDWINSCADWGZ-KBXCAEBGSA-N 1 1 345.443 3.569 20 5 EHBDMO C[C@@H]1CCC[N@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CCO)c1 ZINC000596647171 1034346123 /nfs/dbraw/zinc/34/61/23/1034346123.db2.gz DOBQNGJLPIPZJC-OAHLLOKOSA-N 1 1 340.423 3.781 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000604435948 1034378241 /nfs/dbraw/zinc/37/82/41/1034378241.db2.gz OHAMOWXAWCUCHW-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000302947724 1034443021 /nfs/dbraw/zinc/44/30/21/1034443021.db2.gz NCDSONKBDKYFCK-INIZCTEOSA-N 1 1 333.435 3.602 20 5 EHBDMO COc1cc(C)c([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000179631033 1034526766 /nfs/dbraw/zinc/52/67/66/1034526766.db2.gz LLQMEMUJILSNGL-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075837932 1034574780 /nfs/dbraw/zinc/57/47/80/1034574780.db2.gz OBWKOBGVEFIYNQ-INWMFGNUSA-N 1 1 342.399 3.798 20 5 EHBDMO COc1cc(C[NH+]2CCC(c3ccco3)CC2)c([N+](=O)[O-])cc1OC ZINC000597179509 1034584233 /nfs/dbraw/zinc/58/42/33/1034584233.db2.gz IXGVLPJUVQRUMX-UHFFFAOYSA-N 1 1 346.383 3.585 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1=CCSC1 ZINC000597245678 1034637939 /nfs/dbraw/zinc/63/79/39/1034637939.db2.gz MXWVIXHKMPDKIL-UHFFFAOYSA-N 1 1 330.409 3.960 20 5 EHBDMO Cc1ccc(C[NH+]2CCC(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000179878457 1034918840 /nfs/dbraw/zinc/91/88/40/1034918840.db2.gz RSULEVHIGUZGIO-UHFFFAOYSA-N 1 1 338.407 3.998 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000615834452 1035028889 /nfs/dbraw/zinc/02/88/89/1035028889.db2.gz VBABGCYVUULLML-QWSHFYNQSA-N 1 1 326.400 3.532 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000065958729 1035030295 /nfs/dbraw/zinc/03/02/95/1035030295.db2.gz KNRRROHEMDNKHF-UHFFFAOYSA-N 1 1 342.439 3.984 20 5 EHBDMO COc1cc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000180065964 1035348756 /nfs/dbraw/zinc/34/87/56/1035348756.db2.gz VVUCCIYMEFYASC-FQEVSTJZSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1ccccc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026197604 1035502574 /nfs/dbraw/zinc/50/25/74/1035502574.db2.gz NWHRDPYCMLXDLU-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573350 1035538348 /nfs/dbraw/zinc/53/83/48/1035538348.db2.gz RJBZRLUDQCVAFT-FUHWJXTLSA-N 1 1 345.830 3.783 20 5 EHBDMO CN1CC[C@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573350 1035538361 /nfs/dbraw/zinc/53/83/61/1035538361.db2.gz RJBZRLUDQCVAFT-FUHWJXTLSA-N 1 1 345.830 3.783 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000492466608 1035825460 /nfs/dbraw/zinc/82/54/60/1035825460.db2.gz ZEEMUEWDNWLZLV-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](C4CC4)C3)co2)cc1 ZINC000588977545 1036208239 /nfs/dbraw/zinc/20/82/39/1036208239.db2.gz ASFASFAXHVCCHY-HNNXBMFYSA-N 1 1 327.384 3.872 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687383 1036243455 /nfs/dbraw/zinc/24/34/55/1036243455.db2.gz JCIPZARFMLWMOV-DNVCBOLYSA-N 1 1 328.412 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000609132752 1036467982 /nfs/dbraw/zinc/46/79/82/1036467982.db2.gz GWLUVZYZCURWSU-HNNXBMFYSA-N 1 1 331.441 3.633 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000589519796 1036487579 /nfs/dbraw/zinc/48/75/79/1036487579.db2.gz ANUWUELLRUGZPY-BNXPMYBGSA-N 1 1 346.818 3.795 20 5 EHBDMO CCOC(=O)[C@]1(C(C)C)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825986 1036510879 /nfs/dbraw/zinc/51/08/79/1036510879.db2.gz IPDGKFFJYCSDMZ-KBXCAEBGSA-N 1 1 334.416 3.567 20 5 EHBDMO CCSc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000446849889 1036600669 /nfs/dbraw/zinc/60/06/69/1036600669.db2.gz RVVSVWFWWDOORU-UHFFFAOYSA-N 1 1 342.424 3.873 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1CO ZINC000191181950 1036696592 /nfs/dbraw/zinc/69/65/92/1036696592.db2.gz ICDCRLXCZNLTPG-MLGOLLRUSA-N 1 1 332.425 3.526 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1occc1C ZINC000412023677 1036729937 /nfs/dbraw/zinc/72/99/37/1036729937.db2.gz DAQWEPUSPGEONN-UHFFFAOYSA-N 1 1 345.399 3.655 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641877 1036914503 /nfs/dbraw/zinc/91/45/03/1036914503.db2.gz MRWWXEVIYQOYGL-ZIAGYGMSSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537096 1037022522 /nfs/dbraw/zinc/02/25/22/1037022522.db2.gz IDKLLCCPWLDPFB-XJKSGUPXSA-N 1 1 328.416 3.552 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000542252165 1037199639 /nfs/dbraw/zinc/19/96/39/1037199639.db2.gz VNWNGCSEMUGCLC-OAHLLOKOSA-N 1 1 331.416 3.520 20 5 EHBDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000472607864 1037256829 /nfs/dbraw/zinc/25/68/29/1037256829.db2.gz DTGKJZNQAPAHBH-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000462694304 1037289757 /nfs/dbraw/zinc/28/97/57/1037289757.db2.gz AVQMATLJEZOLHH-GFCCVEGCSA-N 1 1 335.404 3.679 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(C)cc1 ZINC000532490912 1037519314 /nfs/dbraw/zinc/51/93/14/1037519314.db2.gz ORBTZEOKJIMASN-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(C)cc1 ZINC000532490912 1037519319 /nfs/dbraw/zinc/51/93/19/1037519319.db2.gz ORBTZEOKJIMASN-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)CCC[C@H]1C ZINC000532571303 1037672648 /nfs/dbraw/zinc/67/26/48/1037672648.db2.gz LWZWJXVAISYVKV-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587418 1037707223 /nfs/dbraw/zinc/70/72/23/1037707223.db2.gz ZHWWHSHKFOILSK-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000031582029 1037721094 /nfs/dbraw/zinc/72/10/94/1037721094.db2.gz PBNHHOQEBCGUCX-UHFFFAOYSA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(CC(C)C)CC1 ZINC000760921701 1037785453 /nfs/dbraw/zinc/78/54/53/1037785453.db2.gz QZCUZDGBKQBOTB-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000103473180 1037903054 /nfs/dbraw/zinc/90/30/54/1037903054.db2.gz PDUJOGCCHRRNHR-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H](NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395493 1037938726 /nfs/dbraw/zinc/93/87/26/1037938726.db2.gz CLFCZSMZUUSPLT-CVAIRZPRSA-N 1 1 339.439 3.591 20 5 EHBDMO C[C@H](NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395493 1037938746 /nfs/dbraw/zinc/93/87/46/1037938746.db2.gz CLFCZSMZUUSPLT-CVAIRZPRSA-N 1 1 339.439 3.591 20 5 EHBDMO Cc1c([C@@H](C)[NH2+][C@@H](CCO)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000592402863 1037944673 /nfs/dbraw/zinc/94/46/73/1037944673.db2.gz LCOIQLXINFNTDA-DYVFJYSZSA-N 1 1 332.375 3.817 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000378134866 1037990912 /nfs/dbraw/zinc/99/09/12/1037990912.db2.gz OOMPEJLIZDYTFL-UHFFFAOYSA-N 1 1 342.370 3.755 20 5 EHBDMO CC(C)([NH2+]Cc1ccc(-c2cc[nH]n2)o1)c1ccccc1[N+](=O)[O-] ZINC000492152300 1038025366 /nfs/dbraw/zinc/02/53/66/1038025366.db2.gz OIZYLRZNXUDUEG-UHFFFAOYSA-N 1 1 326.356 3.603 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccc1SC ZINC000058527833 1038074614 /nfs/dbraw/zinc/07/46/14/1038074614.db2.gz ATSYHUNEXOCQTE-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C1CC1)C1CC1 ZINC000104680112 1038434178 /nfs/dbraw/zinc/43/41/78/1038434178.db2.gz YRWPWHAUTROVKU-UHFFFAOYSA-N 1 1 341.411 3.913 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000541389096 1038600643 /nfs/dbraw/zinc/60/06/43/1038600643.db2.gz NGVODROOSTVPPR-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1)CC(C)C ZINC000539105528 1038689386 /nfs/dbraw/zinc/68/93/86/1038689386.db2.gz GIRKSGLGCUDCRB-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000479944143 1038921683 /nfs/dbraw/zinc/92/16/83/1038921683.db2.gz AXRUKVZLKQXLDD-AWEZNQCLSA-N 1 1 333.432 3.720 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000485453224 1039086822 /nfs/dbraw/zinc/08/68/22/1039086822.db2.gz RSTCWGCEQUDMLA-QGZVFWFLSA-N 1 1 326.396 3.593 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000015301084 1039088333 /nfs/dbraw/zinc/08/83/33/1039088333.db2.gz FEQWBOPTDRYHAL-MRXNPFEDSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000485694818 1039415032 /nfs/dbraw/zinc/41/50/32/1039415032.db2.gz LUPHKAIFEBSUIY-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H](C3CC3)C2)s1 ZINC000485694818 1039415038 /nfs/dbraw/zinc/41/50/38/1039415038.db2.gz LUPHKAIFEBSUIY-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000554946534 1039969070 /nfs/dbraw/zinc/96/90/70/1039969070.db2.gz VJXBSBNBRKOKBW-GFCCVEGCSA-N 1 1 328.359 3.859 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000554946534 1039969084 /nfs/dbraw/zinc/96/90/84/1039969084.db2.gz VJXBSBNBRKOKBW-GFCCVEGCSA-N 1 1 328.359 3.859 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c(F)c1 ZINC000573528170 1040154618 /nfs/dbraw/zinc/15/46/18/1040154618.db2.gz WCUVNLTVOXNVFZ-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)c(F)c1 ZINC000573528170 1040154621 /nfs/dbraw/zinc/15/46/21/1040154621.db2.gz WCUVNLTVOXNVFZ-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO Cc1cc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555207672 1040292104 /nfs/dbraw/zinc/29/21/04/1040292104.db2.gz PGFMLQUCRBSJKQ-SECBINFHSA-N 1 1 340.305 3.615 20 5 EHBDMO Cc1cc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555207672 1040292119 /nfs/dbraw/zinc/29/21/19/1040292119.db2.gz PGFMLQUCRBSJKQ-SECBINFHSA-N 1 1 340.305 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000490029779 1040299766 /nfs/dbraw/zinc/29/97/66/1040299766.db2.gz YABIYBTYDKJJQW-KRWDZBQOSA-N 1 1 341.411 3.550 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000490092145 1040353175 /nfs/dbraw/zinc/35/31/75/1040353175.db2.gz YVCISCVTMHAOBR-OLMNPRSZSA-N 1 1 348.443 3.629 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000588492062 1040688071 /nfs/dbraw/zinc/68/80/71/1040688071.db2.gz XJQWKXHIDJBSRI-VORVDVFJSA-N 1 1 336.391 3.739 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc(C4CC4)o3)C2)cc1 ZINC000600170028 1040754926 /nfs/dbraw/zinc/75/49/26/1040754926.db2.gz VIGNWJSKSUVHCU-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO O[C@H]1CC[N@H+](Cc2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211789158 1040892479 /nfs/dbraw/zinc/89/24/79/1040892479.db2.gz HSLXGUSIXJILFO-HNNXBMFYSA-N 1 1 345.402 3.610 20 5 EHBDMO O[C@H]1CC[N@@H+](Cc2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211789158 1040892498 /nfs/dbraw/zinc/89/24/98/1040892498.db2.gz HSLXGUSIXJILFO-HNNXBMFYSA-N 1 1 345.402 3.610 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895306 1040897746 /nfs/dbraw/zinc/89/77/46/1040897746.db2.gz LVNYKBKOEYOYGB-GUYCJALGSA-N 1 1 328.416 3.843 20 5 EHBDMO CCOc1ncccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168573 1040959861 /nfs/dbraw/zinc/95/98/61/1040959861.db2.gz NNXZKWSQZVVIJF-QGZVFWFLSA-N 1 1 341.411 3.901 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@H]21 ZINC000555721465 1041060320 /nfs/dbraw/zinc/06/03/20/1041060320.db2.gz REJPPJATMIELLI-HUUCEWRRSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000341522969 1041168948 /nfs/dbraw/zinc/16/89/48/1041168948.db2.gz HHKZBDSYEOIVEC-GFCCVEGCSA-N 1 1 349.460 3.524 20 5 EHBDMO CC(C)Cn1ccnc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433267114 1041179922 /nfs/dbraw/zinc/17/99/22/1041179922.db2.gz YCUDJMSWEYRXTL-KRWDZBQOSA-N 1 1 342.443 3.960 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](c1ccccc1F)[C@H](C)O ZINC000571289424 1041257130 /nfs/dbraw/zinc/25/71/30/1041257130.db2.gz BCLNJESRCNVZAB-LXIYXOSZSA-N 1 1 332.375 3.815 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1ccccc1 ZINC000198596704 1041749398 /nfs/dbraw/zinc/74/93/98/1041749398.db2.gz FEEALCXOYHKWMQ-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1ccccc1 ZINC000198596704 1041749407 /nfs/dbraw/zinc/74/94/07/1041749407.db2.gz FEEALCXOYHKWMQ-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CCCCCC1 ZINC000109093463 1042131669 /nfs/dbraw/zinc/13/16/69/1042131669.db2.gz DJHWWHSHFGEDQH-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112656379 1042416423 /nfs/dbraw/zinc/41/64/23/1042416423.db2.gz GLZVVTHSZLYJMZ-DOMZBBRYSA-N 1 1 346.818 3.891 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)O1 ZINC000511958983 1042488673 /nfs/dbraw/zinc/48/86/73/1042488673.db2.gz XALBNTBFVZTJMU-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)O1 ZINC000511958983 1042488674 /nfs/dbraw/zinc/48/86/74/1042488674.db2.gz XALBNTBFVZTJMU-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO COC(=O)c1coc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000278908058 1042905944 /nfs/dbraw/zinc/90/59/44/1042905944.db2.gz ZWSASJXXRYYQLJ-VXGBXAGGSA-N 1 1 332.356 3.695 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC000541935857 1042917221 /nfs/dbraw/zinc/91/72/21/1042917221.db2.gz NAETWWQEKLWUHA-RDJZCZTQSA-N 1 1 340.427 3.854 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@H](CCO)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279223027 1043598756 /nfs/dbraw/zinc/59/87/56/1043598756.db2.gz ZEPJFHIEHOPZCD-CVEARBPZSA-N 1 1 330.384 3.624 20 5 EHBDMO CCCCC[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001170235373 1134716725 /nfs/dbraw/zinc/71/67/25/1134716725.db2.gz ZCYJCOCJMXQRKF-UHFFFAOYSA-N 1 1 327.222 3.906 20 5 EHBDMO CCCCC[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001170235373 1134716732 /nfs/dbraw/zinc/71/67/32/1134716732.db2.gz ZCYJCOCJMXQRKF-UHFFFAOYSA-N 1 1 327.222 3.906 20 5 EHBDMO C[NH+](C)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000337261120 1044128368 /nfs/dbraw/zinc/12/83/68/1044128368.db2.gz XHQOFTJBIJIVCE-UHFFFAOYSA-N 1 1 333.775 3.562 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083133637 1127210609 /nfs/dbraw/zinc/21/06/09/1127210609.db2.gz QBADQBMDHWRKHA-LBPRGKRZSA-N 1 1 341.367 3.938 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083133637 1127210612 /nfs/dbraw/zinc/21/06/12/1127210612.db2.gz QBADQBMDHWRKHA-LBPRGKRZSA-N 1 1 341.367 3.938 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000301382744 1127741203 /nfs/dbraw/zinc/74/12/03/1127741203.db2.gz VGTHVIIEVNFOKO-VXGBXAGGSA-N 1 1 343.374 3.729 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443890 1127919607 /nfs/dbraw/zinc/91/96/07/1127919607.db2.gz VAJAUWOWVMEJHE-WFASDCNBSA-N 1 1 332.429 3.546 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478247 1131242036 /nfs/dbraw/zinc/24/20/36/1131242036.db2.gz XXRKYODHZIPQDE-PBHICJAKSA-N 1 1 336.395 3.780 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508526 1128484300 /nfs/dbraw/zinc/48/43/00/1128484300.db2.gz AQIKWZGFWHYRPZ-DOTOQJQBSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200550 1120561520 /nfs/dbraw/zinc/56/15/20/1120561520.db2.gz OLHZXCQAFXQZPP-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200550 1120561523 /nfs/dbraw/zinc/56/15/23/1120561523.db2.gz OLHZXCQAFXQZPP-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCOCc1ccccc1)CC2 ZINC000542508747 1120855088 /nfs/dbraw/zinc/85/50/88/1120855088.db2.gz PMPDHCIEIIJBTL-UHFFFAOYSA-N 1 1 326.396 3.560 20 5 EHBDMO C[N@@H+]1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957920 1128948850 /nfs/dbraw/zinc/94/88/50/1128948850.db2.gz GEXGWCMCZKGRGG-FUHWJXTLSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957920 1128948853 /nfs/dbraw/zinc/94/88/53/1128948853.db2.gz GEXGWCMCZKGRGG-FUHWJXTLSA-N 1 1 345.830 3.783 20 5 EHBDMO CCCCCC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000762070644 1121090189 /nfs/dbraw/zinc/09/01/89/1121090189.db2.gz FOHIHEDOJAGCBR-UHFFFAOYSA-N 1 1 332.404 3.965 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663183 1121561490 /nfs/dbraw/zinc/56/14/90/1121561490.db2.gz PXQLMBNSJXFWRQ-GOEBONIOSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663183 1121561495 /nfs/dbraw/zinc/56/14/95/1121561495.db2.gz PXQLMBNSJXFWRQ-GOEBONIOSA-N 1 1 347.459 3.661 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC000780400260 1121575183 /nfs/dbraw/zinc/57/51/83/1121575183.db2.gz UQZPVQNKRTVKJO-CSXIPAGWSA-N 1 1 338.407 3.806 20 5 EHBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000489839684 1122086705 /nfs/dbraw/zinc/08/67/05/1122086705.db2.gz SMZUSXZPIHGWPA-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000489839684 1122086709 /nfs/dbraw/zinc/08/67/09/1122086709.db2.gz SMZUSXZPIHGWPA-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301156649 1122167016 /nfs/dbraw/zinc/16/70/16/1122167016.db2.gz AMKHQXMTYIOXEX-MRXNPFEDSA-N 1 1 343.402 3.710 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@H+](C)C(C)C ZINC000301175089 1122241818 /nfs/dbraw/zinc/24/18/18/1122241818.db2.gz FTZZYDRSTGOFOH-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000195315321 1123360841 /nfs/dbraw/zinc/36/08/41/1123360841.db2.gz KBTKNSFVUPYCIN-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610161177 1123742038 /nfs/dbraw/zinc/74/20/38/1123742038.db2.gz KWMJZGGUIYFUGT-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610161177 1123742042 /nfs/dbraw/zinc/74/20/42/1123742042.db2.gz KWMJZGGUIYFUGT-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccccc1 ZINC000067961105 1123795975 /nfs/dbraw/zinc/79/59/75/1123795975.db2.gz GKMMZXRECCOHMF-HNNXBMFYSA-N 1 1 341.411 3.925 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@H]1c1ccccc1 ZINC000301823521 1129149248 /nfs/dbraw/zinc/14/92/48/1129149248.db2.gz CMIYZSKDHAOAIF-HUUCEWRRSA-N 1 1 332.791 3.501 20 5 EHBDMO Cc1nc(NC(C)(C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301831586 1129170304 /nfs/dbraw/zinc/17/03/04/1129170304.db2.gz SRJGOTREZDRHQE-UHFFFAOYSA-N 1 1 328.416 3.621 20 5 EHBDMO Cc1cc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000080605823 1124622632 /nfs/dbraw/zinc/62/26/32/1124622632.db2.gz IHNLBXWKZGOINZ-DYVFJYSZSA-N 1 1 346.456 3.855 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)s1 ZINC000619698921 1125383917 /nfs/dbraw/zinc/38/39/17/1125383917.db2.gz RJYQYNDLXQJSOF-LBPRGKRZSA-N 1 1 332.429 3.573 20 5 EHBDMO O=C(CC[N@@H+](C1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000619716509 1125387963 /nfs/dbraw/zinc/38/79/63/1125387963.db2.gz RPPZZMDEKMGLKE-UHFFFAOYSA-N 1 1 331.416 3.721 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735490632 1131352233 /nfs/dbraw/zinc/35/22/33/1131352233.db2.gz MBGSSGBQJUJAPX-UHFFFAOYSA-N 1 1 325.840 3.554 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000114729155 1129187135 /nfs/dbraw/zinc/18/71/35/1129187135.db2.gz UOPMUACJAMYWAQ-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131026817 1129376486 /nfs/dbraw/zinc/37/64/86/1129376486.db2.gz YSYQPZBNUGZPQI-OLZOCXBDSA-N 1 1 330.388 3.655 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000466489444 1129489292 /nfs/dbraw/zinc/48/92/92/1129489292.db2.gz RKCFGWGKLKNRHH-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000092223840 1129537343 /nfs/dbraw/zinc/53/73/43/1129537343.db2.gz OUJFOOCZLVWJMX-SFHVURJKSA-N 1 1 329.400 3.842 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802858 1129590461 /nfs/dbraw/zinc/59/04/61/1129590461.db2.gz YFWXURGDCNIZEK-WBMJQRKESA-N 1 1 346.818 3.576 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000922884278 1129709233 /nfs/dbraw/zinc/70/92/33/1129709233.db2.gz YNGHJQUHNAHSKZ-CQSZACIVSA-N 1 1 349.337 3.758 20 5 EHBDMO COc1cc(N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081755 1129767676 /nfs/dbraw/zinc/76/76/76/1129767676.db2.gz YATLHLGMSTZHQX-HOTGVXAUSA-N 1 1 347.459 3.694 20 5 EHBDMO Cn1c[nH+]cc1CCNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000302121239 1129769104 /nfs/dbraw/zinc/76/91/04/1129769104.db2.gz DLJLNWCKMWIQML-UHFFFAOYSA-N 1 1 348.712 3.655 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CC2CCC1CC2 ZINC001168748813 1129919420 /nfs/dbraw/zinc/91/94/20/1129919420.db2.gz AXFAHFGBDGZDIL-UHFFFAOYSA-N 1 1 325.206 3.732 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC2CCC1CC2 ZINC001168748813 1129919421 /nfs/dbraw/zinc/91/94/21/1129919421.db2.gz AXFAHFGBDGZDIL-UHFFFAOYSA-N 1 1 325.206 3.732 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000172864387 1130165857 /nfs/dbraw/zinc/16/58/57/1130165857.db2.gz QAQHGOUQEAQKCA-ZIAGYGMSSA-N 1 1 329.400 3.913 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455547 1130234394 /nfs/dbraw/zinc/23/43/94/1130234394.db2.gz JWXDANVZGVWJKS-AWEZNQCLSA-N 1 1 348.424 3.881 20 5 EHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000174832755 1130387093 /nfs/dbraw/zinc/38/70/93/1130387093.db2.gz MGOWVQHNRDITBK-ZDUSSCGKSA-N 1 1 328.372 3.621 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209173 1130897644 /nfs/dbraw/zinc/89/76/44/1130897644.db2.gz JQVPMXOVOWKHQH-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209173 1130897646 /nfs/dbraw/zinc/89/76/46/1130897646.db2.gz JQVPMXOVOWKHQH-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000733302482 1131019135 /nfs/dbraw/zinc/01/91/35/1131019135.db2.gz XHQQQXLEQLNRGO-GFCCVEGCSA-N 1 1 334.445 3.881 20 5 EHBDMO CO[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(F)(F)F ZINC000733330004 1131027672 /nfs/dbraw/zinc/02/76/72/1131027672.db2.gz NTSTWMZYBVRCDI-CQSZACIVSA-N 1 1 344.289 3.522 20 5 EHBDMO COc1cc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000347963415 1131106729 /nfs/dbraw/zinc/10/67/29/1131106729.db2.gz PCYYTJWKQOTPAZ-HNNXBMFYSA-N 1 1 333.413 3.609 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1C ZINC000740870784 1131550903 /nfs/dbraw/zinc/55/09/03/1131550903.db2.gz IMMFFGIVLRDOKA-NEPJUHHUSA-N 1 1 334.445 3.514 20 5 EHBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000741250977 1131587743 /nfs/dbraw/zinc/58/77/43/1131587743.db2.gz LFOAQACTZCZIIO-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000741250977 1131587746 /nfs/dbraw/zinc/58/77/46/1131587746.db2.gz LFOAQACTZCZIIO-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154507 1131694007 /nfs/dbraw/zinc/69/40/07/1131694007.db2.gz KMEYHTLHRXOUIZ-CABCVRRESA-N 1 1 328.416 3.926 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](c3cccnc3)C1)CC2 ZINC001172915534 1131902945 /nfs/dbraw/zinc/90/29/45/1131902945.db2.gz OPGPJTKXIRCVRN-MOPGFXCFSA-N 1 1 337.423 3.727 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381054 1131914968 /nfs/dbraw/zinc/91/49/68/1131914968.db2.gz SZYDYGVHTNKFKH-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO CC1(C)CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018623 1131937251 /nfs/dbraw/zinc/93/72/51/1131937251.db2.gz XNWJVGJGIKTZJM-UHFFFAOYSA-N 1 1 339.386 3.574 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@](C)(F)CC2)c1F ZINC001173178945 1131992544 /nfs/dbraw/zinc/99/25/44/1131992544.db2.gz CHZIUHQIWCWBSP-SJKOYZFVSA-N 1 1 342.386 3.888 20 5 EHBDMO CC[N@@H+](Cc1cccnc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187615 1131994084 /nfs/dbraw/zinc/99/40/84/1131994084.db2.gz AVXXDVUQUZQZDR-CYBMUJFWSA-N 1 1 347.390 3.591 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2cccs2)c1F ZINC001173188543 1131994180 /nfs/dbraw/zinc/99/41/80/1131994180.db2.gz GMRNPVRCDZFWKS-NSHDSACASA-N 1 1 338.404 3.867 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCCCC2(F)F)c1F ZINC001173193743 1131995437 /nfs/dbraw/zinc/99/54/37/1131995437.db2.gz WPWCOTQDTDNDKJ-QMTHXVAHSA-N 1 1 346.349 3.841 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](Cc2ccco2)C2CC2)c1F ZINC001173194180 1131995582 /nfs/dbraw/zinc/99/55/82/1131995582.db2.gz YIZTWHWXYOVXBG-LBPRGKRZSA-N 1 1 348.374 3.931 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1CC(=O)OC(C)(C)C ZINC001173231923 1132009028 /nfs/dbraw/zinc/00/90/28/1132009028.db2.gz OXGXYWDDKSEECK-PBHICJAKSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC001173232284 1132009567 /nfs/dbraw/zinc/00/95/67/1132009567.db2.gz AGTAKDGXOQJYAH-LIRRHRJNSA-N 1 1 344.386 3.818 20 5 EHBDMO CCC[N@@H+](CCc1ccccn1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234033 1132010735 /nfs/dbraw/zinc/01/07/35/1132010735.db2.gz OTFFEOSIUWUERX-INIZCTEOSA-N 1 1 327.428 3.876 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037123 1132636734 /nfs/dbraw/zinc/63/67/34/1132636734.db2.gz JBPHTXISHRIDJD-DAXOMENPSA-N 1 1 340.876 3.875 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000804357269 1133007096 /nfs/dbraw/zinc/00/70/96/1133007096.db2.gz BPCRBLZVQBMDJU-VBQJREDUSA-N 1 1 345.443 3.639 20 5 EHBDMO NC(=O)c1ccc(C[N@H+]2CCCCC23CCCCCC3)c([N+](=O)[O-])c1 ZINC001176960260 1133016017 /nfs/dbraw/zinc/01/60/17/1133016017.db2.gz WNSPUVGKWSOOAV-UHFFFAOYSA-N 1 1 345.443 3.773 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762598 1133048470 /nfs/dbraw/zinc/04/84/70/1133048470.db2.gz IZLCKWBJZUCAEW-WBMJQRKESA-N 1 1 331.420 3.506 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765455 1133050562 /nfs/dbraw/zinc/05/05/62/1133050562.db2.gz PJTWTYDOIGOYLT-CQSZACIVSA-N 1 1 331.420 3.650 20 5 EHBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936025 1133072332 /nfs/dbraw/zinc/07/23/32/1133072332.db2.gz OJGMATXFUBRMSZ-PMACEKPBSA-N 1 1 340.423 3.725 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCN(c3ccccc3)CC2)ccc1Cl ZINC000768541743 1133153817 /nfs/dbraw/zinc/15/38/17/1133153817.db2.gz KQRKLPJMZSJMHD-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCN(c3ccccc3)CC2)ccc1Cl ZINC000768541743 1133153820 /nfs/dbraw/zinc/15/38/20/1133153820.db2.gz KQRKLPJMZSJMHD-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNc2ccc3[nH]c[nH+]c3c2)c1 ZINC001178688640 1133191287 /nfs/dbraw/zinc/19/12/87/1133191287.db2.gz MQSDOVSTOVQJHC-UHFFFAOYSA-N 1 1 334.282 3.685 20 5 EHBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC001180332804 1133362844 /nfs/dbraw/zinc/36/28/44/1133362844.db2.gz UMTRUPSFZBQVBH-IUODEOHRSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1nn(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000770669183 1133456904 /nfs/dbraw/zinc/45/69/04/1133456904.db2.gz BQOZKNXVQIFMKS-ZDUSSCGKSA-N 1 1 328.416 3.723 20 5 EHBDMO Cc1[nH+]ccn1-c1ncccc1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000774537811 1133723770 /nfs/dbraw/zinc/72/37/70/1133723770.db2.gz XVEWPLWNGBVNLO-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO NC(=[NH+]OCc1ccc(Br)c([N+](=O)[O-])c1)C1CCCC1 ZINC000786892848 1133917875 /nfs/dbraw/zinc/91/78/75/1133917875.db2.gz BTEQFERRDPRISJ-UHFFFAOYSA-N 1 1 342.193 3.546 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908572 1134116158 /nfs/dbraw/zinc/11/61/58/1134116158.db2.gz MEMMKLBYYVSNCK-MRXNPFEDSA-N 1 1 343.383 3.956 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1F ZINC000788486379 1134131427 /nfs/dbraw/zinc/13/14/27/1134131427.db2.gz UUOAODKQRXVKBR-IBGZPJMESA-N 1 1 344.386 3.507 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327190 1134748179 /nfs/dbraw/zinc/74/81/79/1134748179.db2.gz FMLUCGAMKMCSCZ-HNNXBMFYSA-N 1 1 340.423 3.901 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326682 1134748628 /nfs/dbraw/zinc/74/86/28/1134748628.db2.gz BOOOAQJSJARJMU-CHWSQXEVSA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170329832 1134749282 /nfs/dbraw/zinc/74/92/82/1134749282.db2.gz VLHBXYQHMYVCNF-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170354805 1134754343 /nfs/dbraw/zinc/75/43/43/1134754343.db2.gz PJHYZANXPKHFPA-CQSZACIVSA-N 1 1 346.402 3.848 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346406 1134759830 /nfs/dbraw/zinc/75/98/30/1134759830.db2.gz NMMLDMXVCYYKEB-KBXCAEBGSA-N 1 1 341.411 3.767 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cccc1[N+](=O)[O-] ZINC000792912189 1134824127 /nfs/dbraw/zinc/82/41/27/1134824127.db2.gz YXFLRGCSLQBZJY-UONOGXRCSA-N 1 1 329.227 3.919 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443599 1134868193 /nfs/dbraw/zinc/86/81/93/1134868193.db2.gz CQSRDUZQAXIRIM-DNVCBOLYSA-N 1 1 326.396 3.852 20 5 EHBDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001191531666 1134879974 /nfs/dbraw/zinc/87/99/74/1134879974.db2.gz VHJLYVCDAZBWJI-QGZVFWFLSA-N 1 1 325.412 3.825 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3ccc(F)cc3C)CC2)c(C)c1[N+](=O)[O-] ZINC000793545088 1134952974 /nfs/dbraw/zinc/95/29/74/1134952974.db2.gz MDUUZIPDKAHOCN-UHFFFAOYSA-N 1 1 346.406 3.693 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001192453347 1135022167 /nfs/dbraw/zinc/02/21/67/1135022167.db2.gz ZRJDPYGGQOSRDO-OAHLLOKOSA-N 1 1 333.319 3.883 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@]2(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])n1 ZINC001195758874 1135461010 /nfs/dbraw/zinc/46/10/10/1135461010.db2.gz WWDQJCRDEOLTOE-KRWDZBQOSA-N 1 1 348.834 3.579 20 5 EHBDMO O=C(C[N@H+]1CCCC[C@@H]1CC1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC001196330482 1135546691 /nfs/dbraw/zinc/54/66/91/1135546691.db2.gz ZEXPNZGIFAECCE-OAHLLOKOSA-N 1 1 331.416 3.578 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCCC[C@@H](C)C1 ZINC000775732795 1135587006 /nfs/dbraw/zinc/58/70/06/1135587006.db2.gz WEUDHKFDKQGLAR-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCCC[C@@H](C)C1 ZINC000775732795 1135587010 /nfs/dbraw/zinc/58/70/10/1135587010.db2.gz WEUDHKFDKQGLAR-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2cc([N+](=O)[O-])ccc2C(C)=O)c1 ZINC000807935457 1135587957 /nfs/dbraw/zinc/58/79/57/1135587957.db2.gz NQUJSIQXVUAIIH-UHFFFAOYSA-N 1 1 341.411 3.861 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC001197284444 1135672627 /nfs/dbraw/zinc/67/26/27/1135672627.db2.gz JGTZNBHWWQEXDY-SFHVURJKSA-N 1 1 332.444 3.932 20 5 EHBDMO Cc1ccc(CN(C)Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000809738819 1135883381 /nfs/dbraw/zinc/88/33/81/1135883381.db2.gz LJNKLVUDCWFITO-UHFFFAOYSA-N 1 1 327.428 3.597 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCCC[C@H]23)o1 ZINC001199345322 1135896340 /nfs/dbraw/zinc/89/63/40/1135896340.db2.gz QDLQPASTHANODS-SJLPKXTDSA-N 1 1 341.411 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCN3CCCC[C@H]23)o1 ZINC001199345322 1135896344 /nfs/dbraw/zinc/89/63/44/1135896344.db2.gz QDLQPASTHANODS-SJLPKXTDSA-N 1 1 341.411 3.571 20 5 EHBDMO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCC[N@@H+](C)C1 ZINC000809948632 1135905305 /nfs/dbraw/zinc/90/53/05/1135905305.db2.gz IHNYHNAISLFTOO-NSHDSACASA-N 1 1 346.258 3.675 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279851 1136133697 /nfs/dbraw/zinc/13/36/97/1136133697.db2.gz ZELIPEADOGLSBY-HNAYVOBHSA-N 1 1 328.412 3.938 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000850428328 1136256915 /nfs/dbraw/zinc/25/69/15/1136256915.db2.gz MVOUMJBOOFVYPX-VXGBXAGGSA-N 1 1 345.355 3.923 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000813329310 1136322721 /nfs/dbraw/zinc/32/27/21/1136322721.db2.gz OJIBROYPDICBRN-ZIAGYGMSSA-N 1 1 328.416 3.848 20 5 EHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCO1 ZINC000338942167 1136435762 /nfs/dbraw/zinc/43/57/62/1136435762.db2.gz DPXQDGYYEIBTFW-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577920 1136443402 /nfs/dbraw/zinc/44/34/02/1136443402.db2.gz AUNCZIKSTMFHCU-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000776591047 1136450971 /nfs/dbraw/zinc/45/09/71/1136450971.db2.gz GIIUWOLGLOPWRV-UPRAQXHNSA-N 1 1 344.386 3.850 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591983 1136452851 /nfs/dbraw/zinc/45/28/51/1136452851.db2.gz NPISFMFRSPXBHL-NIKGAXFTSA-N 1 1 326.396 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)cc1 ZINC000852427124 1136455349 /nfs/dbraw/zinc/45/53/49/1136455349.db2.gz STCNJWMFCBFGOL-FUHWJXTLSA-N 1 1 342.395 3.839 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000112659431 1136644152 /nfs/dbraw/zinc/64/41/52/1136644152.db2.gz RMHVWJFCUJPNRJ-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586370 1137021611 /nfs/dbraw/zinc/02/16/11/1137021611.db2.gz NNUFMVNEJLHNMS-KXBFYZLASA-N 1 1 326.396 3.639 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)c(OC)c1 ZINC000859631942 1137023712 /nfs/dbraw/zinc/02/37/12/1137023712.db2.gz VWXBBBOFQLRZGN-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@](C)(O)c1ccccc1 ZINC000822515551 1137063889 /nfs/dbraw/zinc/06/38/89/1137063889.db2.gz CGHJLOWZENLVKU-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@](C)(O)c1ccccc1 ZINC000822515551 1137063891 /nfs/dbraw/zinc/06/38/91/1137063891.db2.gz CGHJLOWZENLVKU-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362093 1137215384 /nfs/dbraw/zinc/21/53/84/1137215384.db2.gz XSEZFLYHLCEVTM-KSSFIOAISA-N 1 1 346.452 3.741 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000794626672 1137221675 /nfs/dbraw/zinc/22/16/75/1137221675.db2.gz KUPVMHHWMUSNLV-UHFFFAOYSA-N 1 1 345.399 3.505 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)c2)c1 ZINC000844749794 1137249794 /nfs/dbraw/zinc/24/97/94/1137249794.db2.gz IMFDZIYVVFVEHI-MRXNPFEDSA-N 1 1 348.353 3.537 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)c2)c1 ZINC000844749794 1137249796 /nfs/dbraw/zinc/24/97/96/1137249796.db2.gz IMFDZIYVVFVEHI-MRXNPFEDSA-N 1 1 348.353 3.537 20 5 EHBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000845529345 1137297003 /nfs/dbraw/zinc/29/70/03/1137297003.db2.gz VDKKICISSZFQBZ-SNVBAGLBSA-N 1 1 338.770 3.505 20 5 EHBDMO C[C@@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000795119013 1137491730 /nfs/dbraw/zinc/49/17/30/1137491730.db2.gz BAROTQSWAZVRAH-CYBMUJFWSA-N 1 1 337.851 3.554 20 5 EHBDMO COCCCCc1ccc[nH+]c1NCc1cccc([N+](=O)[O-])c1C ZINC000871864458 1137561262 /nfs/dbraw/zinc/56/12/62/1137561262.db2.gz XZDXNOKGZGSHDM-UHFFFAOYSA-N 1 1 329.400 3.879 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CO)c1ccccc1 ZINC000872036071 1137566732 /nfs/dbraw/zinc/56/67/32/1137566732.db2.gz RTEHIFNLJKUHJX-BLLLJJGKSA-N 1 1 332.425 3.701 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1cc(C)[nH]n1 ZINC000872049626 1137567780 /nfs/dbraw/zinc/56/77/80/1137567780.db2.gz UHWNETMYKFWAGM-JQWIXIFHSA-N 1 1 334.445 3.630 20 5 EHBDMO Cc1c(C[NH2+][C@@H](c2ccccc2)[C@H](O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138764 1137591232 /nfs/dbraw/zinc/59/12/32/1137591232.db2.gz MPVLWTWLLQXQRF-RBUKOAKNSA-N 1 1 328.412 3.751 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccc[nH]1 ZINC000877123966 1137670653 /nfs/dbraw/zinc/67/06/53/1137670653.db2.gz HGQZIHDRUIELKR-ZETCQYMHSA-N 1 1 330.207 3.598 20 5 EHBDMO Cc1csc([C@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813826 1137690968 /nfs/dbraw/zinc/69/09/68/1137690968.db2.gz PKNJCVQOEWWUBX-VOKGJARPSA-N 1 1 329.425 3.862 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000880053267 1137766842 /nfs/dbraw/zinc/76/68/42/1137766842.db2.gz LAANDGBXACQOOK-SMDDNHRTSA-N 1 1 332.322 3.617 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000880053267 1137766843 /nfs/dbraw/zinc/76/68/43/1137766843.db2.gz LAANDGBXACQOOK-SMDDNHRTSA-N 1 1 332.322 3.617 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880097376 1137768018 /nfs/dbraw/zinc/76/80/18/1137768018.db2.gz PWPPIANEMCFYQV-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000120890084 1137953317 /nfs/dbraw/zinc/95/33/17/1137953317.db2.gz AGIBQCTVKUHHJY-CQSZACIVSA-N 1 1 345.418 3.955 20 5 EHBDMO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885969568 1138029319 /nfs/dbraw/zinc/02/93/19/1138029319.db2.gz WONOVFTWGRAQFV-QGZVFWFLSA-N 1 1 327.384 3.508 20 5 EHBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885969568 1138029321 /nfs/dbraw/zinc/02/93/21/1138029321.db2.gz WONOVFTWGRAQFV-QGZVFWFLSA-N 1 1 327.384 3.508 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000181917073 1139939837 /nfs/dbraw/zinc/93/98/37/1139939837.db2.gz JBSUEXPRLXBJDM-OAHLLOKOSA-N 1 1 330.409 3.930 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000182123024 1139952033 /nfs/dbraw/zinc/95/20/33/1139952033.db2.gz YVHBJBPYNJAJAC-NSHDSACASA-N 1 1 335.791 3.893 20 5 EHBDMO Cc1cnn([C@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760526 1139991012 /nfs/dbraw/zinc/99/10/12/1139991012.db2.gz CXSDBPBANURGEM-RDJZCZTQSA-N 1 1 328.416 3.806 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000183390666 1140034852 /nfs/dbraw/zinc/03/48/52/1140034852.db2.gz CFDGOWWVLFTIAE-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000183390666 1140034855 /nfs/dbraw/zinc/03/48/55/1140034855.db2.gz CFDGOWWVLFTIAE-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cs1 ZINC000267468776 1140794804 /nfs/dbraw/zinc/79/48/04/1140794804.db2.gz WPHUEEAETYBLSX-STQMWFEESA-N 1 1 338.454 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cs1 ZINC000267468776 1140794809 /nfs/dbraw/zinc/79/48/09/1140794809.db2.gz WPHUEEAETYBLSX-STQMWFEESA-N 1 1 338.454 3.806 20 5 EHBDMO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000268209549 1140903061 /nfs/dbraw/zinc/90/30/61/1140903061.db2.gz HNUONQVVMQBEOT-GFCCVEGCSA-N 1 1 330.413 3.805 20 5 EHBDMO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000268209549 1140903064 /nfs/dbraw/zinc/90/30/64/1140903064.db2.gz HNUONQVVMQBEOT-GFCCVEGCSA-N 1 1 330.413 3.805 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(F)c1 ZINC000268839517 1141005272 /nfs/dbraw/zinc/00/52/72/1141005272.db2.gz QJGOZCOZLLSRRK-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687371 1141135381 /nfs/dbraw/zinc/13/53/81/1141135381.db2.gz TVZMAYBXGOUAOA-MSOLQXFVSA-N 1 1 330.359 3.604 20 5 EHBDMO COc1ccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1[N+](=O)[O-] ZINC000269853625 1141151049 /nfs/dbraw/zinc/15/10/49/1141151049.db2.gz PROQFVPTLNUWEO-AWEZNQCLSA-N 1 1 334.322 3.659 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCC[C@@H]1O ZINC000270170608 1141187951 /nfs/dbraw/zinc/18/79/51/1141187951.db2.gz UGPBAVRPUOMXHN-QAPCUYQASA-N 1 1 337.419 3.539 20 5 EHBDMO O=C(C[NH+]1CCC2(CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000608833577 1014766645 /nfs/dbraw/zinc/76/66/45/1014766645.db2.gz SXDMKIYCWSLAEU-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000430199657 1014845988 /nfs/dbraw/zinc/84/59/88/1014845988.db2.gz DBHYROZYVYMXCY-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000430199657 1014846003 /nfs/dbraw/zinc/84/60/03/1014846003.db2.gz DBHYROZYVYMXCY-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302045563 1014945045 /nfs/dbraw/zinc/94/50/45/1014945045.db2.gz KILYNVKOMMVPCN-NEPJUHHUSA-N 1 1 338.839 3.708 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000198594737 1125488407 /nfs/dbraw/zinc/48/84/07/1125488407.db2.gz HPQZQNBZKJZKPH-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000430214642 1015021297 /nfs/dbraw/zinc/02/12/97/1015021297.db2.gz CCYJERBWFNJKAR-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000430214642 1015021309 /nfs/dbraw/zinc/02/13/09/1015021309.db2.gz CCYJERBWFNJKAR-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000247132418 1016597570 /nfs/dbraw/zinc/59/75/70/1016597570.db2.gz VPEOTBVGWDMZPF-XJKSGUPXSA-N 1 1 346.456 3.855 20 5 EHBDMO CC(C)c1ccc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000189929002 1016781051 /nfs/dbraw/zinc/78/10/51/1016781051.db2.gz ZZCCUGAZLFJOPE-INIZCTEOSA-N 1 1 347.459 3.665 20 5 EHBDMO CC(C)C[C@H]([NH3+])c1noc(-c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000414613694 1017032542 /nfs/dbraw/zinc/03/25/42/1017032542.db2.gz GBFWXCLHRLMQFV-HNNXBMFYSA-N 1 1 348.406 3.777 20 5 EHBDMO COc1ccc([C@H](C)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279536 1032267091 /nfs/dbraw/zinc/26/70/91/1032267091.db2.gz KEMYBECXNGQSGT-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO COCc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502975 1032685091 /nfs/dbraw/zinc/68/50/91/1032685091.db2.gz SKXOIUCLSDJHTH-HNNXBMFYSA-N 1 1 330.384 3.714 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000610281963 1017615089 /nfs/dbraw/zinc/61/50/89/1017615089.db2.gz OLFSPAKKHCNUOI-INIZCTEOSA-N 1 1 345.830 3.959 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351921 1017971658 /nfs/dbraw/zinc/97/16/58/1017971658.db2.gz ADDQDXSPZZGJQF-OCCSQVGLSA-N 1 1 326.824 3.764 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000574200716 1032738435 /nfs/dbraw/zinc/73/84/35/1032738435.db2.gz DWIHXFTUGXXKOY-DHZHZOJOSA-N 1 1 325.412 3.806 20 5 EHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410597 1018933316 /nfs/dbraw/zinc/93/33/16/1018933316.db2.gz VJCAACNBIZWXAK-JQWIXIFHSA-N 1 1 344.358 3.825 20 5 EHBDMO C[C@@H]1[C@@H](C)[C@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000419379860 1019008671 /nfs/dbraw/zinc/00/86/71/1019008671.db2.gz XEZWWNMHLYQYCG-HZSPNIEDSA-N 1 1 329.400 3.769 20 5 EHBDMO CC[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427621 1032816543 /nfs/dbraw/zinc/81/65/43/1032816543.db2.gz JFBZSKYVLDHTCJ-BBRMVZONSA-N 1 1 345.468 3.883 20 5 EHBDMO Cn1cccc1C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000129334447 1019560232 /nfs/dbraw/zinc/56/02/32/1019560232.db2.gz LARSQFOMRDUEHQ-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000129334447 1019560245 /nfs/dbraw/zinc/56/02/45/1019560245.db2.gz LARSQFOMRDUEHQ-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1 ZINC000610452221 1019833516 /nfs/dbraw/zinc/83/35/16/1019833516.db2.gz YRUMEWZXMUFDBU-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000129789957 1032901330 /nfs/dbraw/zinc/90/13/30/1032901330.db2.gz KAJITJZZZUHUMV-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000129789957 1032901338 /nfs/dbraw/zinc/90/13/38/1032901338.db2.gz KAJITJZZZUHUMV-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO C[N@@H+](CCc1nccs1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602482026 1032911502 /nfs/dbraw/zinc/91/15/02/1032911502.db2.gz FDSBDDBGDIPKSU-UHFFFAOYSA-N 1 1 345.346 3.745 20 5 EHBDMO COc1cc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000361029389 1020891356 /nfs/dbraw/zinc/89/13/56/1020891356.db2.gz HBDLOIFIXAANJD-AWEZNQCLSA-N 1 1 329.400 3.536 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505883568 1021237184 /nfs/dbraw/zinc/23/71/84/1021237184.db2.gz CENCQVXWPRLMSB-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505883568 1021237194 /nfs/dbraw/zinc/23/71/94/1021237194.db2.gz CENCQVXWPRLMSB-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(Cl)c1 ZINC000322895819 1021372652 /nfs/dbraw/zinc/37/26/52/1021372652.db2.gz BSPBGKWGCYTILD-UAGQMJEPSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@H](CC[NH3+])NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414897591 1021517074 /nfs/dbraw/zinc/51/70/74/1021517074.db2.gz RWGCAALBHGRHMM-GFCCVEGCSA-N 1 1 349.818 3.867 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000441403184 1022232893 /nfs/dbraw/zinc/23/28/93/1022232893.db2.gz GDCVMMUKBVBQMD-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000441403184 1022232906 /nfs/dbraw/zinc/23/29/06/1022232906.db2.gz GDCVMMUKBVBQMD-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO C[C@@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000187517764 1022277053 /nfs/dbraw/zinc/27/70/53/1022277053.db2.gz ILFORVQHCLXOQP-CQSZACIVSA-N 1 1 328.416 3.617 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000506846035 1022396438 /nfs/dbraw/zinc/39/64/38/1022396438.db2.gz HJQZMGSTUWULKC-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000506846035 1022396453 /nfs/dbraw/zinc/39/64/53/1022396453.db2.gz HJQZMGSTUWULKC-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO COc1cc2c(cc1Cl)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000550111961 1022472736 /nfs/dbraw/zinc/47/27/36/1022472736.db2.gz HEAUDCWBKUVPBN-UHFFFAOYSA-N 1 1 346.814 3.858 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)[C@H](C)O1 ZINC000438346894 1022585092 /nfs/dbraw/zinc/58/50/92/1022585092.db2.gz FEYCVKWXBZHJQK-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)[C@H](C)O1 ZINC000438346894 1022585095 /nfs/dbraw/zinc/58/50/95/1022585095.db2.gz FEYCVKWXBZHJQK-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nccn3C3CC3)C2)cc1 ZINC000894720318 1022790721 /nfs/dbraw/zinc/79/07/21/1022790721.db2.gz VBQPLUTZGPNIFD-OAHLLOKOSA-N 1 1 326.400 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nccn3C3CC3)C2)cc1 ZINC000894720318 1022790734 /nfs/dbraw/zinc/79/07/34/1022790734.db2.gz VBQPLUTZGPNIFD-OAHLLOKOSA-N 1 1 326.400 3.506 20 5 EHBDMO Cc1ncc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684815 1033084716 /nfs/dbraw/zinc/08/47/16/1033084716.db2.gz IQIBPTJSJWHWRW-RHSMWYFYSA-N 1 1 340.427 3.942 20 5 EHBDMO Cc1ncc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684814 1033085147 /nfs/dbraw/zinc/08/51/47/1033085147.db2.gz IQIBPTJSJWHWRW-PBHICJAKSA-N 1 1 340.427 3.942 20 5 EHBDMO CCC[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000353921885 1023005557 /nfs/dbraw/zinc/00/55/57/1023005557.db2.gz OGZGGNYOXXRLCE-SJORKVTESA-N 1 1 328.416 3.910 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1NCC[N@@H+]1CCc2sccc2C1 ZINC000506994595 1023067451 /nfs/dbraw/zinc/06/74/51/1023067451.db2.gz JMAPTQUFKSIPCW-UHFFFAOYSA-N 1 1 337.832 3.780 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1NCC[N@H+]1CCc2sccc2C1 ZINC000506994595 1023067461 /nfs/dbraw/zinc/06/74/61/1023067461.db2.gz JMAPTQUFKSIPCW-UHFFFAOYSA-N 1 1 337.832 3.780 20 5 EHBDMO CN1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427961 1023125860 /nfs/dbraw/zinc/12/58/60/1023125860.db2.gz NITYVFKZEREGIY-AWEZNQCLSA-N 1 1 345.468 3.755 20 5 EHBDMO Cc1[nH]nc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc12 ZINC000507173577 1023174121 /nfs/dbraw/zinc/17/41/21/1023174121.db2.gz OAAKNKVPBRGBEM-UHFFFAOYSA-N 1 1 339.399 3.585 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507233864 1023207105 /nfs/dbraw/zinc/20/71/05/1023207105.db2.gz PPZXYOSDYYOSFS-LIRRHRJNSA-N 1 1 326.396 3.902 20 5 EHBDMO CCOc1cc(C[NH2+][C@@](C)(CC)c2nccs2)ccc1[N+](=O)[O-] ZINC000276977768 1023524349 /nfs/dbraw/zinc/52/43/49/1023524349.db2.gz XVEHYDRPMQPRBS-INIZCTEOSA-N 1 1 335.429 3.865 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)cs1 ZINC000449765505 1033178526 /nfs/dbraw/zinc/17/85/26/1033178526.db2.gz ISFLVWYKTUQXPZ-AWEZNQCLSA-N 1 1 338.454 3.711 20 5 EHBDMO C[C@@H](CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000475021390 1024023392 /nfs/dbraw/zinc/02/33/92/1024023392.db2.gz BSSARDGNFJLFJH-INIZCTEOSA-N 1 1 340.423 3.948 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000353865298 1024054235 /nfs/dbraw/zinc/05/42/35/1024054235.db2.gz KQNXRMIBKIQDQM-SJORKVTESA-N 1 1 340.427 3.792 20 5 EHBDMO CC[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000430081371 1024339311 /nfs/dbraw/zinc/33/93/11/1024339311.db2.gz DKRKLIWTQHOVDQ-CYBMUJFWSA-N 1 1 348.374 3.729 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507901067 1024760254 /nfs/dbraw/zinc/76/02/54/1024760254.db2.gz DOBAFLPKYWJRAK-HNNXBMFYSA-N 1 1 343.402 3.613 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cs1 ZINC000602888061 1033235820 /nfs/dbraw/zinc/23/58/20/1033235820.db2.gz OVOJCPROQNASFJ-AWEZNQCLSA-N 1 1 340.408 3.589 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCOC1 ZINC000119708320 1024928042 /nfs/dbraw/zinc/92/80/42/1024928042.db2.gz GKMNAGPRWYLMSM-CYBMUJFWSA-N 1 1 347.440 3.577 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039195 1025072866 /nfs/dbraw/zinc/07/28/66/1025072866.db2.gz CNZJESPUWZGWOK-ZBFHGGJFSA-N 1 1 347.459 3.693 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccc(F)cn2)CC1 ZINC000602906640 1033257320 /nfs/dbraw/zinc/25/73/20/1033257320.db2.gz YKKOEZBLEWGZTA-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000443992841 1025156325 /nfs/dbraw/zinc/15/63/25/1025156325.db2.gz YLPNIKSATUQDMY-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1cccc(F)c1 ZINC000019540978 1025174997 /nfs/dbraw/zinc/17/49/97/1025174997.db2.gz NVOMHTPBYNLEMI-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1cccc(F)c1 ZINC000019540978 1025175006 /nfs/dbraw/zinc/17/50/06/1025175006.db2.gz NVOMHTPBYNLEMI-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000185480317 1025184838 /nfs/dbraw/zinc/18/48/38/1025184838.db2.gz ICKBIUYCMAAUFH-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896227664 1025261688 /nfs/dbraw/zinc/26/16/88/1025261688.db2.gz NUNQXHYFWUEOTB-PKXJPQMGSA-N 1 1 344.308 3.974 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158055467 1025334026 /nfs/dbraw/zinc/33/40/26/1025334026.db2.gz WLACQYAJHGHZNQ-MRXNPFEDSA-N 1 1 326.396 3.635 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000602953840 1033276110 /nfs/dbraw/zinc/27/61/10/1033276110.db2.gz DIZWDPRJMSNBRK-UHFFFAOYSA-N 1 1 347.440 3.515 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896493848 1025497721 /nfs/dbraw/zinc/49/77/21/1025497721.db2.gz WOBMZGKROULLQA-JBXOJTMHSA-N 1 1 340.427 3.611 20 5 EHBDMO Cc1cccc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000478051313 1025623089 /nfs/dbraw/zinc/62/30/89/1025623089.db2.gz CHTOARCCCLCDLH-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cccc(CCC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511093133 1025648102 /nfs/dbraw/zinc/64/81/02/1025648102.db2.gz CGYATIPKBXPVLL-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[N@H+](C(C)(C)C)CC1 ZINC000530342005 1025680040 /nfs/dbraw/zinc/68/00/40/1025680040.db2.gz AHZCBQOJCFWJOV-DTQAZKPQSA-N 1 1 331.460 3.804 20 5 EHBDMO Cc1ccc(N2CC[N@H+](Cc3ccccc3[N+](=O)[O-])[C@@H](C)C2)cc1C ZINC001167558299 1025679953 /nfs/dbraw/zinc/67/99/53/1025679953.db2.gz LIZSUDKRWNLPTH-KRWDZBQOSA-N 1 1 339.439 3.922 20 5 EHBDMO Cc1ccc(N2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])[C@@H](C)C2)cc1C ZINC001167558299 1025679956 /nfs/dbraw/zinc/67/99/56/1025679956.db2.gz LIZSUDKRWNLPTH-KRWDZBQOSA-N 1 1 339.439 3.922 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425544179 1025704016 /nfs/dbraw/zinc/70/40/16/1025704016.db2.gz BTSWTBKYIUCRHH-KSSFIOAISA-N 1 1 330.428 3.937 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425544178 1025704487 /nfs/dbraw/zinc/70/44/87/1025704487.db2.gz BTSWTBKYIUCRHH-KDOFPFPSSA-N 1 1 330.428 3.937 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425559236 1025753524 /nfs/dbraw/zinc/75/35/24/1025753524.db2.gz ZBIRJJJWWAJTCR-KRWDZBQOSA-N 1 1 334.391 3.515 20 5 EHBDMO Cc1cc(N2CC[NH+](C/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000522167857 1026048615 /nfs/dbraw/zinc/04/86/15/1026048615.db2.gz WSWLDJQKWHCQJJ-VMPITWQZSA-N 1 1 337.423 3.739 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1sccc1Br ZINC000050015726 1026348978 /nfs/dbraw/zinc/34/89/78/1026348978.db2.gz QDMNIPRNMKRKQD-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C2CC2)O1 ZINC000475282910 1026441772 /nfs/dbraw/zinc/44/17/72/1026441772.db2.gz VCOUGDBAKAQXCD-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C2CC2)O1 ZINC000475282910 1026441776 /nfs/dbraw/zinc/44/17/76/1026441776.db2.gz VCOUGDBAKAQXCD-BFUOFWGJSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000511156698 1026561138 /nfs/dbraw/zinc/56/11/38/1026561138.db2.gz ACZBOZVJDITGQB-INIZCTEOSA-N 1 1 347.462 3.850 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)o1 ZINC000342833960 1027553021 /nfs/dbraw/zinc/55/30/21/1027553021.db2.gz CZJREJQVWDEFPJ-IBGZPJMESA-N 1 1 342.395 3.857 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)o1 ZINC000342833961 1027554398 /nfs/dbraw/zinc/55/43/98/1027554398.db2.gz CZJREJQVWDEFPJ-LJQANCHMSA-N 1 1 342.395 3.857 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078562434 1027964893 /nfs/dbraw/zinc/96/48/93/1027964893.db2.gz NGACTHWTNBYZHC-GFCCVEGCSA-N 1 1 345.365 3.782 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCC[C@H]1C ZINC000444667680 1028140205 /nfs/dbraw/zinc/14/02/05/1028140205.db2.gz YYNKLRLIPJNARU-PBHICJAKSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCC[C@@H]1C ZINC000444667682 1028140423 /nfs/dbraw/zinc/14/04/23/1028140423.db2.gz YYNKLRLIPJNARU-WMLDXEAASA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1C ZINC000444677650 1028148110 /nfs/dbraw/zinc/14/81/10/1028148110.db2.gz QAQYSSVWMJBBAW-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444747555 1028236308 /nfs/dbraw/zinc/23/63/08/1028236308.db2.gz AKZFWPPVAXBZGO-CQSZACIVSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202081 1028269879 /nfs/dbraw/zinc/26/98/79/1028269879.db2.gz ALHMPRDMDCBAIC-UONOGXRCSA-N 1 1 345.468 3.974 20 5 EHBDMO C[C@H](N[C@@H]1CC[NH2+]C[C@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398888 1028413193 /nfs/dbraw/zinc/41/31/93/1028413193.db2.gz PDHVOOPINYJCKS-VNHYZAJKSA-N 1 1 345.468 3.972 20 5 EHBDMO C[N@@H+](CCCOc1ccc(F)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000523702130 1028557434 /nfs/dbraw/zinc/55/74/34/1028557434.db2.gz SEYOXQMXRQZEGA-UHFFFAOYSA-N 1 1 332.375 3.677 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cs1 ZINC000286194386 1028824687 /nfs/dbraw/zinc/82/46/87/1028824687.db2.gz XPXLXOAMKCQETG-BRWVUGGUSA-N 1 1 344.436 3.661 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000533287918 1029578984 /nfs/dbraw/zinc/57/89/84/1029578984.db2.gz HXCXQPCZHWCHCZ-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000533290613 1029584082 /nfs/dbraw/zinc/58/40/82/1029584082.db2.gz LVBLZEGHPBBNCO-INIZCTEOSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@]1(O)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428446994 1029689725 /nfs/dbraw/zinc/68/97/25/1029689725.db2.gz KXUKPVKLURFERH-KRWDZBQOSA-N 1 1 332.425 3.670 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCOCCc1ccccc1)C2 ZINC000536005096 1029725406 /nfs/dbraw/zinc/72/54/06/1029725406.db2.gz XYOGKHHPPXWKBL-UHFFFAOYSA-N 1 1 340.423 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)CC2(O)CCCC2)c1 ZINC000531888792 1029983237 /nfs/dbraw/zinc/98/32/37/1029983237.db2.gz CQPRSIYTARRAIU-UHFFFAOYSA-N 1 1 340.423 3.902 20 5 EHBDMO CC[C@]1(C(C)C)C[C@H]1[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453441178 1030258616 /nfs/dbraw/zinc/25/86/16/1030258616.db2.gz MVOJNVOGVFRGOT-ZHALLVOQSA-N 1 1 342.443 3.832 20 5 EHBDMO COc1cc(C[N@@H+]2CCC(C)=C(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000482450095 1030434064 /nfs/dbraw/zinc/43/40/64/1030434064.db2.gz ICDWYKHUPMRMJR-UHFFFAOYSA-N 1 1 342.342 3.747 20 5 EHBDMO COc1cc(C[N@H+]2CCC(C)=C(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000482450095 1030434069 /nfs/dbraw/zinc/43/40/69/1030434069.db2.gz ICDWYKHUPMRMJR-UHFFFAOYSA-N 1 1 342.342 3.747 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293453 1030527129 /nfs/dbraw/zinc/52/71/29/1030527129.db2.gz YJTYSAOZKAVYHG-IBGZPJMESA-N 1 1 326.396 3.767 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](CC(C)C)C1 ZINC001168147705 1030927273 /nfs/dbraw/zinc/92/72/73/1030927273.db2.gz WXUHJTLVPUAJPD-INIZCTEOSA-N 1 1 347.459 3.990 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000483120923 1030967300 /nfs/dbraw/zinc/96/73/00/1030967300.db2.gz LIYIKLDITHDVLR-LBPRGKRZSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483254981 1031068579 /nfs/dbraw/zinc/06/85/79/1031068579.db2.gz IWTQSZFLWAFKHE-KGLIPLIRSA-N 1 1 333.432 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)cc1Cl ZINC000898071743 1033324789 /nfs/dbraw/zinc/32/47/89/1033324789.db2.gz RNYMPCPEUXLUNI-LBPRGKRZSA-N 1 1 337.832 3.769 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485924 1033367320 /nfs/dbraw/zinc/36/73/20/1033367320.db2.gz TZRWEYUWGDVNRN-ZFWWWQNUSA-N 1 1 334.445 3.508 20 5 EHBDMO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000598680271 1033379642 /nfs/dbraw/zinc/37/96/42/1033379642.db2.gz UJSBDZZCBDBLNL-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1[nH+]cn(CCCCc2noc(-c3ccc([N+](=O)[O-])s3)n2)c1C ZINC000594535666 1033437725 /nfs/dbraw/zinc/43/77/25/1033437725.db2.gz ZYCRENIJEMKCHL-UHFFFAOYSA-N 1 1 347.400 3.543 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])n1cc(C[N@@H+](C)C2CCCCC2)nn1 ZINC000603220882 1033439201 /nfs/dbraw/zinc/43/92/01/1033439201.db2.gz WNFWWTWQOAGCLH-CQSZACIVSA-N 1 1 343.431 3.560 20 5 EHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293223 1033574138 /nfs/dbraw/zinc/57/41/38/1033574138.db2.gz TUIYLQZGPKCQBV-UKRRQHHQSA-N 1 1 348.472 3.816 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000593660939 1033636967 /nfs/dbraw/zinc/63/69/67/1033636967.db2.gz SWBMHBSGQRNSQS-UAGQMJEPSA-N 1 1 342.443 3.832 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H](C)C2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595068077 1033643479 /nfs/dbraw/zinc/64/34/79/1033643479.db2.gz OENAGXLRBYZZQQ-FZKQIMNGSA-N 1 1 344.411 3.590 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000595079522 1033697329 /nfs/dbraw/zinc/69/73/29/1033697329.db2.gz KBLIQCCIIQKNEG-KRWDZBQOSA-N 1 1 328.416 3.588 20 5 EHBDMO C[C@H](CO)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670814 1033942400 /nfs/dbraw/zinc/94/24/00/1033942400.db2.gz DNPVLWXDCHTWLD-ABAIWWIYSA-N 1 1 346.349 3.597 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000595716259 1033960614 /nfs/dbraw/zinc/96/06/14/1033960614.db2.gz GIBASVMNTFOGGD-KRWDZBQOSA-N 1 1 328.368 3.542 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000595716259 1033960621 /nfs/dbraw/zinc/96/06/21/1033960621.db2.gz GIBASVMNTFOGGD-KRWDZBQOSA-N 1 1 328.368 3.542 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000595748881 1033978995 /nfs/dbraw/zinc/97/89/95/1033978995.db2.gz YQMFXYDHYOQFGP-RBUKOAKNSA-N 1 1 340.423 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1 ZINC000595788258 1033997918 /nfs/dbraw/zinc/99/79/18/1033997918.db2.gz HOEYLHIGZDOHEK-QFBILLFUSA-N 1 1 348.443 3.645 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000595867733 1034031504 /nfs/dbraw/zinc/03/15/04/1034031504.db2.gz PPARPGSDZLBPJF-UONOGXRCSA-N 1 1 347.415 3.546 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000603932097 1034041629 /nfs/dbraw/zinc/04/16/29/1034041629.db2.gz BZMWUXTXLZEEOE-UHFFFAOYSA-N 1 1 335.423 3.826 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2(C)C)c1[N+](=O)[O-] ZINC000599630710 1034056746 /nfs/dbraw/zinc/05/67/46/1034056746.db2.gz UWUDZXQGHKNUBJ-AWEZNQCLSA-N 1 1 333.363 3.798 20 5 EHBDMO O=c1[nH]ccc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)c1[N+](=O)[O-] ZINC000596057866 1034056741 /nfs/dbraw/zinc/05/67/41/1034056741.db2.gz CPATXJQOSXEECE-UHFFFAOYSA-N 1 1 339.355 3.515 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690700 1034094109 /nfs/dbraw/zinc/09/41/09/1034094109.db2.gz PGUAFRYWOSCHOY-PYLYLYNFSA-N 1 1 342.399 3.823 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679260 1034107080 /nfs/dbraw/zinc/10/70/80/1034107080.db2.gz LXWQWPSQRDXMII-OAHLLOKOSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612584140 1035077005 /nfs/dbraw/zinc/07/70/05/1035077005.db2.gz RSZVAGLVYHLWKK-SFHVURJKSA-N 1 1 330.359 3.696 20 5 EHBDMO CC[C@H](C)[N@@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592925 1035649075 /nfs/dbraw/zinc/64/90/75/1035649075.db2.gz KXJKTUIYUOBWSH-JTQLQIEISA-N 1 1 332.347 3.825 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCO1 ZINC000511504781 1035905754 /nfs/dbraw/zinc/90/57/54/1035905754.db2.gz AMEBYCYLYMQKHH-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[N@H+]1CC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155413 1035919373 /nfs/dbraw/zinc/91/93/73/1035919373.db2.gz FJFVBIMQLOFCHF-UZLBHIALSA-N 1 1 339.439 3.616 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Br)o1 ZINC000549408276 1035922378 /nfs/dbraw/zinc/92/23/78/1035922378.db2.gz MROHXTJEZDJOIB-UHFFFAOYSA-N 1 1 339.189 3.625 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2cccnc2)C(C)C)ccc1[N+](=O)[O-] ZINC000492558435 1035979487 /nfs/dbraw/zinc/97/94/87/1035979487.db2.gz LUOHWDCWVGATFW-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)CCSCC)ccc1[N+](=O)[O-] ZINC000492721853 1036230393 /nfs/dbraw/zinc/23/03/93/1036230393.db2.gz LQBHTZCCRJZGHQ-CYBMUJFWSA-N 1 1 326.462 3.957 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000589114332 1036259311 /nfs/dbraw/zinc/25/93/11/1036259311.db2.gz WXTCBUMHAJKUIA-UHFFFAOYSA-N 1 1 328.294 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(C4CCC4)CC3)n2)cc1 ZINC000595660003 1036259606 /nfs/dbraw/zinc/25/96/06/1036259606.db2.gz PXGIITZORLMYJL-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200175 1036306327 /nfs/dbraw/zinc/30/63/27/1036306327.db2.gz VQUVAWFZZFZSGV-RRWQFYAYSA-N 1 1 330.428 3.747 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000589499624 1036440212 /nfs/dbraw/zinc/44/02/12/1036440212.db2.gz YEBPNRKWPCKTSL-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000589499624 1036440216 /nfs/dbraw/zinc/44/02/16/1036440216.db2.gz YEBPNRKWPCKTSL-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000609134004 1036527694 /nfs/dbraw/zinc/52/76/94/1036527694.db2.gz XCJQKZJHLIOXTO-UHFFFAOYSA-N 1 1 342.395 3.560 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000609134004 1036527710 /nfs/dbraw/zinc/52/77/10/1036527710.db2.gz XCJQKZJHLIOXTO-UHFFFAOYSA-N 1 1 342.395 3.560 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742944 1036600149 /nfs/dbraw/zinc/60/01/49/1036600149.db2.gz KHVSPHNMVGDLFF-BVUBDWEXSA-N 1 1 338.473 3.808 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)Cc1cccc(Cl)c1 ZINC000541772556 1036643209 /nfs/dbraw/zinc/64/32/09/1036643209.db2.gz GGUOSXOCQGZQAV-UHFFFAOYSA-N 1 1 348.830 3.941 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1CO ZINC000191181965 1036697377 /nfs/dbraw/zinc/69/73/77/1036697377.db2.gz ICDCRLXCZNLTPG-BLLLJJGKSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1nnc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)s1 ZINC000541871445 1036739406 /nfs/dbraw/zinc/73/94/06/1036739406.db2.gz JWLKJQWZJWLUAT-UHFFFAOYSA-N 1 1 346.437 3.773 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000464838370 1036853223 /nfs/dbraw/zinc/85/32/23/1036853223.db2.gz VLLSUFCBEVSJAC-BEFAXECRSA-N 1 1 326.396 3.599 20 5 EHBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000609143781 1036956375 /nfs/dbraw/zinc/95/63/75/1036956375.db2.gz MNARULNWSVRQGT-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(C(F)(F)F)cnn2C)cc1[N+](=O)[O-] ZINC000594940611 1037045815 /nfs/dbraw/zinc/04/58/15/1037045815.db2.gz PDIHFAISZDWDII-JTQLQIEISA-N 1 1 342.321 3.506 20 5 EHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC[C@H]1CCCC[N@@H+]1C ZINC000760792869 1037074317 /nfs/dbraw/zinc/07/43/17/1037074317.db2.gz LYRFKZYGNIRCQX-CYBMUJFWSA-N 1 1 340.807 3.588 20 5 EHBDMO CCc1cccc(C)c1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271781916 1037205705 /nfs/dbraw/zinc/20/57/05/1037205705.db2.gz SJDIVTJRKMELEW-CQSZACIVSA-N 1 1 341.411 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](C4CCC4)C3)co2)cc1 ZINC000591063379 1037225535 /nfs/dbraw/zinc/22/55/35/1037225535.db2.gz SFICJGCAMYKMMA-HNNXBMFYSA-N 1 1 327.384 3.872 20 5 EHBDMO CCc1[nH+]ccn1[C@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310267 1037245440 /nfs/dbraw/zinc/24/54/40/1037245440.db2.gz JFXQREAJWQMPSS-ZDUSSCGKSA-N 1 1 348.834 3.844 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000452081440 1037288968 /nfs/dbraw/zinc/28/89/68/1037288968.db2.gz JWCIBXMJBKVDOW-OAHLLOKOSA-N 1 1 336.432 3.631 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000341175020 1037701521 /nfs/dbraw/zinc/70/15/21/1037701521.db2.gz DXAYNTJGGYELTE-CQSZACIVSA-N 1 1 348.786 3.520 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000341175020 1037701534 /nfs/dbraw/zinc/70/15/34/1037701534.db2.gz DXAYNTJGGYELTE-CQSZACIVSA-N 1 1 348.786 3.520 20 5 EHBDMO COc1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000760930196 1037848260 /nfs/dbraw/zinc/84/82/60/1037848260.db2.gz YCIPZNCHBDIRNR-UHFFFAOYSA-N 1 1 346.814 3.858 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463200465 1037886409 /nfs/dbraw/zinc/88/64/09/1037886409.db2.gz UEYNQBMGLSOFOT-KSZLIROESA-N 1 1 348.443 3.509 20 5 EHBDMO COc1ccc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000443324852 1037892229 /nfs/dbraw/zinc/89/22/29/1037892229.db2.gz YXRDBRHKVPWMBS-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1ccc(C[N@H+]2CC3(CCCC3)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000443324852 1037892246 /nfs/dbraw/zinc/89/22/46/1037892246.db2.gz YXRDBRHKVPWMBS-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549999399 1038012310 /nfs/dbraw/zinc/01/23/10/1038012310.db2.gz DQLZZBPNTWFTKM-HNNXBMFYSA-N 1 1 346.349 3.741 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000467555821 1038472448 /nfs/dbraw/zinc/47/24/48/1038472448.db2.gz WGYDZDRXDWJOPA-UHFFFAOYSA-N 1 1 328.412 3.942 20 5 EHBDMO CCC[C@H]([NH2+][C@H](CO)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000539086557 1038667312 /nfs/dbraw/zinc/66/73/12/1038667312.db2.gz BICDDVHJAGEMJL-ZWKOTPCHSA-N 1 1 344.411 3.768 20 5 EHBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214075 1038697346 /nfs/dbraw/zinc/69/73/46/1038697346.db2.gz QRXPFWSASVQAFD-LJQANCHMSA-N 1 1 344.411 3.839 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959426 1038697385 /nfs/dbraw/zinc/69/73/85/1038697385.db2.gz PLTVMAQXRFUFKC-CRAIPNDOSA-N 1 1 329.375 3.900 20 5 EHBDMO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000539376791 1038868016 /nfs/dbraw/zinc/86/80/16/1038868016.db2.gz KJOHZKHXLZVPRC-ZIAGYGMSSA-N 1 1 341.411 3.835 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000488587556 1039287738 /nfs/dbraw/zinc/28/77/38/1039287738.db2.gz PSHNWRIKIOULOJ-CYBMUJFWSA-N 1 1 328.368 3.907 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328266 1039671107 /nfs/dbraw/zinc/67/11/07/1039671107.db2.gz SFFPXTDINIHVMQ-TXPKVOOTSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328266 1039671115 /nfs/dbraw/zinc/67/11/15/1039671115.db2.gz SFFPXTDINIHVMQ-TXPKVOOTSA-N 1 1 329.444 3.579 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1C ZINC000489147658 1039677117 /nfs/dbraw/zinc/67/71/17/1039677117.db2.gz LJPRPUCCVWOUMH-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1C ZINC000489147658 1039677134 /nfs/dbraw/zinc/67/71/34/1039677134.db2.gz LJPRPUCCVWOUMH-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417325528 1039682397 /nfs/dbraw/zinc/68/23/97/1039682397.db2.gz QUPYHZKXGOECOY-LJQANCHMSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](CCO)c1ccco1)CCCC2 ZINC000417345688 1039707806 /nfs/dbraw/zinc/70/78/06/1039707806.db2.gz SEZWJDNCEDSATM-SJORKVTESA-N 1 1 330.384 3.669 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](CCO)c1ccco1)CCCC2 ZINC000417345685 1039708539 /nfs/dbraw/zinc/70/85/39/1039708539.db2.gz SEZWJDNCEDSATM-DLBZAZTESA-N 1 1 330.384 3.669 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474628 1039768836 /nfs/dbraw/zinc/76/88/36/1039768836.db2.gz IDQPXRFVRWWLAH-CRAIPNDOSA-N 1 1 331.460 3.540 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474628 1039768845 /nfs/dbraw/zinc/76/88/45/1039768845.db2.gz IDQPXRFVRWWLAH-CRAIPNDOSA-N 1 1 331.460 3.540 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000428735671 1040114089 /nfs/dbraw/zinc/11/40/89/1040114089.db2.gz QOESSAFETUYDSS-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000428735671 1040114100 /nfs/dbraw/zinc/11/41/00/1040114100.db2.gz QOESSAFETUYDSS-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[N@H+](C2CCCC2)CC1 ZINC000490013331 1040307203 /nfs/dbraw/zinc/30/72/03/1040307203.db2.gz LTXJJGGAWCTLAJ-MRXNPFEDSA-N 1 1 331.460 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](CCO)CC3CC3)s2)cc1 ZINC000092505871 1040335137 /nfs/dbraw/zinc/33/51/37/1040335137.db2.gz ZSPXIHNLKPKCOG-UHFFFAOYSA-N 1 1 332.425 3.528 20 5 EHBDMO C[C@H]1C[C@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@H+]1Cc1ccccc1 ZINC000511649213 1040398865 /nfs/dbraw/zinc/39/88/65/1040398865.db2.gz WCRKZIVYPNTJCS-RDJZCZTQSA-N 1 1 340.427 3.702 20 5 EHBDMO C[N@@H+](CCSCCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000433018997 1040465498 /nfs/dbraw/zinc/46/54/98/1040465498.db2.gz HQKMFUSGGJRQGM-UHFFFAOYSA-N 1 1 346.452 3.839 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000433025969 1040490228 /nfs/dbraw/zinc/49/02/28/1040490228.db2.gz NJHPGRRHCAXDPG-CQSZACIVSA-N 1 1 340.427 3.760 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547909 1040588193 /nfs/dbraw/zinc/58/81/93/1040588193.db2.gz RICQBXKFDCFDEG-INIZCTEOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547909 1040588203 /nfs/dbraw/zinc/58/82/03/1040588203.db2.gz RICQBXKFDCFDEG-INIZCTEOSA-N 1 1 329.375 3.810 20 5 EHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371468 1040791809 /nfs/dbraw/zinc/79/18/09/1040791809.db2.gz MXYURLXIVJSOIU-CMPLNLGQSA-N 1 1 344.358 3.825 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895310 1040897280 /nfs/dbraw/zinc/89/72/80/1040897280.db2.gz LVNYKBKOEYOYGB-SUMWQHHRSA-N 1 1 328.416 3.843 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000566683304 1041176934 /nfs/dbraw/zinc/17/69/34/1041176934.db2.gz GTMQOXLOGDZYSX-SWLSCSKDSA-N 1 1 345.365 3.520 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000108086462 1042005627 /nfs/dbraw/zinc/00/56/27/1042005627.db2.gz ILRYCXKYUWEKNW-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111310249 1042261423 /nfs/dbraw/zinc/26/14/23/1042261423.db2.gz WBRVFBJVABDQKY-MRXNPFEDSA-N 1 1 347.440 3.748 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](CO)C(C)(C)C ZINC000093821753 1042544742 /nfs/dbraw/zinc/54/47/42/1042544742.db2.gz BCDXHMYCIYELMF-OAHLLOKOSA-N 1 1 349.456 3.557 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799438 1042700767 /nfs/dbraw/zinc/70/07/67/1042700767.db2.gz ZMGDHQPYHQJVRS-CZUORRHYSA-N 1 1 334.416 3.782 20 5 EHBDMO C[N@H+]1CCC[C@@H](CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000568872037 1042900279 /nfs/dbraw/zinc/90/02/79/1042900279.db2.gz QRKMGVKYDCXPRY-SWLSCSKDSA-N 1 1 345.365 3.520 20 5 EHBDMO CC(C)c1ccc(C[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000007905835 1042924384 /nfs/dbraw/zinc/92/43/84/1042924384.db2.gz GNHUOVCXEBQERH-UHFFFAOYSA-N 1 1 341.411 3.789 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000007905835 1042924389 /nfs/dbraw/zinc/92/43/89/1042924389.db2.gz GNHUOVCXEBQERH-UHFFFAOYSA-N 1 1 341.411 3.789 20 5 EHBDMO Cc1ccccc1C[N@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728895802 1043492416 /nfs/dbraw/zinc/49/24/16/1043492416.db2.gz IAPONGYLHUQORW-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728895802 1043492423 /nfs/dbraw/zinc/49/24/23/1043492423.db2.gz IAPONGYLHUQORW-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO Cc1nccnc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279391771 1044034167 /nfs/dbraw/zinc/03/41/67/1044034167.db2.gz CFHPBMHFLVNXRU-SNVBAGLBSA-N 1 1 340.305 3.563 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncc(F)c1 ZINC000279506884 1044150859 /nfs/dbraw/zinc/15/08/59/1044150859.db2.gz NDMOOOWGMHNGCT-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cn1 ZINC000279580027 1044240904 /nfs/dbraw/zinc/24/09/04/1044240904.db2.gz UKFFQBJWNRBAQC-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO CC(C)(C)c1nnc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000344671416 1044269307 /nfs/dbraw/zinc/26/93/07/1044269307.db2.gz LGDHBWJFHUFTGK-VURMDHGXSA-N 1 1 332.429 3.547 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000279669987 1044389685 /nfs/dbraw/zinc/38/96/85/1044389685.db2.gz NEGIUXHGCZGLFH-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000764491605 1127499063 /nfs/dbraw/zinc/49/90/63/1127499063.db2.gz CXVAIJNPOZRIPY-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000764491605 1127499064 /nfs/dbraw/zinc/49/90/64/1127499064.db2.gz CXVAIJNPOZRIPY-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068978 1127569964 /nfs/dbraw/zinc/56/99/64/1127569964.db2.gz UUHLSDBARMJYBS-DLBZAZTESA-N 1 1 346.456 3.570 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000765087254 1127572274 /nfs/dbraw/zinc/57/22/74/1127572274.db2.gz JNXARYQVWPKKSG-GFCCVEGCSA-N 1 1 335.404 3.679 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000301426065 1127742560 /nfs/dbraw/zinc/74/25/60/1127742560.db2.gz PBMBNLHBQZRWOB-LRDDRELGSA-N 1 1 332.429 3.546 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NCc2ccccc2-n2cc[nH+]c2C)c1 ZINC000338660073 1128007787 /nfs/dbraw/zinc/00/77/87/1128007787.db2.gz VWUBLXRRZZXWHV-UHFFFAOYSA-N 1 1 338.367 3.710 20 5 EHBDMO Cc1ccncc1CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000347576119 1128112654 /nfs/dbraw/zinc/11/26/54/1128112654.db2.gz AGYNTOSOGJQRNQ-UHFFFAOYSA-N 1 1 325.412 3.895 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)n[nH]1 ZINC000273024523 1128433607 /nfs/dbraw/zinc/43/36/07/1128433607.db2.gz SMYVPLYTPBENJZ-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)[nH]n1 ZINC000273024523 1128433611 /nfs/dbraw/zinc/43/36/11/1128433611.db2.gz SMYVPLYTPBENJZ-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000091080482 1128445781 /nfs/dbraw/zinc/44/57/81/1128445781.db2.gz JKNSKHPVHJHOQZ-QGZVFWFLSA-N 1 1 344.415 3.541 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccccc1N(C)CC ZINC001649118029 1128489188 /nfs/dbraw/zinc/48/91/88/1128489188.db2.gz VPVZBGWKZQLWNL-UHFFFAOYSA-N 1 1 343.427 3.739 20 5 EHBDMO CC[N@@H+](CC(C)C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737679 1128661385 /nfs/dbraw/zinc/66/13/85/1128661385.db2.gz JAKKLFPIYPWRSH-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1ccnc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000301685433 1128921337 /nfs/dbraw/zinc/92/13/37/1128921337.db2.gz VKBVJBFHRMFPRX-INIZCTEOSA-N 1 1 346.475 3.779 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001626016617 1120981628 /nfs/dbraw/zinc/98/16/28/1120981628.db2.gz WJUBDFNFGUMIKG-MRXNPFEDSA-N 1 1 347.459 3.596 20 5 EHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(C)c(C)c1 ZINC000917148015 1122539286 /nfs/dbraw/zinc/53/92/86/1122539286.db2.gz UEXQUBFXMWRZGM-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCO3)o2)cc1 ZINC000556620408 1123063719 /nfs/dbraw/zinc/06/37/19/1123063719.db2.gz ZXHACWCQRLSJRR-HKUYNNGSSA-N 1 1 342.395 3.998 20 5 EHBDMO C[C@H](CNc1cccc(F)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000919963679 1123248648 /nfs/dbraw/zinc/24/86/48/1123248648.db2.gz SLQLWQXCSMGWPT-CYBMUJFWSA-N 1 1 329.375 3.593 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000609539971 1123607404 /nfs/dbraw/zinc/60/74/04/1123607404.db2.gz LLPGIGRHURUTHB-CQSZACIVSA-N 1 1 330.384 3.965 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1 ZINC000064550905 1123667190 /nfs/dbraw/zinc/66/71/90/1123667190.db2.gz DZASKKSYUPASEA-CQSZACIVSA-N 1 1 331.441 3.980 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000064550906 1123667336 /nfs/dbraw/zinc/66/73/36/1123667336.db2.gz QXGQXLVYXKBFRA-CQSZACIVSA-N 1 1 331.441 3.980 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCc3c(Cl)cccc3C2)cc1 ZINC000610080004 1123726816 /nfs/dbraw/zinc/72/68/16/1123726816.db2.gz ZOUBDVUWVCTPLF-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCc3c(Cl)cccc3C2)cc1 ZINC000610080004 1123726819 /nfs/dbraw/zinc/72/68/19/1123726819.db2.gz ZOUBDVUWVCTPLF-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO Cc1ccccc1C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007845532 1123836251 /nfs/dbraw/zinc/83/62/51/1123836251.db2.gz VKYDLYXEWJSRQN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007845532 1123836258 /nfs/dbraw/zinc/83/62/58/1123836258.db2.gz VKYDLYXEWJSRQN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO CCc1ccc([C@@H](COC)[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])o1 ZINC000255658826 1129171649 /nfs/dbraw/zinc/17/16/49/1129171649.db2.gz UEBTUXYUXFFQNN-QKIRZYONSA-N 1 1 330.384 3.741 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301832638 1129174313 /nfs/dbraw/zinc/17/43/13/1129174313.db2.gz RNUWMXXDAVTEGA-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO COCC[N@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735490691 1131352030 /nfs/dbraw/zinc/35/20/30/1131352030.db2.gz OHUMOFYOAHKJQD-UHFFFAOYSA-N 1 1 348.830 3.939 20 5 EHBDMO COCC[N@@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735490691 1131352034 /nfs/dbraw/zinc/35/20/34/1131352034.db2.gz OHUMOFYOAHKJQD-UHFFFAOYSA-N 1 1 348.830 3.939 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894155 1129289862 /nfs/dbraw/zinc/28/98/62/1129289862.db2.gz WWEOAMCRNSXCSQ-YOEHRIQHSA-N 1 1 346.818 3.809 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000328112998 1129548340 /nfs/dbraw/zinc/54/83/40/1129548340.db2.gz UYTPKRJJDIVYOW-JFIYKMOQSA-N 1 1 348.443 3.509 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214828 1129619612 /nfs/dbraw/zinc/61/96/12/1129619612.db2.gz HVUKIXAKCTWXNN-MRXNPFEDSA-N 1 1 342.395 3.602 20 5 EHBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])cc2F)c(N2CCCC2)[nH+]1 ZINC000302039565 1129764636 /nfs/dbraw/zinc/76/46/36/1129764636.db2.gz HFNDQVUYCDYGEP-UHFFFAOYSA-N 1 1 330.363 3.650 20 5 EHBDMO CC[N@@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000132094325 1129875762 /nfs/dbraw/zinc/87/57/62/1129875762.db2.gz SVPOATPLILJMFJ-OAHLLOKOSA-N 1 1 341.411 3.752 20 5 EHBDMO CC[N@H+]1CC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907099 1130330228 /nfs/dbraw/zinc/33/02/28/1130330228.db2.gz FJFVBIMQLOFCHF-OXQOHEQNSA-N 1 1 339.439 3.616 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000246055893 1130339165 /nfs/dbraw/zinc/33/91/65/1130339165.db2.gz XWJJRVJVCAPJGK-JHJVBQTASA-N 1 1 330.388 3.684 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794895 1131082183 /nfs/dbraw/zinc/08/21/83/1131082183.db2.gz HITFVLDUVBCBSW-JKSUJKDBSA-N 1 1 349.450 3.820 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000742153796 1131694200 /nfs/dbraw/zinc/69/42/00/1131694200.db2.gz ZLWBLKCTRMQVJW-KRWDZBQOSA-N 1 1 328.416 3.820 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000742153796 1131694203 /nfs/dbraw/zinc/69/42/03/1131694203.db2.gz ZLWBLKCTRMQVJW-KRWDZBQOSA-N 1 1 328.416 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](c3cccnc3)C1)CC2 ZINC001172915536 1131902860 /nfs/dbraw/zinc/90/28/60/1131902860.db2.gz OPGPJTKXIRCVRN-RBUKOAKNSA-N 1 1 337.423 3.727 20 5 EHBDMO CC1CC([N@@H+](C)C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010799 1131935881 /nfs/dbraw/zinc/93/58/81/1131935881.db2.gz ZHZKTMLQXYYVRR-UHFFFAOYSA-N 1 1 339.386 3.572 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CC2CC(F)(F)C2)c1F ZINC001173195473 1131996251 /nfs/dbraw/zinc/99/62/51/1131996251.db2.gz GONQWSJOSQRWBM-JTQLQIEISA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001173225939 1132007109 /nfs/dbraw/zinc/00/71/09/1132007109.db2.gz GTJQWEGJIAHDJY-OXQOHEQNSA-N 1 1 340.423 3.817 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000744437182 1132093276 /nfs/dbraw/zinc/09/32/76/1132093276.db2.gz JNGPPJGCDCFSEH-OAHLLOKOSA-N 1 1 328.416 3.784 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCC3(CCC3)CO2)C2CC2)cc1 ZINC001168860546 1132582656 /nfs/dbraw/zinc/58/26/56/1132582656.db2.gz YSHPWNXVTLLPTJ-GOSISDBHSA-N 1 1 330.428 3.909 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039022 1132638513 /nfs/dbraw/zinc/63/85/13/1132638513.db2.gz MPANHCCZJQYBLO-AAEUAGOBSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040026 1132638559 /nfs/dbraw/zinc/63/85/59/1132638559.db2.gz XCAHBRMZIXAPMC-AAEUAGOBSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048729 1132641515 /nfs/dbraw/zinc/64/15/15/1132641515.db2.gz BCEVZSGTKCSIOT-GXFFZTMASA-N 1 1 329.227 3.797 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052014 1132642849 /nfs/dbraw/zinc/64/28/49/1132642849.db2.gz FOHUXDDFXMMXCI-GXTWGEPZSA-N 1 1 329.425 3.571 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052014 1132642855 /nfs/dbraw/zinc/64/28/55/1132642855.db2.gz FOHUXDDFXMMXCI-GXTWGEPZSA-N 1 1 329.425 3.571 20 5 EHBDMO C[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001169396211 1132745771 /nfs/dbraw/zinc/74/57/71/1132745771.db2.gz PZCBRPNEPHZTLG-LLVKDONJSA-N 1 1 327.222 3.979 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1OC ZINC000766843427 1132868448 /nfs/dbraw/zinc/86/84/48/1132868448.db2.gz JBUHDMDPBHFSDL-OAHLLOKOSA-N 1 1 348.374 3.992 20 5 EHBDMO COCC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001176200420 1132887394 /nfs/dbraw/zinc/88/73/94/1132887394.db2.gz BNRVEGWLDZOVBX-UHFFFAOYSA-N 1 1 346.402 3.999 20 5 EHBDMO COCC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001176200420 1132887403 /nfs/dbraw/zinc/88/74/03/1132887403.db2.gz BNRVEGWLDZOVBX-UHFFFAOYSA-N 1 1 346.402 3.999 20 5 EHBDMO COCC[C@H](c1ccccc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000767118572 1132951033 /nfs/dbraw/zinc/95/10/33/1132951033.db2.gz JRUUFSDTNLXWHP-GOSISDBHSA-N 1 1 326.396 3.731 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001176874617 1133006462 /nfs/dbraw/zinc/00/64/62/1133006462.db2.gz PBTYUGCOCDKWPR-PHIMTYICSA-N 1 1 325.206 3.589 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246256 1133250842 /nfs/dbraw/zinc/25/08/42/1133250842.db2.gz YOWMXNWIGUYFLE-QUCCMNQESA-N 1 1 340.423 3.991 20 5 EHBDMO CSCC[C@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769462247 1133295417 /nfs/dbraw/zinc/29/54/17/1133295417.db2.gz CZOAGSNYNAJPOK-JTQLQIEISA-N 1 1 347.278 3.931 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769462247 1133295420 /nfs/dbraw/zinc/29/54/20/1133295420.db2.gz CZOAGSNYNAJPOK-JTQLQIEISA-N 1 1 347.278 3.931 20 5 EHBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC001180332806 1133362733 /nfs/dbraw/zinc/36/27/33/1133362733.db2.gz UMTRUPSFZBQVBH-WFASDCNBSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1nn(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670938 1133457932 /nfs/dbraw/zinc/45/79/32/1133457932.db2.gz UUMJLEBWSMXHCG-ZDUSSCGKSA-N 1 1 328.416 3.723 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517581 1133702869 /nfs/dbraw/zinc/70/28/69/1133702869.db2.gz HNBGPFDUYJUPOT-RVKKMQEKSA-N 1 1 347.459 3.583 20 5 EHBDMO C[C@H](OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877272 1133916035 /nfs/dbraw/zinc/91/60/35/1133916035.db2.gz CDKQUPUZLPHLKS-GUYCJALGSA-N 1 1 332.400 3.606 20 5 EHBDMO C[C@H](OC(=O)[C@H]1CCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879808 1133923525 /nfs/dbraw/zinc/92/35/25/1133923525.db2.gz DVQCHOSYMBRABG-SUMWQHHRSA-N 1 1 332.400 3.606 20 5 EHBDMO Cc1cc(N2CCC[N@@H+](Cc3ccc(C)cc3)CC2)c([N+](=O)[O-])s1 ZINC001184681128 1133981016 /nfs/dbraw/zinc/98/10/16/1133981016.db2.gz KQWSRLBKFOTBRO-UHFFFAOYSA-N 1 1 345.468 3.985 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666696 1133986320 /nfs/dbraw/zinc/98/63/20/1133986320.db2.gz PBLPFCQSVRFIDM-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1F ZINC000788479665 1134130637 /nfs/dbraw/zinc/13/06/37/1134130637.db2.gz ZLXQAMVHWAKAGX-QGZVFWFLSA-N 1 1 344.386 3.915 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC001185775487 1134131605 /nfs/dbraw/zinc/13/16/05/1134131605.db2.gz QERDDIRMVBMERO-MWLCHTKSSA-N 1 1 329.322 3.651 20 5 EHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1cccc(Br)c1[N+](=O)[O-] ZINC001186602626 1134238924 /nfs/dbraw/zinc/23/89/24/1134238924.db2.gz QWQCYZJBPNBSEV-LLVKDONJSA-N 1 1 344.253 3.890 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330109 1134749018 /nfs/dbraw/zinc/74/90/18/1134749018.db2.gz YVPDKJGSVZBVNA-OAHLLOKOSA-N 1 1 340.423 3.901 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170343521 1134758418 /nfs/dbraw/zinc/75/84/18/1134758418.db2.gz PYKSLRZDNFEHHG-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC001170352063 1134761726 /nfs/dbraw/zinc/76/17/26/1134761726.db2.gz KPPARGQHSWPOOP-ZDUSSCGKSA-N 1 1 342.395 3.559 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC001170352063 1134761733 /nfs/dbraw/zinc/76/17/33/1134761733.db2.gz KPPARGQHSWPOOP-ZDUSSCGKSA-N 1 1 342.395 3.559 20 5 EHBDMO Cc1n[nH]cc1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000793610265 1134972011 /nfs/dbraw/zinc/97/20/11/1134972011.db2.gz RWKBFMPXANWCNP-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1)CC1CC1 ZINC000804590734 1135127863 /nfs/dbraw/zinc/12/78/63/1135127863.db2.gz MEVMCZRKAJGPNE-UHFFFAOYSA-N 1 1 346.475 3.515 20 5 EHBDMO C[C@]1(CNc2ccc(N)cc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000804624237 1135145134 /nfs/dbraw/zinc/14/51/34/1135145134.db2.gz KKFYTIQWDCEFMQ-LJQANCHMSA-N 1 1 340.427 3.644 20 5 EHBDMO CC[C@H](C[N@@H+](CC)CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001193594112 1135155874 /nfs/dbraw/zinc/15/58/74/1135155874.db2.gz PMYGRNUIPMSJDT-MRXNPFEDSA-N 1 1 330.432 3.615 20 5 EHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H](O)c1ccc(C)cc1 ZINC000747531226 1135744046 /nfs/dbraw/zinc/74/40/46/1135744046.db2.gz SVYTUTIBLDVKCU-GOSISDBHSA-N 1 1 332.375 3.598 20 5 EHBDMO CC(C)c1ccc2c(c1)CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845362 1135860189 /nfs/dbraw/zinc/86/01/89/1135860189.db2.gz ZKYHRQHJZABMAR-FQEVSTJZSA-N 1 1 340.423 3.810 20 5 EHBDMO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000809946434 1135903326 /nfs/dbraw/zinc/90/33/26/1135903326.db2.gz DOMZWWIBEFOCJG-CYBMUJFWSA-N 1 1 344.242 3.570 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000810048002 1135916091 /nfs/dbraw/zinc/91/60/91/1135916091.db2.gz RWFDLOPNIOYURZ-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000810048002 1135916093 /nfs/dbraw/zinc/91/60/93/1135916093.db2.gz RWFDLOPNIOYURZ-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccccc1CO ZINC000811475670 1136096200 /nfs/dbraw/zinc/09/62/00/1136096200.db2.gz KCVDJVWBQOOERP-UHFFFAOYSA-N 1 1 341.194 3.684 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279853 1136133582 /nfs/dbraw/zinc/13/35/82/1136133582.db2.gz ZELIPEADOGLSBY-KXBFYZLASA-N 1 1 328.412 3.938 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812850652 1136261185 /nfs/dbraw/zinc/26/11/85/1136261185.db2.gz XTGQUSPTOIHAER-IFXJQAMLSA-N 1 1 344.411 3.547 20 5 EHBDMO C[C@]1(c2ccccc2)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584563 1136442586 /nfs/dbraw/zinc/44/25/86/1136442586.db2.gz MYFGNYYSFWLFEQ-UXHICEINSA-N 1 1 340.423 3.682 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577922 1136443410 /nfs/dbraw/zinc/44/34/10/1136443410.db2.gz AUNCZIKSTMFHCU-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)ccc1Cl ZINC000852759446 1136483686 /nfs/dbraw/zinc/48/36/86/1136483686.db2.gz PHZXCCGWGPIGML-CALCHBBNSA-N 1 1 336.819 3.641 20 5 EHBDMO CCc1ccc([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640971 1136487546 /nfs/dbraw/zinc/48/75/46/1136487546.db2.gz ZHQBTRJMNPRNFW-QUCCMNQESA-N 1 1 340.423 3.680 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3c[nH]nc32)cc(C(F)(F)F)c1 ZINC000857864303 1136915249 /nfs/dbraw/zinc/91/52/49/1136915249.db2.gz GWGPKULVBOMYJC-ZDUSSCGKSA-N 1 1 340.305 3.504 20 5 EHBDMO Cc1cc([NH+]2CCCC2)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819398977 1136935940 /nfs/dbraw/zinc/93/59/40/1136935940.db2.gz XJIXFKLGHJWUSX-IBGZPJMESA-N 1 1 341.411 3.649 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000820663846 1137000334 /nfs/dbraw/zinc/00/03/34/1137000334.db2.gz DERFGBNYRUMRSH-UHFFFAOYSA-N 1 1 339.386 3.987 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820670575 1137000363 /nfs/dbraw/zinc/00/03/63/1137000363.db2.gz RFEFBIPEOMDFIZ-LLVKDONJSA-N 1 1 329.803 3.555 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585271 1137021488 /nfs/dbraw/zinc/02/14/88/1137021488.db2.gz MMZIJTMMDVNQFC-BEFAXECRSA-N 1 1 326.396 3.639 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)C1 ZINC000339032783 1137127053 /nfs/dbraw/zinc/12/70/53/1137127053.db2.gz IOGRPSCRPZBSQM-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO Cc1[nH+]ccn1CCCOc1cc(Cl)c(Cl)cc1[N+](=O)[O-] ZINC000794729581 1137242131 /nfs/dbraw/zinc/24/21/31/1137242131.db2.gz FVERNNCJQCLSEE-UHFFFAOYSA-N 1 1 330.171 3.876 20 5 EHBDMO CCCCN1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866250203 1137339135 /nfs/dbraw/zinc/33/91/35/1137339135.db2.gz WIGLTAGFASOXMK-AWEZNQCLSA-N 1 1 337.439 3.519 20 5 EHBDMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)c1 ZINC000846979770 1137381914 /nfs/dbraw/zinc/38/19/14/1137381914.db2.gz QQXVZXLDBLFXKX-CYBMUJFWSA-N 1 1 331.803 3.941 20 5 EHBDMO CC[C@H](CO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348191076 1137452234 /nfs/dbraw/zinc/45/22/34/1137452234.db2.gz FQQJHAGJRKCQES-MRXNPFEDSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348191076 1137452236 /nfs/dbraw/zinc/45/22/36/1137452236.db2.gz FQQJHAGJRKCQES-MRXNPFEDSA-N 1 1 332.375 3.507 20 5 EHBDMO C[C@H](NC[C@H](c1cccs1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017574 1137564709 /nfs/dbraw/zinc/56/47/09/1137564709.db2.gz CJEZCOYSCCEICF-SMDDNHRTSA-N 1 1 337.420 3.749 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017151 1137564775 /nfs/dbraw/zinc/56/47/75/1137564775.db2.gz VICBPCHWKXBGFU-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023195 1137565396 /nfs/dbraw/zinc/56/53/96/1137565396.db2.gz CZRCRVJCVPEKQF-KGLIPLIRSA-N 1 1 337.489 3.699 20 5 EHBDMO COCc1cc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1F ZINC000872037370 1137566758 /nfs/dbraw/zinc/56/67/58/1137566758.db2.gz DZEJAFKTNSAWNB-LLVKDONJSA-N 1 1 336.338 3.870 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC[C@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000872108084 1137571418 /nfs/dbraw/zinc/57/14/18/1137571418.db2.gz WEDFCUAVOLSBKP-MAUKXSAKSA-N 1 1 340.427 3.754 20 5 EHBDMO Cc1csc([C@@H]2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872736433 1137583477 /nfs/dbraw/zinc/58/34/77/1137583477.db2.gz AGJCAYYVIXYHIY-GFCCVEGCSA-N 1 1 340.408 3.902 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054896 1137700850 /nfs/dbraw/zinc/70/08/50/1137700850.db2.gz NAHCIYHOLCLRLE-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878114434 1137702882 /nfs/dbraw/zinc/70/28/82/1137702882.db2.gz XHQVBZPJCIPHBR-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC3(C2)CCCCC3)o1 ZINC000878133950 1137703730 /nfs/dbraw/zinc/70/37/30/1137703730.db2.gz DTGWCZSLANJCBI-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO CCC(C)(C)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878245748 1137708561 /nfs/dbraw/zinc/70/85/61/1137708561.db2.gz FZXQLYGCBUYVNU-UHFFFAOYSA-N 1 1 338.795 3.919 20 5 EHBDMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000881822060 1137816025 /nfs/dbraw/zinc/81/60/25/1137816025.db2.gz XFOJMSOFLSASFF-LZWOXQAQSA-N 1 1 345.443 3.639 20 5 EHBDMO CCC[C@@H](C)CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000883257588 1137850830 /nfs/dbraw/zinc/85/08/30/1137850830.db2.gz GDLJUUALKIRHIV-RHSMWYFYSA-N 1 1 330.432 3.834 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC(C)(C)C1 ZINC000112702265 1137909539 /nfs/dbraw/zinc/90/95/39/1137909539.db2.gz UPAWDMAJTXLQFP-LBPRGKRZSA-N 1 1 330.388 3.828 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432289 1137930210 /nfs/dbraw/zinc/93/02/10/1137930210.db2.gz GGIQPPGTYDMNQX-OAHLLOKOSA-N 1 1 330.388 3.655 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208716 1137935673 /nfs/dbraw/zinc/93/56/73/1137935673.db2.gz FRHQGQKCWPCWQJ-GOSISDBHSA-N 1 1 336.432 3.773 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCOC1 ZINC000119740316 1137944234 /nfs/dbraw/zinc/94/42/34/1137944234.db2.gz RSLBQMHZIVOLNM-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000885973468 1138029482 /nfs/dbraw/zinc/02/94/82/1138029482.db2.gz SXRSJVMZDUQPHW-SJLPKXTDSA-N 1 1 341.411 3.590 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)s1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136891885 1138044094 /nfs/dbraw/zinc/04/40/94/1138044094.db2.gz LSQYWOWBFJVGMB-CQSZACIVSA-N 1 1 340.832 3.865 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCc3cccnc32)cc(C(F)(F)F)c1 ZINC000886601526 1138100760 /nfs/dbraw/zinc/10/07/60/1138100760.db2.gz VQNSCPZRWHQBCO-CQSZACIVSA-N 1 1 337.301 3.786 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000085635949 1138184983 /nfs/dbraw/zinc/18/49/83/1138184983.db2.gz NNLOHHJBPYDXRP-HNNXBMFYSA-N 1 1 348.447 3.550 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093337696 1138236133 /nfs/dbraw/zinc/23/61/33/1138236133.db2.gz YRTVZLRVGDYSCL-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000336970638 1138438125 /nfs/dbraw/zinc/43/81/25/1138438125.db2.gz OPXYFUMUXOSQLC-QGZVFWFLSA-N 1 1 339.395 3.761 20 5 EHBDMO CC(=O)Nc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153256094 1139129040 /nfs/dbraw/zinc/12/90/40/1139129040.db2.gz SNABMKLRCWSPNW-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CC(=O)Nc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153256094 1139129041 /nfs/dbraw/zinc/12/90/41/1139129041.db2.gz SNABMKLRCWSPNW-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153474229 1139137408 /nfs/dbraw/zinc/13/74/08/1139137408.db2.gz MIRDSBQOXOONMX-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(c2nccs2)CC1 ZINC000182693073 1139986764 /nfs/dbraw/zinc/98/67/64/1139986764.db2.gz DLINWJOSWTVKKN-AWEZNQCLSA-N 1 1 346.456 3.633 20 5 EHBDMO Cc1nc(C[C@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744534 1139989581 /nfs/dbraw/zinc/98/95/81/1139989581.db2.gz BWLNLPPWYBNUAD-DZGCQCFKSA-N 1 1 344.415 3.610 20 5 EHBDMO C[C@H]1C[C@@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000193466586 1140577224 /nfs/dbraw/zinc/57/72/24/1140577224.db2.gz QSFUNHPZOXRQHC-YOEHRIQHSA-N 1 1 340.427 3.642 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC000266525335 1140698799 /nfs/dbraw/zinc/69/87/99/1140698799.db2.gz KBMJQFSNWBOPGW-ZDUSSCGKSA-N 1 1 334.416 3.710 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891853 1141280859 /nfs/dbraw/zinc/28/08/59/1141280859.db2.gz PGJQAJVQSXMVLO-OCCSQVGLSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891853 1141280864 /nfs/dbraw/zinc/28/08/64/1141280864.db2.gz PGJQAJVQSXMVLO-OCCSQVGLSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891853 1141280868 /nfs/dbraw/zinc/28/08/68/1141280868.db2.gz PGJQAJVQSXMVLO-OCCSQVGLSA-N 1 1 341.415 3.531 20 5 EHBDMO Cc1[nH+]ccn1CCSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000271002209 1141292684 /nfs/dbraw/zinc/29/26/84/1141292684.db2.gz HLJSURHEEYXCBF-UHFFFAOYSA-N 1 1 344.396 3.688 20 5 EHBDMO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271653304 1141413536 /nfs/dbraw/zinc/41/35/36/1141413536.db2.gz VSGIGBZFIWJUKT-KGLIPLIRSA-N 1 1 327.384 3.581 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575521 1141521046 /nfs/dbraw/zinc/52/10/46/1141521046.db2.gz VOGCUFNGAHPJMZ-JQWIXIFHSA-N 1 1 344.358 3.825 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCOc1ccccc1 ZINC000430193494 1014758227 /nfs/dbraw/zinc/75/82/27/1014758227.db2.gz GJKHORGFDUMNFI-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000430204539 1014895348 /nfs/dbraw/zinc/89/53/48/1014895348.db2.gz ROEGBBYGOODGJC-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000430211021 1014996161 /nfs/dbraw/zinc/99/61/61/1014996161.db2.gz HBTGIRMAZWROQH-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1ccccc1 ZINC000430216007 1015043935 /nfs/dbraw/zinc/04/39/35/1015043935.db2.gz DRGINQHRIWZJGD-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1ccccc1 ZINC000430216007 1015043950 /nfs/dbraw/zinc/04/39/50/1015043950.db2.gz DRGINQHRIWZJGD-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO COc1cc(C)nc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000339841115 1015737503 /nfs/dbraw/zinc/73/75/03/1015737503.db2.gz KDXUAIBSPADUTJ-UHFFFAOYSA-N 1 1 329.400 3.717 20 5 EHBDMO COc1cc(C)nc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000339841115 1015737510 /nfs/dbraw/zinc/73/75/10/1015737510.db2.gz KDXUAIBSPADUTJ-UHFFFAOYSA-N 1 1 329.400 3.717 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)ccc2Br)cc1 ZINC000037995984 1016316528 /nfs/dbraw/zinc/31/65/28/1016316528.db2.gz OWHLWAIZBATZLF-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032801284 1016605243 /nfs/dbraw/zinc/60/52/43/1016605243.db2.gz VSOQYFKMUAAMKV-VXGBXAGGSA-N 1 1 347.802 3.926 20 5 EHBDMO CCC[N@@H+](CC(C)C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC001167256270 1016786066 /nfs/dbraw/zinc/78/60/66/1016786066.db2.gz UTBAJTVJUIFGCI-LBPRGKRZSA-N 1 1 341.839 3.943 20 5 EHBDMO C[C@@H]1C[C@H](O)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414527023 1016954000 /nfs/dbraw/zinc/95/40/00/1016954000.db2.gz QDYTWONPHIAEPQ-DOMZBBRYSA-N 1 1 332.425 3.526 20 5 EHBDMO CC(C)Oc1ccccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000278755777 1032379297 /nfs/dbraw/zinc/37/92/97/1032379297.db2.gz SOZFROZWVXJEHX-UHFFFAOYSA-N 1 1 340.383 3.548 20 5 EHBDMO C[C@@H]1CCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000761234301 1032609730 /nfs/dbraw/zinc/60/97/30/1032609730.db2.gz KVNVPTVIVFDGBW-CQSZACIVSA-N 1 1 326.400 3.553 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000449494102 1032659373 /nfs/dbraw/zinc/65/93/73/1032659373.db2.gz GFXIFHWQHFFRBN-GUYCJALGSA-N 1 1 330.384 3.712 20 5 EHBDMO CCc1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449497660 1032667031 /nfs/dbraw/zinc/66/70/31/1032667031.db2.gz IXXNZFDQZFXQIH-AWEZNQCLSA-N 1 1 331.441 3.993 20 5 EHBDMO CCc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449497660 1032667040 /nfs/dbraw/zinc/66/70/40/1032667040.db2.gz IXXNZFDQZFXQIH-AWEZNQCLSA-N 1 1 331.441 3.993 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnn4ccccc34)C2)cc1 ZINC000449501190 1032681764 /nfs/dbraw/zinc/68/17/64/1032681764.db2.gz PGAWOHGJYQDMGZ-MRXNPFEDSA-N 1 1 336.395 3.622 20 5 EHBDMO C[C@@H]1CCN(c2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610284396 1017685589 /nfs/dbraw/zinc/68/55/89/1017685589.db2.gz YCRPVESVRYBZPC-CQSZACIVSA-N 1 1 331.441 3.757 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075194 1018999302 /nfs/dbraw/zinc/99/93/02/1018999302.db2.gz XGALUINHRBIZIA-BXUZGUMPSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433518 1019126557 /nfs/dbraw/zinc/12/65/57/1019126557.db2.gz PJCFFHQZCSWPFS-OXQOHEQNSA-N 1 1 339.439 3.862 20 5 EHBDMO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439046 1032844355 /nfs/dbraw/zinc/84/43/55/1032844355.db2.gz YTLRXHSYSYLSJH-GHMZBOCLSA-N 1 1 337.807 3.724 20 5 EHBDMO Cc1csc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182657639 1019732894 /nfs/dbraw/zinc/73/28/94/1019732894.db2.gz RKPDDRWJPPTQAY-AWEZNQCLSA-N 1 1 346.456 3.551 20 5 EHBDMO Cc1cc(NC(=O)[C@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC001266630956 1019736380 /nfs/dbraw/zinc/73/63/80/1019736380.db2.gz HPJCKXPMWRVRQP-INIZCTEOSA-N 1 1 347.802 3.798 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+](C[C@H]1CCOC1)C1CC1 ZINC000602439514 1032888538 /nfs/dbraw/zinc/88/85/38/1032888538.db2.gz HJAZHRCYOYJJIN-LLVKDONJSA-N 1 1 344.333 3.615 20 5 EHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732768 1020295226 /nfs/dbraw/zinc/29/52/26/1020295226.db2.gz MLFOGKKNULEIAK-MRXNPFEDSA-N 1 1 334.416 3.862 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169794 1020499409 /nfs/dbraw/zinc/49/94/09/1020499409.db2.gz MGICBUAQHOGBFX-DYVFJYSZSA-N 1 1 328.416 3.515 20 5 EHBDMO CC[N@@H+](C)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000126318019 1020571266 /nfs/dbraw/zinc/57/12/66/1020571266.db2.gz VWJNIAWBRMLAEL-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488555 1032918560 /nfs/dbraw/zinc/91/85/60/1032918560.db2.gz ZHKFHFQPDXPOKO-NWDGAFQWSA-N 1 1 336.823 3.606 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413089405 1020665251 /nfs/dbraw/zinc/66/52/51/1020665251.db2.gz BISQKMVJRSZSLM-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000360870463 1020846019 /nfs/dbraw/zinc/84/60/19/1020846019.db2.gz ILZWXTJIFMIPQM-RDJZCZTQSA-N 1 1 340.427 3.763 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCCCn1cccn1)C1CC1 ZINC000135219440 1020903694 /nfs/dbraw/zinc/90/36/94/1020903694.db2.gz SURYNDPLLKFCQT-UHFFFAOYSA-N 1 1 328.416 3.626 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3cc4c(s3)CCCC4)nc2c1 ZINC000602526889 1032962536 /nfs/dbraw/zinc/96/25/36/1032962536.db2.gz HPNLZMOZVAYOCX-UHFFFAOYSA-N 1 1 343.408 3.966 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000439255050 1021301164 /nfs/dbraw/zinc/30/11/64/1021301164.db2.gz FSBDQVXNNDQMTN-IBGZPJMESA-N 1 1 328.412 3.758 20 5 EHBDMO CCC1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000506180297 1022405695 /nfs/dbraw/zinc/40/56/95/1022405695.db2.gz UAUOBXAVHHEUTA-UHFFFAOYSA-N 1 1 334.416 3.862 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936042 1022472253 /nfs/dbraw/zinc/47/22/53/1022472253.db2.gz VDSZQKCASXEWDV-RDJZCZTQSA-N 1 1 326.396 3.852 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000602683536 1033083169 /nfs/dbraw/zinc/08/31/69/1033083169.db2.gz CUHSZNJHPLOGEY-CQSZACIVSA-N 1 1 346.349 3.861 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000058933016 1033085824 /nfs/dbraw/zinc/08/58/24/1033085824.db2.gz ONAJWPBSGHYVJG-GOSISDBHSA-N 1 1 330.359 3.950 20 5 EHBDMO COc1cc(C[NH+]2CCC(C)(F)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000602742642 1033108270 /nfs/dbraw/zinc/10/82/70/1033108270.db2.gz MCNQETQQIDDNBG-UHFFFAOYSA-N 1 1 348.321 3.529 20 5 EHBDMO CN(C)c1ccccc1C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000507166847 1023158851 /nfs/dbraw/zinc/15/88/51/1023158851.db2.gz FVJDVSCCUYYONS-UHFFFAOYSA-N 1 1 325.412 3.825 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000507166847 1023158858 /nfs/dbraw/zinc/15/88/58/1023158858.db2.gz FVJDVSCCUYYONS-UHFFFAOYSA-N 1 1 325.412 3.825 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441489004 1023209091 /nfs/dbraw/zinc/20/90/91/1023209091.db2.gz INDGGQUCWCADKQ-ZIAGYGMSSA-N 1 1 336.432 3.881 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2COC)CC1 ZINC000178386042 1023224398 /nfs/dbraw/zinc/22/43/98/1023224398.db2.gz NKBXEOSRGGSDOO-UHFFFAOYSA-N 1 1 349.475 3.690 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000341807626 1023354281 /nfs/dbraw/zinc/35/42/81/1023354281.db2.gz KESQCHOXCXWSDU-SNVBAGLBSA-N 1 1 332.347 3.681 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1OC(C)C ZINC000610800059 1023693532 /nfs/dbraw/zinc/69/35/32/1023693532.db2.gz QXPVJOLSECWULG-CQSZACIVSA-N 1 1 329.400 3.936 20 5 EHBDMO CCS[C@H]1CCCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000548509032 1023994932 /nfs/dbraw/zinc/99/49/32/1023994932.db2.gz BIEUXNPIHIEZHC-ZDUSSCGKSA-N 1 1 334.445 3.579 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000548509032 1023994950 /nfs/dbraw/zinc/99/49/50/1023994950.db2.gz BIEUXNPIHIEZHC-ZDUSSCGKSA-N 1 1 334.445 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H](CC4CC4)C3)o2)c1 ZINC000550422501 1024195770 /nfs/dbraw/zinc/19/57/70/1024195770.db2.gz LYFWELVGRCCSSF-OAHLLOKOSA-N 1 1 341.411 3.914 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@H](c2ccccc2F)C(C)C)c1[N+](=O)[O-] ZINC000895346569 1024346783 /nfs/dbraw/zinc/34/67/83/1024346783.db2.gz JDKGCTAEYLKSFE-INIZCTEOSA-N 1 1 348.374 3.935 20 5 EHBDMO COCC[N@@H+](C)CC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000505582721 1024536838 /nfs/dbraw/zinc/53/68/38/1024536838.db2.gz VNMSJVXCUCVPEO-QGZVFWFLSA-N 1 1 343.427 3.716 20 5 EHBDMO C[C@@H](c1ccc(F)cc1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000071952347 1024917217 /nfs/dbraw/zinc/91/72/17/1024917217.db2.gz WMNMPTCRUXAHSB-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccccc2)n1 ZINC000511060738 1025109989 /nfs/dbraw/zinc/10/99/89/1025109989.db2.gz VLRTVNYKWRTDNV-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccccc2)n1 ZINC000511060738 1025109995 /nfs/dbraw/zinc/10/99/95/1025109995.db2.gz VLRTVNYKWRTDNV-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000602953874 1033276143 /nfs/dbraw/zinc/27/61/43/1033276143.db2.gz DQIWRCFVWWJUOS-UHFFFAOYSA-N 1 1 335.404 3.645 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)o1 ZINC000551826590 1025475080 /nfs/dbraw/zinc/47/50/80/1025475080.db2.gz NTAARYCJMYRPON-IEBWSBKVSA-N 1 1 342.395 3.998 20 5 EHBDMO Cc1cnccc1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582178742 1025524009 /nfs/dbraw/zinc/52/40/09/1025524009.db2.gz QPYHKUXFIZJWCI-SFHVURJKSA-N 1 1 325.412 3.720 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478213 1025659364 /nfs/dbraw/zinc/65/93/64/1025659364.db2.gz HEEKVOKEPUDIPW-TZMCWYRMSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000451355444 1025861630 /nfs/dbraw/zinc/86/16/30/1025861630.db2.gz VCNMCLQGFCRNPC-NUJGCVRESA-N 1 1 348.443 3.509 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)Cc2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000451381155 1025881394 /nfs/dbraw/zinc/88/13/94/1025881394.db2.gz ZKGRFKICJOXFRP-UHFFFAOYSA-N 1 1 349.818 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCc3ccncc3)C2)cc1 ZINC000451554170 1026107644 /nfs/dbraw/zinc/10/76/44/1026107644.db2.gz ZLMWIOHUZWTCRB-GOSISDBHSA-N 1 1 325.412 3.802 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000530627686 1026153819 /nfs/dbraw/zinc/15/38/19/1026153819.db2.gz SPVLQULKQZSTTE-IBGZPJMESA-N 1 1 328.412 3.674 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCCC[C@@H]1C ZINC000339002300 1026333112 /nfs/dbraw/zinc/33/31/12/1026333112.db2.gz KQMWYBSRTFEJKY-UONOGXRCSA-N 1 1 328.416 3.818 20 5 EHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000451973682 1026430118 /nfs/dbraw/zinc/43/01/18/1026430118.db2.gz XPULYPDFMMWVPD-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000531379276 1026845793 /nfs/dbraw/zinc/84/57/93/1026845793.db2.gz ZOHWILYIOYCHLE-LJQANCHMSA-N 1 1 325.412 3.696 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](Cc4nccs4)C3)c2c1 ZINC000897279633 1026879376 /nfs/dbraw/zinc/87/93/76/1026879376.db2.gz VHRHPPFKRODIBR-LBPRGKRZSA-N 1 1 340.408 3.669 20 5 EHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)C2)cc1OC ZINC001167602807 1027009301 /nfs/dbraw/zinc/00/93/01/1027009301.db2.gz QFMDWKXLGQLWAC-KGLIPLIRSA-N 1 1 336.432 3.870 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)ccc1Cl ZINC000186444504 1027048845 /nfs/dbraw/zinc/04/88/45/1027048845.db2.gz BCQMWZKRKSRZTK-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)ccc1Cl ZINC000186444504 1027048851 /nfs/dbraw/zinc/04/88/51/1027048851.db2.gz BCQMWZKRKSRZTK-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000543907459 1027291127 /nfs/dbraw/zinc/29/11/27/1027291127.db2.gz PVBSDAWFUDAVAI-ZVZYQTTQSA-N 1 1 345.443 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c(F)c1 ZINC000612174291 1027911011 /nfs/dbraw/zinc/91/10/11/1027911011.db2.gz DCJGAVSHHSJBHM-MRXNPFEDSA-N 1 1 334.322 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c(F)c1 ZINC000612174291 1027911031 /nfs/dbraw/zinc/91/10/31/1027911031.db2.gz DCJGAVSHHSJBHM-MRXNPFEDSA-N 1 1 334.322 3.526 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C ZINC000444677652 1028147080 /nfs/dbraw/zinc/14/70/80/1028147080.db2.gz QAQYSSVWMJBBAW-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)n[nH]1 ZINC000518838462 1028243779 /nfs/dbraw/zinc/24/37/79/1028243779.db2.gz VCTPJMIMOQZGMJ-UHFFFAOYSA-N 1 1 336.395 3.659 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000347376206 1028804196 /nfs/dbraw/zinc/80/41/96/1028804196.db2.gz ZXLMWYKYWMGKIP-DNXIFWLFSA-N 1 1 326.400 3.601 20 5 EHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288261 1029581039 /nfs/dbraw/zinc/58/10/39/1029581039.db2.gz WUFPQVPSYZPABD-OCCSQVGLSA-N 1 1 333.432 3.741 20 5 EHBDMO C[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000525268990 1029777249 /nfs/dbraw/zinc/77/72/49/1029777249.db2.gz CABIVGVJMHDWAW-QGZVFWFLSA-N 1 1 339.439 3.691 20 5 EHBDMO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000601268204 1029875842 /nfs/dbraw/zinc/87/58/42/1029875842.db2.gz MPAIOMGTMXBXIP-HNNXBMFYSA-N 1 1 328.368 3.607 20 5 EHBDMO CC(C)(CO)[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000429711050 1029961232 /nfs/dbraw/zinc/96/12/32/1029961232.db2.gz DDHNGYWKOKPRHA-QGZVFWFLSA-N 1 1 332.375 3.583 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccs1 ZINC000441249809 1030132320 /nfs/dbraw/zinc/13/23/20/1030132320.db2.gz PEBLJRJWVVTFKZ-UHFFFAOYSA-N 1 1 336.413 3.566 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000159410876 1030179480 /nfs/dbraw/zinc/17/94/80/1030179480.db2.gz NDNRVXJOIFWZPT-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509103 1030258219 /nfs/dbraw/zinc/25/82/19/1030258219.db2.gz LUISUPNLAKOLBL-HNAYVOBHSA-N 1 1 331.460 3.826 20 5 EHBDMO CC[C@]1(C(C)C)C[C@H]1[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453441179 1030260171 /nfs/dbraw/zinc/26/01/71/1030260171.db2.gz MVOJNVOGVFRGOT-ZIFCJYIRSA-N 1 1 342.443 3.832 20 5 EHBDMO Cc1ccc2[nH]c(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000447560893 1030303095 /nfs/dbraw/zinc/30/30/95/1030303095.db2.gz GBYGCPGPOJUDHR-INIZCTEOSA-N 1 1 336.395 3.947 20 5 EHBDMO Cc1ccc2nc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000447560893 1030303109 /nfs/dbraw/zinc/30/31/09/1030303109.db2.gz GBYGCPGPOJUDHR-INIZCTEOSA-N 1 1 336.395 3.947 20 5 EHBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cc(C2CC2)cc[nH+]1 ZINC000520463282 1030576596 /nfs/dbraw/zinc/57/65/96/1030576596.db2.gz ZUKFLAGLJNNELG-LBPRGKRZSA-N 1 1 340.383 3.696 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483104657 1030961301 /nfs/dbraw/zinc/96/13/01/1030961301.db2.gz WFNIHZOTBLRRRZ-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000537843494 1031956260 /nfs/dbraw/zinc/95/62/60/1031956260.db2.gz SGBYYWZISBPRDG-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000537843494 1031956277 /nfs/dbraw/zinc/95/62/77/1031956277.db2.gz SGBYYWZISBPRDG-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000593602624 1033415750 /nfs/dbraw/zinc/41/57/50/1033415750.db2.gz WSLBAIPGLVWRFS-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594603455 1033448228 /nfs/dbraw/zinc/44/82/28/1033448228.db2.gz VJSZVSRQCIOUKG-NVXWUHKLSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cccc(OC3CC3)c2F)cc1[N+](=O)[O-] ZINC000594916747 1033544296 /nfs/dbraw/zinc/54/42/96/1033544296.db2.gz BQUYLLHWWJAKPU-UHFFFAOYSA-N 1 1 346.358 3.574 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1COc2ccc(C)cc21 ZINC000595022884 1033616382 /nfs/dbraw/zinc/61/63/82/1033616382.db2.gz QDWJLKHZQJMGCF-LRDDRELGSA-N 1 1 328.368 3.696 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c(F)c1 ZINC000595026287 1033623492 /nfs/dbraw/zinc/62/34/92/1033623492.db2.gz KGDQDFCIVINHKR-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COCc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)ccc1F ZINC000595008007 1033631210 /nfs/dbraw/zinc/63/12/10/1033631210.db2.gz MRGNJPLPZREXFN-GFCCVEGCSA-N 1 1 348.374 3.740 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC2(CC1)C(F)(F)C2(F)F ZINC000593659617 1033635303 /nfs/dbraw/zinc/63/53/03/1033635303.db2.gz WYKRJOHEBFZSPG-HYXAFXHYSA-N 1 1 344.308 3.974 20 5 EHBDMO CC[C@H]([NH2+]Cc1c(OC)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000595073148 1033655060 /nfs/dbraw/zinc/65/50/60/1033655060.db2.gz MSJLVXZGVVQDAM-INIZCTEOSA-N 1 1 330.384 3.853 20 5 EHBDMO COc1ccc(C[N@H+](Cc2onc(C)c2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000595295823 1033720831 /nfs/dbraw/zinc/72/08/31/1033720831.db2.gz SZJIXHYTQOSFLJ-ZDUSSCGKSA-N 1 1 345.399 3.701 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000595295823 1033720845 /nfs/dbraw/zinc/72/08/45/1033720845.db2.gz SZJIXHYTQOSFLJ-ZDUSSCGKSA-N 1 1 345.399 3.701 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552526 1033859273 /nfs/dbraw/zinc/85/92/73/1033859273.db2.gz MKHKUVMUYIXOSW-KRWDZBQOSA-N 1 1 333.363 3.628 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748158 1033979086 /nfs/dbraw/zinc/97/90/86/1033979086.db2.gz QDVUYDDMEIMJJK-HHXXYDBFSA-N 1 1 340.423 3.754 20 5 EHBDMO Cc1c([C@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094862 1034080076 /nfs/dbraw/zinc/08/00/76/1034080076.db2.gz NQWOMVHQIHTQEW-RDJZCZTQSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1c([C@H](C)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094862 1034080128 /nfs/dbraw/zinc/08/01/28/1034080128.db2.gz NQWOMVHQIHTQEW-RDJZCZTQSA-N 1 1 331.460 3.676 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689557 1034096180 /nfs/dbraw/zinc/09/61/80/1034096180.db2.gz JOCPQUGCCDNBNV-JZIMQPMSSA-N 1 1 331.416 3.520 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689557 1034096191 /nfs/dbraw/zinc/09/61/91/1034096191.db2.gz JOCPQUGCCDNBNV-JZIMQPMSSA-N 1 1 331.416 3.520 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000596168108 1034116594 /nfs/dbraw/zinc/11/65/94/1034116594.db2.gz KREUFOZHKROQKL-SMDDNHRTSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000596596800 1034311560 /nfs/dbraw/zinc/31/15/60/1034311560.db2.gz FYHNXRIRSBHVBR-ZDUSSCGKSA-N 1 1 328.416 3.772 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000604427980 1034376153 /nfs/dbraw/zinc/37/61/53/1034376153.db2.gz MVWJWWGIEUPJTK-KRWDZBQOSA-N 1 1 342.395 3.645 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435879 1034379329 /nfs/dbraw/zinc/37/93/29/1034379329.db2.gz CJFQXNNXBGLRGE-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000534337071 1034433110 /nfs/dbraw/zinc/43/31/10/1034433110.db2.gz VRDMHWPQXVGSRW-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO C[C@@H](c1cccs1)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411172609 1034799612 /nfs/dbraw/zinc/79/96/12/1034799612.db2.gz MOAFNVXGEYGAGI-LBPRGKRZSA-N 1 1 333.413 3.678 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425153 1034847995 /nfs/dbraw/zinc/84/79/95/1034847995.db2.gz FQUKDQQPUXBILH-UXLLHSPISA-N 1 1 347.459 3.673 20 5 EHBDMO COc1ccc(OCCC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935523 1034997114 /nfs/dbraw/zinc/99/71/14/1034997114.db2.gz NNBOBZKRNSWBHZ-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cn1 ZINC000612586744 1035080800 /nfs/dbraw/zinc/08/08/00/1035080800.db2.gz KAGHPSCUTPDHHQ-UHFFFAOYSA-N 1 1 329.400 3.754 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cn1 ZINC000612586744 1035080809 /nfs/dbraw/zinc/08/08/09/1035080809.db2.gz KAGHPSCUTPDHHQ-UHFFFAOYSA-N 1 1 329.400 3.754 20 5 EHBDMO C[C@@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2F)c1)[NH+]1CCOCC1 ZINC000511374570 1035207182 /nfs/dbraw/zinc/20/71/82/1035207182.db2.gz AVEVTXIBOSLSPU-ZDUSSCGKSA-N 1 1 345.374 3.871 20 5 EHBDMO C[C@H](c1cccc(Nc2ccccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000511452447 1035458712 /nfs/dbraw/zinc/45/87/12/1035458712.db2.gz BMZLOYPVZRPMDX-CQSZACIVSA-N 1 1 327.384 3.732 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@@H](c2ccccc2F)[C@H](C)O)cccc1[N+](=O)[O-] ZINC000581196326 1035478967 /nfs/dbraw/zinc/47/89/67/1035478967.db2.gz RTXLGSUNXNJKQH-ZJNRKIDTSA-N 1 1 332.375 3.815 20 5 EHBDMO CC(C)[N@@H+](C)CCCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581256256 1035482363 /nfs/dbraw/zinc/48/23/63/1035482363.db2.gz YDWCWHVAHRQZPV-CQSZACIVSA-N 1 1 333.354 3.518 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000075864701 1035568566 /nfs/dbraw/zinc/56/85/66/1035568566.db2.gz WJHHZNSPTXQYAA-MRXNPFEDSA-N 1 1 344.386 3.773 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000457106742 1035744474 /nfs/dbraw/zinc/74/44/74/1035744474.db2.gz DOPNOKPWUPVVMU-KRWDZBQOSA-N 1 1 347.462 3.943 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c(C)c1OC ZINC000588216073 1035824263 /nfs/dbraw/zinc/82/42/63/1035824263.db2.gz HJZJXQWQXYTIIR-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492481426 1035852017 /nfs/dbraw/zinc/85/20/17/1035852017.db2.gz DJOQSEGVIIEMLU-MRXNPFEDSA-N 1 1 329.400 3.669 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492481426 1035852041 /nfs/dbraw/zinc/85/20/41/1035852041.db2.gz DJOQSEGVIIEMLU-MRXNPFEDSA-N 1 1 329.400 3.669 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@@H]1CCCCO1 ZINC000492531541 1035933364 /nfs/dbraw/zinc/93/33/64/1035933364.db2.gz FZLVYITZVFEUIC-INIZCTEOSA-N 1 1 336.432 3.775 20 5 EHBDMO CCOc1cc(CN2CCC(C[NH+](CC)CC)CC2)ccc1[N+](=O)[O-] ZINC000492554619 1035996381 /nfs/dbraw/zinc/99/63/81/1035996381.db2.gz ADFQOKRICNHUOZ-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000572305415 1036061986 /nfs/dbraw/zinc/06/19/86/1036061986.db2.gz JNLOHCBCUHOTJV-SFHVURJKSA-N 1 1 330.359 3.674 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@](F)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000572305415 1036062007 /nfs/dbraw/zinc/06/20/07/1036062007.db2.gz JNLOHCBCUHOTJV-SFHVURJKSA-N 1 1 330.359 3.674 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113837 1036258219 /nfs/dbraw/zinc/25/82/19/1036258219.db2.gz ZOXJYGLTYCGZAP-RISCZKNCSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000492781985 1036286237 /nfs/dbraw/zinc/28/62/37/1036286237.db2.gz FKQURVNNTUZFHK-APWZRJJASA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@H](Cc2ccccc2)C1 ZINC000492781985 1036286256 /nfs/dbraw/zinc/28/62/56/1036286256.db2.gz FKQURVNNTUZFHK-APWZRJJASA-N 1 1 340.423 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000589300212 1036330505 /nfs/dbraw/zinc/33/05/05/1036330505.db2.gz DZPLUVRBFZUSFE-BMGDILEWSA-N 1 1 330.428 3.998 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000589494488 1036437305 /nfs/dbraw/zinc/43/73/05/1036437305.db2.gz QZASANKMNITPDT-SFHVURJKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000589494488 1036437318 /nfs/dbraw/zinc/43/73/18/1036437318.db2.gz QZASANKMNITPDT-SFHVURJKSA-N 1 1 340.379 3.501 20 5 EHBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825987 1036509327 /nfs/dbraw/zinc/50/93/27/1036509327.db2.gz IPDGKFFJYCSDMZ-KDOFPFPSSA-N 1 1 334.416 3.567 20 5 EHBDMO CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000590161712 1036779167 /nfs/dbraw/zinc/77/91/67/1036779167.db2.gz OECAHYIKJWGCGR-UHFFFAOYSA-N 1 1 332.322 3.615 20 5 EHBDMO CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000590161712 1036779186 /nfs/dbraw/zinc/77/91/86/1036779186.db2.gz OECAHYIKJWGCGR-UHFFFAOYSA-N 1 1 332.322 3.615 20 5 EHBDMO COC[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590175601 1036800611 /nfs/dbraw/zinc/80/06/11/1036800611.db2.gz WVNIMZSIBHPFMF-GFCCVEGCSA-N 1 1 346.349 3.862 20 5 EHBDMO C[N@@H+](CCc1cccs1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089906438 1036938788 /nfs/dbraw/zinc/93/87/88/1036938788.db2.gz CZRWVWRMIDOXAP-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO CC(C)(CNCc1ccc([N+](=O)[O-])c(Cl)c1)[NH+]1CCCCC1 ZINC000761515144 1037092674 /nfs/dbraw/zinc/09/26/74/1037092674.db2.gz IEWOVVNDVAYNIM-UHFFFAOYSA-N 1 1 325.840 3.602 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493250055 1037196795 /nfs/dbraw/zinc/19/67/95/1037196795.db2.gz CSYSSPXVCHKLGQ-INIZCTEOSA-N 1 1 348.834 3.936 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493250055 1037196808 /nfs/dbraw/zinc/19/68/08/1037196808.db2.gz CSYSSPXVCHKLGQ-INIZCTEOSA-N 1 1 348.834 3.936 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2OC)cc1[N+](=O)[O-] ZINC000188779271 1037244971 /nfs/dbraw/zinc/24/49/71/1037244971.db2.gz DIRKXTDRARJQON-OLZOCXBDSA-N 1 1 345.399 3.809 20 5 EHBDMO Cc1cnn([C@H]2CCC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000493357199 1037271334 /nfs/dbraw/zinc/27/13/34/1037271334.db2.gz GCXUENYFAFTINP-ZDUSSCGKSA-N 1 1 334.807 3.590 20 5 EHBDMO Cc1cnn([C@H]2CCC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000493357199 1037271349 /nfs/dbraw/zinc/27/13/49/1037271349.db2.gz GCXUENYFAFTINP-ZDUSSCGKSA-N 1 1 334.807 3.590 20 5 EHBDMO CN(Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110238 1037326134 /nfs/dbraw/zinc/32/61/34/1037326134.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 1 1 339.439 3.549 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053805 1037531125 /nfs/dbraw/zinc/53/11/25/1037531125.db2.gz FQUKDQQPUXBILH-YQQAZPJKSA-N 1 1 347.459 3.673 20 5 EHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000494036828 1037789492 /nfs/dbraw/zinc/78/94/92/1037789492.db2.gz HCZOLUXXEJIRLE-UHFFFAOYSA-N 1 1 325.368 3.587 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCC(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592131041 1037844487 /nfs/dbraw/zinc/84/44/87/1037844487.db2.gz RIMZARAUNFQSDB-HDJSIYSDSA-N 1 1 346.349 3.653 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000103473181 1037902981 /nfs/dbraw/zinc/90/29/81/1037902981.db2.gz PDUJOGCCHRRNHR-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000185213374 1039046317 /nfs/dbraw/zinc/04/63/17/1039046317.db2.gz FZPWEUUMVVWUIN-UHFFFAOYSA-N 1 1 335.448 3.552 20 5 EHBDMO CCC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000552300178 1039169901 /nfs/dbraw/zinc/16/99/01/1039169901.db2.gz ZKWIKHOYMONOID-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000552300178 1039169909 /nfs/dbraw/zinc/16/99/09/1039169909.db2.gz ZKWIKHOYMONOID-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574442 1039265090 /nfs/dbraw/zinc/26/50/90/1039265090.db2.gz YGFBWZCWWISFPM-MRXNPFEDSA-N 1 1 344.386 3.807 20 5 EHBDMO Cc1cccc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)c1[N+](=O)[O-] ZINC000500787647 1039497238 /nfs/dbraw/zinc/49/72/38/1039497238.db2.gz NTSGUZHOXAZSHW-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO OC1CCN(CCC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000238158787 1039501472 /nfs/dbraw/zinc/50/14/72/1039501472.db2.gz LMMYHTZDRAKGKT-UHFFFAOYSA-N 1 1 348.490 3.929 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1SC ZINC000554834979 1039809756 /nfs/dbraw/zinc/80/97/56/1039809756.db2.gz OPEACWLQLVVKOG-UHFFFAOYSA-N 1 1 346.452 4.000 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490014983 1040308747 /nfs/dbraw/zinc/30/87/47/1040308747.db2.gz RVVIVBWBBQUZCD-QGZVFWFLSA-N 1 1 326.396 3.668 20 5 EHBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355743 1040767979 /nfs/dbraw/zinc/76/79/79/1040767979.db2.gz WCDDTPNNRMXCRJ-WOJBJXKFSA-N 1 1 345.446 3.745 20 5 EHBDMO COC(=O)[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509797031 1040837342 /nfs/dbraw/zinc/83/73/42/1040837342.db2.gz AWQSZADUVQETRQ-LBPRGKRZSA-N 1 1 348.424 3.564 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507302 1041395189 /nfs/dbraw/zinc/39/51/89/1041395189.db2.gz BDSDDNUMFNHJTO-SNVBAGLBSA-N 1 1 329.322 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000511837983 1041685006 /nfs/dbraw/zinc/68/50/06/1041685006.db2.gz KUCYAYKTDJCAOP-SMDDNHRTSA-N 1 1 326.343 3.961 20 5 EHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111312367 1042260929 /nfs/dbraw/zinc/26/09/29/1042260929.db2.gz IVMKGCAFDLAYOZ-MRXNPFEDSA-N 1 1 331.441 3.912 20 5 EHBDMO CC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(OC)cc1 ZINC000181821002 1042409707 /nfs/dbraw/zinc/40/97/07/1042409707.db2.gz FLGHBRKJBTXKGT-OAHLLOKOSA-N 1 1 341.367 3.986 20 5 EHBDMO Cc1[nH+]c(N)ccc1CNc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001167786456 1042478240 /nfs/dbraw/zinc/47/82/40/1042478240.db2.gz RHBNFKDASZDXSS-UHFFFAOYSA-N 1 1 326.278 3.511 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000159202660 1042692783 /nfs/dbraw/zinc/69/27/83/1042692783.db2.gz UMAPCNHVMFSEPW-UHFFFAOYSA-N 1 1 349.456 3.903 20 5 EHBDMO COC(=O)c1coc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000278908052 1042905541 /nfs/dbraw/zinc/90/55/41/1042905541.db2.gz ZWSASJXXRYYQLJ-NEPJUHHUSA-N 1 1 332.356 3.695 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432327147 1042908391 /nfs/dbraw/zinc/90/83/91/1042908391.db2.gz FNHZWIWNBDOPJJ-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000569481323 1043005036 /nfs/dbraw/zinc/00/50/36/1043005036.db2.gz CWDUFETWSRFAOS-INIZCTEOSA-N 1 1 341.411 3.767 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@H](CCO)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279223033 1043599135 /nfs/dbraw/zinc/59/91/35/1043599135.db2.gz ZEPJFHIEHOPZCD-HZPDHXFCSA-N 1 1 330.384 3.624 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@@H](c4ccccc4)C3)c2)cc1 ZINC000728899651 1043716077 /nfs/dbraw/zinc/71/60/77/1043716077.db2.gz KJHDMFZDWITBAS-GOSISDBHSA-N 1 1 348.406 3.905 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H]3C3CCC3)c2)cc1 ZINC000728900957 1043854244 /nfs/dbraw/zinc/85/42/44/1043854244.db2.gz YREVQRCTAYXKDK-GOSISDBHSA-N 1 1 326.400 3.680 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1OC ZINC000060773973 1043893549 /nfs/dbraw/zinc/89/35/49/1043893549.db2.gz VBGJVLUOZWBLRJ-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncs1 ZINC000279583277 1044253291 /nfs/dbraw/zinc/25/32/91/1044253291.db2.gz USYADRKXHGLDOY-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO CO[C@H](C)c1nc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])cs1 ZINC000344716512 1044345199 /nfs/dbraw/zinc/34/51/99/1044345199.db2.gz SBIDBBPHNJHEMY-SMYYYNMVSA-N 1 1 333.413 3.562 20 5 EHBDMO C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000301554966 1128497124 /nfs/dbraw/zinc/49/71/24/1128497124.db2.gz ICXPBAWNVXSAHO-ONGXEEELSA-N 1 1 329.322 3.651 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Cl)cc2n1C ZINC000091372561 1128654050 /nfs/dbraw/zinc/65/40/50/1128654050.db2.gz VYGRDWYRSYUXEJ-LLVKDONJSA-N 1 1 344.802 3.986 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000301647352 1128839108 /nfs/dbraw/zinc/83/91/08/1128839108.db2.gz IHUVHKJOSYHKSK-PBHICJAKSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988978 1128917062 /nfs/dbraw/zinc/91/70/62/1128917062.db2.gz WEDXLGORCGBLBB-ZIAGYGMSSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988978 1128917063 /nfs/dbraw/zinc/91/70/63/1128917063.db2.gz WEDXLGORCGBLBB-ZIAGYGMSSA-N 1 1 345.374 3.733 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494700707 1120725170 /nfs/dbraw/zinc/72/51/70/1120725170.db2.gz DBXAERLZHZPGOG-GOSISDBHSA-N 1 1 348.443 3.773 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000494700707 1120725174 /nfs/dbraw/zinc/72/51/74/1120725174.db2.gz DBXAERLZHZPGOG-GOSISDBHSA-N 1 1 348.443 3.773 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C(F)(F)F)s1 ZINC000428846173 1128957606 /nfs/dbraw/zinc/95/76/06/1128957606.db2.gz BBKBCHLDNCKLCD-UHFFFAOYSA-N 1 1 346.330 3.974 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000915212086 1121248809 /nfs/dbraw/zinc/24/88/09/1121248809.db2.gz WUCOZMWPKWMARR-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO CCCCCC[N@H+](C)Cc1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000762319585 1121252342 /nfs/dbraw/zinc/25/23/42/1121252342.db2.gz KRNJKOCQAUKJKW-UHFFFAOYSA-N 1 1 346.431 3.889 20 5 EHBDMO CCCCCC[N@@H+](C)Cc1nc(Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000762319585 1121252349 /nfs/dbraw/zinc/25/23/49/1121252349.db2.gz KRNJKOCQAUKJKW-UHFFFAOYSA-N 1 1 346.431 3.889 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@H]12 ZINC000915209645 1121253059 /nfs/dbraw/zinc/25/30/59/1121253059.db2.gz LXKJZHXWDJDXRQ-XYPHTWIQSA-N 1 1 328.416 3.803 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724053 1128994303 /nfs/dbraw/zinc/99/43/03/1128994303.db2.gz OOUGQRCVZABZGV-AAEUAGOBSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000113323409 1129001655 /nfs/dbraw/zinc/00/16/55/1129001655.db2.gz XQHHRYWYFNIJIQ-UHFFFAOYSA-N 1 1 340.408 3.712 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c(C)cccc2[N+](=O)[O-])C1 ZINC000194676707 1122838107 /nfs/dbraw/zinc/83/81/07/1122838107.db2.gz RNEZYQLAUCUERC-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO C[C@@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136478 1123167222 /nfs/dbraw/zinc/16/72/22/1123167222.db2.gz IWCAWLSRKOURNS-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136478 1123167228 /nfs/dbraw/zinc/16/72/28/1123167228.db2.gz IWCAWLSRKOURNS-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136478 1123167231 /nfs/dbraw/zinc/16/72/31/1123167231.db2.gz IWCAWLSRKOURNS-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccccc1F ZINC000064350040 1123574462 /nfs/dbraw/zinc/57/44/62/1123574462.db2.gz ULCAZPCTBDPLJK-GOSISDBHSA-N 1 1 332.375 3.678 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672478 1123636431 /nfs/dbraw/zinc/63/64/31/1123636431.db2.gz CGFYWZZDTLYOOJ-RDJZCZTQSA-N 1 1 326.396 3.852 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000609672673 1123641719 /nfs/dbraw/zinc/64/17/19/1123641719.db2.gz WAOXMCXHAVGYLV-ZBFHGGJFSA-N 1 1 326.396 3.981 20 5 EHBDMO C[C@@H](CCN(C)C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237551863 1123750308 /nfs/dbraw/zinc/75/03/08/1123750308.db2.gz JZKGWBQGDUNAEK-ZDUSSCGKSA-N 1 1 333.457 3.753 20 5 EHBDMO C[C@@H](CC[NH+](C)C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237551863 1123750312 /nfs/dbraw/zinc/75/03/12/1123750312.db2.gz JZKGWBQGDUNAEK-ZDUSSCGKSA-N 1 1 333.457 3.753 20 5 EHBDMO Cc1ccccc1C[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007845489 1123836174 /nfs/dbraw/zinc/83/61/74/1123836174.db2.gz VFWNIOHBADLWEV-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007845489 1123836180 /nfs/dbraw/zinc/83/61/80/1123836180.db2.gz VFWNIOHBADLWEV-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000615835120 1123884503 /nfs/dbraw/zinc/88/45/03/1123884503.db2.gz PURRORKVIFRPAP-MDNBWPLSSA-N 1 1 340.427 3.741 20 5 EHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550629 1125106298 /nfs/dbraw/zinc/10/62/98/1125106298.db2.gz LPNFHXVSOTUMAN-QGZVFWFLSA-N 1 1 333.388 3.517 20 5 EHBDMO CC(C)Oc1ncccc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618565250 1125114035 /nfs/dbraw/zinc/11/40/35/1125114035.db2.gz KUGGFGCFJIGUQM-SFHVURJKSA-N 1 1 341.411 3.944 20 5 EHBDMO Cn1nc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c2ccccc21 ZINC000618575516 1125121626 /nfs/dbraw/zinc/12/16/26/1125121626.db2.gz KOBFOHPFPBGZJH-KRWDZBQOSA-N 1 1 336.395 3.649 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccc(F)c(F)c1 ZINC000618680019 1125162135 /nfs/dbraw/zinc/16/21/35/1125162135.db2.gz CJZZBOHWFQFQBW-WFASDCNBSA-N 1 1 339.367 3.792 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccc(F)c(F)c1 ZINC000618680019 1125162138 /nfs/dbraw/zinc/16/21/38/1125162138.db2.gz CJZZBOHWFQFQBW-WFASDCNBSA-N 1 1 339.367 3.792 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569436 1125363918 /nfs/dbraw/zinc/36/39/18/1125363918.db2.gz CKBYRUPCGACMKL-FCLVOEFKSA-N 1 1 332.444 3.746 20 5 EHBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845872 1129189239 /nfs/dbraw/zinc/18/92/39/1129189239.db2.gz TXXGTEDYCCIEBF-IEBWSBKVSA-N 1 1 339.395 3.655 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851863 1129216517 /nfs/dbraw/zinc/21/65/17/1129216517.db2.gz IFPUYHOMJJFCKJ-BEFAXECRSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000301907123 1129316821 /nfs/dbraw/zinc/31/68/21/1129316821.db2.gz NTGFNXQPFFTBEI-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000301907123 1129316826 /nfs/dbraw/zinc/31/68/26/1129316826.db2.gz NTGFNXQPFFTBEI-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)c1ccco1 ZINC000069070384 1129420650 /nfs/dbraw/zinc/42/06/50/1129420650.db2.gz LRCPGGBATQZETI-CYBMUJFWSA-N 1 1 331.372 3.518 20 5 EHBDMO Cc1cccn2c(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cnc12 ZINC000154263116 1129544473 /nfs/dbraw/zinc/54/44/73/1129544473.db2.gz DJPVDDPQHFHSQJ-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1cccn2c(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cnc12 ZINC000154263116 1129544476 /nfs/dbraw/zinc/54/44/76/1129544476.db2.gz DJPVDDPQHFHSQJ-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO CCc1nn(C)c(CC)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154275139 1129545638 /nfs/dbraw/zinc/54/56/38/1129545638.db2.gz NEUXWTSABZYMMF-UHFFFAOYSA-N 1 1 342.443 3.618 20 5 EHBDMO CCc1nn(C)c(CC)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154275139 1129545639 /nfs/dbraw/zinc/54/56/39/1129545639.db2.gz NEUXWTSABZYMMF-UHFFFAOYSA-N 1 1 342.443 3.618 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CCOCC1 ZINC000093284640 1129582759 /nfs/dbraw/zinc/58/27/59/1129582759.db2.gz FIZBUIZHSOGPIA-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1c[nH]nc1-c1ccccc1)CC2 ZINC000093338267 1129584334 /nfs/dbraw/zinc/58/43/34/1129584334.db2.gz WRGAAOXJOVHBHK-UHFFFAOYSA-N 1 1 334.379 3.543 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1c[nH]nc1-c1ccccc1)CC2 ZINC000093338267 1129584337 /nfs/dbraw/zinc/58/43/37/1129584337.db2.gz WRGAAOXJOVHBHK-UHFFFAOYSA-N 1 1 334.379 3.543 20 5 EHBDMO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000922665831 1129619494 /nfs/dbraw/zinc/61/94/94/1129619494.db2.gz RXNYDDKVRZKVTN-GFCCVEGCSA-N 1 1 346.358 3.760 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])nc1 ZINC000390849047 1129638519 /nfs/dbraw/zinc/63/85/19/1129638519.db2.gz HVQFYKDTGNBKTI-QGZVFWFLSA-N 1 1 340.427 3.702 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280990 1129658846 /nfs/dbraw/zinc/65/88/46/1129658846.db2.gz UPNMSOQLMODUQD-GJZGRUSLSA-N 1 1 347.459 3.530 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCCCO)C3CC3)o2)cc1 ZINC000125687793 1129710476 /nfs/dbraw/zinc/71/04/76/1129710476.db2.gz FXBNYBDXQZCGCZ-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000392391473 1129712267 /nfs/dbraw/zinc/71/22/67/1129712267.db2.gz VBOZPBKQUYNEOX-NSHDSACASA-N 1 1 346.353 3.685 20 5 EHBDMO COc1cc(N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081759 1129767129 /nfs/dbraw/zinc/76/71/29/1129767129.db2.gz YATLHLGMSTZHQX-JKSUJKDBSA-N 1 1 347.459 3.694 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303532714 1129852854 /nfs/dbraw/zinc/85/28/54/1129852854.db2.gz GEDUDFAOOCLTPT-HNAYVOBHSA-N 1 1 343.427 3.744 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000543559400 1129973672 /nfs/dbraw/zinc/97/36/72/1129973672.db2.gz SDIRMULNCVVHAI-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO CC(C)CCC[C@@H](C)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429227938 1130090431 /nfs/dbraw/zinc/09/04/31/1130090431.db2.gz QQSVHUMRYWIPPS-OAHLLOKOSA-N 1 1 349.475 3.751 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001307590582 1130099951 /nfs/dbraw/zinc/09/99/51/1130099951.db2.gz WDZVJQAAZWTGDU-WDEREUQCSA-N 1 1 327.222 3.835 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000174035580 1130332075 /nfs/dbraw/zinc/33/20/75/1130332075.db2.gz VWUMAMSIEOMUAZ-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)c1ccccc1F ZINC000429248910 1130343623 /nfs/dbraw/zinc/34/36/23/1130343623.db2.gz PFMDBCHVMHBQAW-UHFFFAOYSA-N 1 1 345.374 3.506 20 5 EHBDMO COc1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000175131940 1130409021 /nfs/dbraw/zinc/40/90/21/1130409021.db2.gz ZBUGETZZPRJXGP-INIZCTEOSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000175131940 1130409024 /nfs/dbraw/zinc/40/90/24/1130409024.db2.gz ZBUGETZZPRJXGP-INIZCTEOSA-N 1 1 329.400 3.669 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892968 1130857449 /nfs/dbraw/zinc/85/74/49/1130857449.db2.gz LTSYSDOPIUKWIP-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892968 1130857458 /nfs/dbraw/zinc/85/74/58/1130857458.db2.gz LTSYSDOPIUKWIP-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209172 1130897855 /nfs/dbraw/zinc/89/78/55/1130897855.db2.gz JQVPMXOVOWKHQH-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209172 1130897862 /nfs/dbraw/zinc/89/78/62/1130897862.db2.gz JQVPMXOVOWKHQH-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO CN(CC[N@@H+](C)C1CCCCC1)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000732568010 1130936718 /nfs/dbraw/zinc/93/67/18/1130936718.db2.gz XXOWRQMJCQBHDV-UHFFFAOYSA-N 1 1 342.443 3.844 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905332 1131886055 /nfs/dbraw/zinc/88/60/55/1131886055.db2.gz RFKALELCSMBZLM-GOEBONIOSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3sccc3C1)CC2 ZINC001172905585 1131888186 /nfs/dbraw/zinc/88/81/86/1131888186.db2.gz SKLLJOKPGJYYOP-INIZCTEOSA-N 1 1 328.437 3.962 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@H+]2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910416 1131916370 /nfs/dbraw/zinc/91/63/70/1131916370.db2.gz ZFIDFAGNRXRWQF-APWZRJJASA-N 1 1 341.411 3.976 20 5 EHBDMO CO[C@H]1CCC[C@@H]2C[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910552 1131917615 /nfs/dbraw/zinc/91/76/15/1131917615.db2.gz LVERWRJPTAWPSX-UMGGQSCQSA-N 1 1 344.455 3.589 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1Cc3cnc(Cl)cc3C1)CC2 ZINC001172912786 1131917914 /nfs/dbraw/zinc/91/79/14/1131917914.db2.gz MHUCWHPRULWBNT-INIZCTEOSA-N 1 1 343.814 3.906 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H]3CCC[C@H]3C2)c1F ZINC001173178276 1131991947 /nfs/dbraw/zinc/99/19/47/1131991947.db2.gz ACFXDYLKKMQTEN-IHRRRGAJSA-N 1 1 336.407 3.796 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CCc2ccccc2)c1F ZINC001173184524 1131993482 /nfs/dbraw/zinc/99/34/82/1131993482.db2.gz NPXLCFKPNODJKY-AWEZNQCLSA-N 1 1 346.402 3.848 20 5 EHBDMO CCOC[C@@]12CCC[C@@H]1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173223756 1132005616 /nfs/dbraw/zinc/00/56/16/1132005616.db2.gz HIRYMDSRIUGPAP-SUMDDJOVSA-N 1 1 332.444 3.664 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173227217 1132006210 /nfs/dbraw/zinc/00/62/10/1132006210.db2.gz OKJKPBKIJVXAOS-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2ccc(F)cc2)C1 ZINC001173227263 1132007218 /nfs/dbraw/zinc/00/72/18/1132007218.db2.gz PAWLSDDAARZWTF-KUHUBIRLSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227931 1132007679 /nfs/dbraw/zinc/00/76/79/1132007679.db2.gz SPMVACWSVHGVDQ-OXJNMPFZSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001173227872 1132007866 /nfs/dbraw/zinc/00/78/66/1132007866.db2.gz SFKVVKZDQFDNCA-DNVCBOLYSA-N 1 1 326.396 3.599 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCC3(CCC3)CO2)C2CC2)cc1 ZINC001168860550 1132582460 /nfs/dbraw/zinc/58/24/60/1132582460.db2.gz YSHPWNXVTLLPTJ-SFHVURJKSA-N 1 1 330.428 3.909 20 5 EHBDMO CC(C)Oc1cccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])c1 ZINC001168884826 1132596594 /nfs/dbraw/zinc/59/65/94/1132596594.db2.gz GMPZKCRQYPZMPG-UHFFFAOYSA-N 1 1 344.411 3.893 20 5 EHBDMO CCC1(CC)C[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000767480647 1133009209 /nfs/dbraw/zinc/00/92/09/1133009209.db2.gz UYOGWNYVTRLFMR-UHFFFAOYSA-N 1 1 334.445 3.510 20 5 EHBDMO COc1cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000768197826 1133112901 /nfs/dbraw/zinc/11/29/01/1133112901.db2.gz XMKZDPBCYSYIIG-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000768197826 1133112905 /nfs/dbraw/zinc/11/29/05/1133112905.db2.gz XMKZDPBCYSYIIG-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO O=C1CC[C@@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769204911 1133244181 /nfs/dbraw/zinc/24/41/81/1133244181.db2.gz BGTUFCXCKIOOAP-GOSISDBHSA-N 1 1 330.431 3.800 20 5 EHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483385 1133289512 /nfs/dbraw/zinc/28/95/12/1133289512.db2.gz MNSYVIMCBYMZKI-LQOHYYORSA-N 1 1 340.423 3.972 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC001185097809 1134028259 /nfs/dbraw/zinc/02/82/59/1134028259.db2.gz DRHFDBUCSVYPNG-GFCCVEGCSA-N 1 1 349.460 3.666 20 5 EHBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120048 1134080639 /nfs/dbraw/zinc/08/06/39/1134080639.db2.gz PQAPPXSIVUFZQG-OCCSQVGLSA-N 1 1 346.408 3.593 20 5 EHBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788614603 1134151736 /nfs/dbraw/zinc/15/17/36/1134151736.db2.gz SWHALRKVKXFSRF-QWRGUYRKSA-N 1 1 333.363 3.737 20 5 EHBDMO Cc1c(C[NH2+][C@@H]2COCc3cccc(Cl)c32)cccc1[N+](=O)[O-] ZINC000788777309 1134173800 /nfs/dbraw/zinc/17/38/00/1134173800.db2.gz OYHOOYYYTHAKQO-OAHLLOKOSA-N 1 1 332.787 3.918 20 5 EHBDMO CC[C@H]1C[N@@H+](CC)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186440829 1134213208 /nfs/dbraw/zinc/21/32/08/1134213208.db2.gz GKBXHFFZYMOGNK-LBPRGKRZSA-N 1 1 331.338 3.534 20 5 EHBDMO Cc1[nH+]ccn1CCCC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000791438382 1134550304 /nfs/dbraw/zinc/55/03/04/1134550304.db2.gz AHLZFRWTYDQZSQ-UHFFFAOYSA-N 1 1 344.415 3.816 20 5 EHBDMO C[C@@H]1CCSCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000792195782 1134666704 /nfs/dbraw/zinc/66/67/04/1134666704.db2.gz FOYHWNRSCYQQAX-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000792195782 1134666709 /nfs/dbraw/zinc/66/67/09/1134666709.db2.gz FOYHWNRSCYQQAX-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335423 1134752409 /nfs/dbraw/zinc/75/24/09/1134752409.db2.gz NJLDVJRMBWOYMQ-FPMFFAJLSA-N 1 1 340.370 3.512 20 5 EHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000792877887 1134811399 /nfs/dbraw/zinc/81/13/99/1134811399.db2.gz WEILGBPMDJGFEE-UHFFFAOYSA-N 1 1 333.319 3.667 20 5 EHBDMO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])o1 ZINC001191258265 1134826971 /nfs/dbraw/zinc/82/69/71/1134826971.db2.gz LSCZMNCPGUKWSX-XJKSGUPXSA-N 1 1 346.431 3.728 20 5 EHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001191406898 1134860808 /nfs/dbraw/zinc/86/08/08/1134860808.db2.gz CKYJFZOJBHHPNK-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001191406897 1134861181 /nfs/dbraw/zinc/86/11/81/1134861181.db2.gz CKYJFZOJBHHPNK-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO C[C@@]1(CNc2ccc(N)cc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000804684316 1135168447 /nfs/dbraw/zinc/16/84/47/1135168447.db2.gz ZACZVWLSURGYDV-IBGZPJMESA-N 1 1 340.427 3.501 20 5 EHBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001194714598 1135311164 /nfs/dbraw/zinc/31/11/64/1135311164.db2.gz IWFYJJRIKUUNMX-RHSMWYFYSA-N 1 1 347.459 3.875 20 5 EHBDMO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233619 1135389450 /nfs/dbraw/zinc/38/94/50/1135389450.db2.gz KDHWGDORZBMWJR-HNNXBMFYSA-N 1 1 348.443 3.929 20 5 EHBDMO CCC1(CC)CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001197514989 1135697219 /nfs/dbraw/zinc/69/72/19/1135697219.db2.gz WIJOWHKJHHBEKC-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO CCC1(CC)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001197514989 1135697220 /nfs/dbraw/zinc/69/72/20/1135697220.db2.gz WIJOWHKJHHBEKC-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000811474566 1136096635 /nfs/dbraw/zinc/09/66/35/1136096635.db2.gz LVQMHQZRVZDYEH-QWHCGFSZSA-N 1 1 344.242 3.618 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274960 1136129203 /nfs/dbraw/zinc/12/92/03/1136129203.db2.gz DYSRNZCYUMMEPZ-YVEFUNNKSA-N 1 1 334.803 3.975 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280113 1136135172 /nfs/dbraw/zinc/13/51/72/1136135172.db2.gz ZVIKIQHRUIEEBB-RBUKOAKNSA-N 1 1 326.396 3.774 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583105 1136441974 /nfs/dbraw/zinc/44/19/74/1136441974.db2.gz WJNYXEAIAMOZGM-YJBOKZPZSA-N 1 1 346.814 3.771 20 5 EHBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585345 1136442209 /nfs/dbraw/zinc/44/22/09/1136442209.db2.gz WASMTHCBEOFIGG-SCLBCKFNSA-N 1 1 348.830 3.845 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@@H]2Cc2ccccc2)cc1 ZINC000776581261 1136444895 /nfs/dbraw/zinc/44/48/95/1136444895.db2.gz GEQAPSOUFLUXIZ-UXHICEINSA-N 1 1 340.423 3.725 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585597 1136448389 /nfs/dbraw/zinc/44/83/89/1136448389.db2.gz XLQDYMPCSRELSD-IUODEOHRSA-N 1 1 349.456 3.649 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000814909441 1136523719 /nfs/dbraw/zinc/52/37/19/1136523719.db2.gz LMNYJUWOWWITNQ-OAHLLOKOSA-N 1 1 343.349 3.536 20 5 EHBDMO C[C@H](OC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445440 1136596137 /nfs/dbraw/zinc/59/61/37/1136596137.db2.gz YSCJKCLJXBIIKR-KBXCAEBGSA-N 1 1 346.427 3.996 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nc1 ZINC000858012996 1136931085 /nfs/dbraw/zinc/93/10/85/1136931085.db2.gz OJMSCRKNSNIWJM-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)nc1 ZINC000858012996 1136931086 /nfs/dbraw/zinc/93/10/86/1136931086.db2.gz OJMSCRKNSNIWJM-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362091 1137215424 /nfs/dbraw/zinc/21/54/24/1137215424.db2.gz XSEZFLYHLCEVTM-KBXCAEBGSA-N 1 1 346.452 3.741 20 5 EHBDMO Cn1cc([C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2(C)C)cn1 ZINC000846929736 1137375892 /nfs/dbraw/zinc/37/58/92/1137375892.db2.gz YNANJUZRYFUKFU-HNNXBMFYSA-N 1 1 348.834 3.607 20 5 EHBDMO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+](C2CCC2)C1 ZINC000795118818 1137490309 /nfs/dbraw/zinc/49/03/09/1137490309.db2.gz AHRZXTBNURWROE-ZDUSSCGKSA-N 1 1 337.851 3.554 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171804857 1137513435 /nfs/dbraw/zinc/51/34/35/1137513435.db2.gz JMGFYLVOCLVSPE-GOEBONIOSA-N 1 1 345.443 3.824 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872020707 1137565102 /nfs/dbraw/zinc/56/51/02/1137565102.db2.gz KLRAFGWEQROKDB-WDEREUQCSA-N 1 1 332.331 3.874 20 5 EHBDMO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872078603 1137570190 /nfs/dbraw/zinc/57/01/90/1137570190.db2.gz RMAZQGBEFVLKSS-NEPJUHHUSA-N 1 1 334.445 3.945 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872275582 1137577180 /nfs/dbraw/zinc/57/71/80/1137577180.db2.gz HTXCNZVTDKQIDF-QGZVFWFLSA-N 1 1 334.416 3.527 20 5 EHBDMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000877835567 1137692886 /nfs/dbraw/zinc/69/28/86/1137692886.db2.gz UALYJWKLMSSAPP-CQSZACIVSA-N 1 1 346.452 3.916 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]2CCCC[C@H]21 ZINC000878398810 1137714262 /nfs/dbraw/zinc/71/42/62/1137714262.db2.gz DMVRHLXQHOMSCM-VNHYZAJKSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000880075641 1137767473 /nfs/dbraw/zinc/76/74/73/1137767473.db2.gz DSIIPYNTHOUHII-GFCCVEGCSA-N 1 1 332.404 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2c(F)cccc2F)C2CC2)cc1 ZINC000130709376 1137841198 /nfs/dbraw/zinc/84/11/98/1137841198.db2.gz FLZKMFJTCYMOJQ-KRWDZBQOSA-N 1 1 348.349 3.571 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC1(CC2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000883254124 1137850613 /nfs/dbraw/zinc/85/06/13/1137850613.db2.gz KQAFECQLTRAFSU-QGZVFWFLSA-N 1 1 340.427 3.588 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])c(C)o1 ZINC000883288014 1137852878 /nfs/dbraw/zinc/85/28/78/1137852878.db2.gz OJULGLPUHVVMGB-UHFFFAOYSA-N 1 1 339.189 3.857 20 5 EHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287539 1137900133 /nfs/dbraw/zinc/90/01/33/1137900133.db2.gz UUPQLSVEJGNSPO-SCZZXKLOSA-N 1 1 329.278 3.509 20 5 EHBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287539 1137900134 /nfs/dbraw/zinc/90/01/34/1137900134.db2.gz UUPQLSVEJGNSPO-SCZZXKLOSA-N 1 1 329.278 3.509 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000112990614 1137911127 /nfs/dbraw/zinc/91/11/27/1137911127.db2.gz IHTYXISFERVODF-OAHLLOKOSA-N 1 1 337.419 3.805 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)c1ccc(F)cc1F)C1CC1 ZINC000135234836 1137964710 /nfs/dbraw/zinc/96/47/10/1137964710.db2.gz YGKULXUPXZRHQF-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1ccc(F)cc1F)C1CC1 ZINC000135234836 1137964711 /nfs/dbraw/zinc/96/47/11/1137964711.db2.gz YGKULXUPXZRHQF-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1OC ZINC000886057847 1138036380 /nfs/dbraw/zinc/03/63/80/1138036380.db2.gz YZQOOGQBTSQTAE-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC[C@@H]1C[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000072862147 1138108568 /nfs/dbraw/zinc/10/85/68/1138108568.db2.gz ROWMOXKRFSTZEG-SMDDNHRTSA-N 1 1 348.428 3.533 20 5 EHBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000072862147 1138108570 /nfs/dbraw/zinc/10/85/70/1138108570.db2.gz ROWMOXKRFSTZEG-SMDDNHRTSA-N 1 1 348.428 3.533 20 5 EHBDMO CCOC[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093838650 1138241654 /nfs/dbraw/zinc/24/16/54/1138241654.db2.gz LPGNCMNLBWFXSX-CYBMUJFWSA-N 1 1 347.440 3.577 20 5 EHBDMO C[C@@H]([N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C)CC1 ZINC000177254080 1139607968 /nfs/dbraw/zinc/60/79/68/1139607968.db2.gz ZEIQNZJWYHELPT-CYBMUJFWSA-N 1 1 329.400 3.913 20 5 EHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184212049 1140087455 /nfs/dbraw/zinc/08/74/55/1140087455.db2.gz ISEQKVCMBONILZ-CQSZACIVSA-N 1 1 340.395 3.524 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(O)(c3ccccc3)CC2)ccc1Cl ZINC000185518925 1140154360 /nfs/dbraw/zinc/15/43/60/1140154360.db2.gz IBQJEVSMFUNKFA-UHFFFAOYSA-N 1 1 346.814 3.732 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2OC)cc1[N+](=O)[O-] ZINC000187592023 1140263788 /nfs/dbraw/zinc/26/37/88/1140263788.db2.gz IEJUONDEXVDMDR-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@H](C)C1 ZINC000187991362 1140279634 /nfs/dbraw/zinc/27/96/34/1140279634.db2.gz LJGJAQVSCLQIHB-STQMWFEESA-N 1 1 330.388 3.828 20 5 EHBDMO CCCn1ccnc1CCC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483096 1140466298 /nfs/dbraw/zinc/46/62/98/1140466298.db2.gz ZHUVLNUQVZBHRJ-OAHLLOKOSA-N 1 1 330.432 3.827 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000267441944 1140791946 /nfs/dbraw/zinc/79/19/46/1140791946.db2.gz IDZVVRPXWQOADD-GDBMZVCRSA-N 1 1 332.425 3.744 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633868 1141129638 /nfs/dbraw/zinc/12/96/38/1141129638.db2.gz GNBCBKDESGSINQ-IAGOWNOFSA-N 1 1 330.384 3.839 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CCO)c1ccccc1 ZINC000271623927 1141408096 /nfs/dbraw/zinc/40/80/96/1141408096.db2.gz DMHGFYPKKRNYCI-GOSISDBHSA-N 1 1 344.411 3.595 20 5 EHBDMO CCOc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430200188 1014866788 /nfs/dbraw/zinc/86/67/88/1014866788.db2.gz GJVKSKLYTYPVRA-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430200188 1014866799 /nfs/dbraw/zinc/86/67/99/1014866799.db2.gz GJVKSKLYTYPVRA-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000430207559 1014927393 /nfs/dbraw/zinc/92/73/93/1014927393.db2.gz MOTBYGKVJSUYGG-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000430207559 1014927400 /nfs/dbraw/zinc/92/74/00/1014927400.db2.gz MOTBYGKVJSUYGG-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000430211395 1014992030 /nfs/dbraw/zinc/99/20/30/1014992030.db2.gz IXSFNSREXVINNZ-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000129724329 1120150832 /nfs/dbraw/zinc/15/08/32/1120150832.db2.gz OTENNZRWTPXREB-MNOVXSKESA-N 1 1 327.222 3.835 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCOCC34CCCC4)o2)c1 ZINC000536709436 1032187743 /nfs/dbraw/zinc/18/77/43/1032187743.db2.gz BAMZELGYWBMTFR-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOCC34CCCC4)o2)c1 ZINC000536709436 1032187754 /nfs/dbraw/zinc/18/77/54/1032187754.db2.gz BAMZELGYWBMTFR-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459753414 1032447553 /nfs/dbraw/zinc/44/75/53/1032447553.db2.gz MBAJSWIJUAMVNB-BHMPTGKFSA-N 1 1 344.455 3.871 20 5 EHBDMO CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414716273 1017150694 /nfs/dbraw/zinc/15/06/94/1017150694.db2.gz NUZKJBJBJYWORT-INIZCTEOSA-N 1 1 343.427 3.819 20 5 EHBDMO [NH3+][C@@H]1CCC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930678 1017325540 /nfs/dbraw/zinc/32/55/40/1017325540.db2.gz TXVKHLAYCHGIDX-VXGBXAGGSA-N 1 1 349.818 3.868 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000468033653 1017510529 /nfs/dbraw/zinc/51/05/29/1017510529.db2.gz MWZGSFFKUXUJEX-NHYWBVRUSA-N 1 1 346.358 3.917 20 5 EHBDMO C[C@H](c1ccc(F)cc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866483 1018544204 /nfs/dbraw/zinc/54/42/04/1018544204.db2.gz AJWDMJSBDYDBJB-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1ccc(F)cc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866483 1018544213 /nfs/dbraw/zinc/54/42/13/1018544213.db2.gz AJWDMJSBDYDBJB-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580129034 1018685723 /nfs/dbraw/zinc/68/57/23/1018685723.db2.gz INKSPUQPYNGCRV-MRXNPFEDSA-N 1 1 332.400 3.694 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433519 1019126375 /nfs/dbraw/zinc/12/63/75/1019126375.db2.gz PJCFFHQZCSWPFS-UZLBHIALSA-N 1 1 339.439 3.862 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Br)cc2F)c1 ZINC000050166184 1019166341 /nfs/dbraw/zinc/16/63/41/1019166341.db2.gz QLQSQZDTXZEFRY-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO COc1ccc(OCC[N@@H+]([C@@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119133418 1019451723 /nfs/dbraw/zinc/45/17/23/1019451723.db2.gz QPZHTXTVZZUHAD-ZDUSSCGKSA-N 1 1 346.383 3.801 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000345146477 1020011065 /nfs/dbraw/zinc/01/10/65/1020011065.db2.gz PZTCHFBGWNERAR-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000157805687 1032869820 /nfs/dbraw/zinc/86/98/20/1032869820.db2.gz JPQYBCYHDZQECN-MRXNPFEDSA-N 1 1 326.396 3.901 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[C@H]1O ZINC000581158833 1020493452 /nfs/dbraw/zinc/49/34/52/1020493452.db2.gz ILFTVQNOHPQZMC-HZPDHXFCSA-N 1 1 332.425 3.669 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000511830619 1020789015 /nfs/dbraw/zinc/78/90/15/1020789015.db2.gz RCNZGEBNULTBFM-KBPBESRZSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000511830619 1020789021 /nfs/dbraw/zinc/78/90/21/1020789021.db2.gz RCNZGEBNULTBFM-KBPBESRZSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1nc2ccccn2c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507168490 1021661820 /nfs/dbraw/zinc/66/18/20/1021661820.db2.gz DCCGEUCHLUTAJD-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO CC(C)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438480982 1022703776 /nfs/dbraw/zinc/70/37/76/1022703776.db2.gz UDZWINBNJSCPSV-NWDGAFQWSA-N 1 1 339.823 3.553 20 5 EHBDMO CC(C)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438480982 1022703782 /nfs/dbraw/zinc/70/37/82/1022703782.db2.gz UDZWINBNJSCPSV-NWDGAFQWSA-N 1 1 339.823 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@]2(CO)CCCc3ccccc32)c(Cl)c1 ZINC000440467369 1022721147 /nfs/dbraw/zinc/72/11/47/1022721147.db2.gz RGVBDVUQYMFIAN-SFHVURJKSA-N 1 1 346.814 3.562 20 5 EHBDMO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])[nH]c1C(C)C ZINC000894370711 1023161301 /nfs/dbraw/zinc/16/13/01/1023161301.db2.gz OLEUGWBAQNACFM-LBPRGKRZSA-N 1 1 345.399 3.684 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507233862 1023207778 /nfs/dbraw/zinc/20/77/78/1023207778.db2.gz PPZXYOSDYYOSFS-KUHUBIRLSA-N 1 1 326.396 3.902 20 5 EHBDMO CCS[C@@H]1CCCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000548509031 1023996918 /nfs/dbraw/zinc/99/69/18/1023996918.db2.gz BIEUXNPIHIEZHC-CYBMUJFWSA-N 1 1 334.445 3.579 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000548509031 1023996936 /nfs/dbraw/zinc/99/69/36/1023996936.db2.gz BIEUXNPIHIEZHC-CYBMUJFWSA-N 1 1 334.445 3.579 20 5 EHBDMO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000602806482 1033180503 /nfs/dbraw/zinc/18/05/03/1033180503.db2.gz URAYESKHHKCVPB-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176398 1024200270 /nfs/dbraw/zinc/20/02/70/1024200270.db2.gz PBOYEFHPLSBSDC-RNCFNFMXSA-N 1 1 329.322 3.508 20 5 EHBDMO C[C@@H]([N@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1)C(C)(C)C ZINC000346037184 1024297296 /nfs/dbraw/zinc/29/72/96/1024297296.db2.gz XNVRQTTWEDRHOC-CQSZACIVSA-N 1 1 330.432 3.765 20 5 EHBDMO C[C@@H]([N@@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1)C(C)(C)C ZINC000346037184 1024297306 /nfs/dbraw/zinc/29/73/06/1024297306.db2.gz XNVRQTTWEDRHOC-CQSZACIVSA-N 1 1 330.432 3.765 20 5 EHBDMO CCc1ccc([C@@H](NCC[N@@H+](C)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544357427 1024339053 /nfs/dbraw/zinc/33/90/53/1024339053.db2.gz MLMZGAVJHKGAJE-IBGZPJMESA-N 1 1 345.443 3.769 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CCSc1ccc(F)cc1)C2 ZINC000550567883 1024401248 /nfs/dbraw/zinc/40/12/48/1024401248.db2.gz DDLMNEXUUGHAJT-UHFFFAOYSA-N 1 1 332.400 3.884 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCSc1ccc(F)cc1)C2 ZINC000550567883 1024401252 /nfs/dbraw/zinc/40/12/52/1024401252.db2.gz DDLMNEXUUGHAJT-UHFFFAOYSA-N 1 1 332.400 3.884 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](c4cccnc4)C3)nc2c1 ZINC000602857403 1033212412 /nfs/dbraw/zinc/21/24/12/1033212412.db2.gz VZHRRYOYPXWILR-AWEZNQCLSA-N 1 1 338.367 3.511 20 5 EHBDMO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000342243801 1024542722 /nfs/dbraw/zinc/54/27/22/1024542722.db2.gz OSHPHWCGZGLNJQ-HNNXBMFYSA-N 1 1 346.431 3.604 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844727 1033221402 /nfs/dbraw/zinc/22/14/02/1033221402.db2.gz FAPVENFJJXLWGD-MRXNPFEDSA-N 1 1 340.427 3.572 20 5 EHBDMO C[C@@H]([NH3+])[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372450 1024857401 /nfs/dbraw/zinc/85/74/01/1024857401.db2.gz RHEHSJHGXYMHCN-VXGBXAGGSA-N 1 1 349.818 3.677 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000895987379 1025044902 /nfs/dbraw/zinc/04/49/02/1025044902.db2.gz DHFXMBIVGFCFKY-UHFFFAOYSA-N 1 1 340.330 3.628 20 5 EHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000435771462 1025130799 /nfs/dbraw/zinc/13/07/99/1025130799.db2.gz VOHYUQIXEQIWJC-QGZVFWFLSA-N 1 1 346.431 3.513 20 5 EHBDMO COc1cc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000185479647 1025183206 /nfs/dbraw/zinc/18/32/06/1025183206.db2.gz LJENOLWDBIZPCJ-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1 ZINC000072058782 1025292799 /nfs/dbraw/zinc/29/27/99/1025292799.db2.gz ZDRBPTVWHIVLRF-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1 ZINC000072058782 1025292810 /nfs/dbraw/zinc/29/28/10/1025292810.db2.gz ZDRBPTVWHIVLRF-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551449755 1025322373 /nfs/dbraw/zinc/32/23/73/1025322373.db2.gz PEDLZNCOZGCGQP-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO C[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000521402551 1025371453 /nfs/dbraw/zinc/37/14/53/1025371453.db2.gz POBDRATUUDVHJT-ZDUSSCGKSA-N 1 1 329.375 3.593 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493849 1025496780 /nfs/dbraw/zinc/49/67/80/1025496780.db2.gz WOBMZGKROULLQA-JMPLCFMRSA-N 1 1 340.427 3.611 20 5 EHBDMO CC(C)c1ccc(C[NH2+]C[C@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000521821380 1025708129 /nfs/dbraw/zinc/70/81/29/1025708129.db2.gz OBKSBDAQOMJQEO-LJQANCHMSA-N 1 1 333.476 3.928 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](COc3ccccc3)C2)cc1 ZINC000505818686 1025718702 /nfs/dbraw/zinc/71/87/02/1025718702.db2.gz KDSWHZGGDOHJEX-QGZVFWFLSA-N 1 1 326.396 3.538 20 5 EHBDMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1ccccc1 ZINC000521859625 1025736669 /nfs/dbraw/zinc/73/66/69/1025736669.db2.gz KSDVQNJSEAQGRN-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1ccccc1 ZINC000521859625 1025736679 /nfs/dbraw/zinc/73/66/79/1025736679.db2.gz KSDVQNJSEAQGRN-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC4(C3)CCCCC4)n2)cc1 ZINC000130021883 1025779686 /nfs/dbraw/zinc/77/96/86/1025779686.db2.gz JYTDTJRZLKBINA-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO CCC[N@@H+](CC)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000516074595 1025955181 /nfs/dbraw/zinc/95/51/81/1025955181.db2.gz UADBDYRUEWRGAA-CQSZACIVSA-N 1 1 333.354 3.520 20 5 EHBDMO C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098362 /nfs/dbraw/zinc/09/83/62/1026098362.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 1 1 331.460 3.649 20 5 EHBDMO C[N@H+]1CCCC[C@@H]1CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098379 /nfs/dbraw/zinc/09/83/79/1026098379.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@@H]1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098397 /nfs/dbraw/zinc/09/83/97/1026098397.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@@H]1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098414 /nfs/dbraw/zinc/09/84/14/1026098414.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 1 1 331.460 3.649 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCSC[C@H]3C3CC3)co2)cc1 ZINC000451658546 1026212217 /nfs/dbraw/zinc/21/22/17/1026212217.db2.gz YHKXHZDDFWODIH-INIZCTEOSA-N 1 1 345.424 3.577 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCSC[C@H]3C3CC3)co2)cc1 ZINC000451658546 1026212227 /nfs/dbraw/zinc/21/22/27/1026212227.db2.gz YHKXHZDDFWODIH-INIZCTEOSA-N 1 1 345.424 3.577 20 5 EHBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475127549 1026221453 /nfs/dbraw/zinc/22/14/53/1026221453.db2.gz IXGDLWOALZFNEE-SFHVURJKSA-N 1 1 330.384 3.592 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]CC2=CCCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000562044677 1026268383 /nfs/dbraw/zinc/26/83/83/1026268383.db2.gz LXQIBNDXXIPEQA-IBGZPJMESA-N 1 1 342.395 3.776 20 5 EHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000531105061 1026572374 /nfs/dbraw/zinc/57/23/74/1026572374.db2.gz KUZVLGIOOKZOHT-MRXNPFEDSA-N 1 1 334.441 3.736 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC000531211145 1026690024 /nfs/dbraw/zinc/69/00/24/1026690024.db2.gz ZADSHXPRMDNMBS-FQEVSTJZSA-N 1 1 340.423 3.819 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676537 1027192622 /nfs/dbraw/zinc/19/26/22/1027192622.db2.gz AHCIWVCVONQCCL-HRCADAONSA-N 1 1 347.459 3.673 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000543907456 1027307458 /nfs/dbraw/zinc/30/74/58/1027307458.db2.gz PVBSDAWFUDAVAI-LESCRADOSA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127705035 1027347783 /nfs/dbraw/zinc/34/77/83/1027347783.db2.gz XSIABJYVBMFKRT-CZUORRHYSA-N 1 1 330.384 3.590 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCC(C)(C)CC1 ZINC000531781982 1027372400 /nfs/dbraw/zinc/37/24/00/1027372400.db2.gz FATXMAFVMVIFPF-UHFFFAOYSA-N 1 1 334.416 3.862 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000503576728 1027920846 /nfs/dbraw/zinc/92/08/46/1027920846.db2.gz HCAJYPKXDJXXOD-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648908 1028111491 /nfs/dbraw/zinc/11/14/91/1028111491.db2.gz OUZKRECSXAJAKA-CJNGLKHVSA-N 1 1 336.395 3.849 20 5 EHBDMO C[C@H](NC1CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423175434 1028245604 /nfs/dbraw/zinc/24/56/04/1028245604.db2.gz AJIUAFJTEWZBPD-LBPRGKRZSA-N 1 1 331.441 3.726 20 5 EHBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358471 1028309156 /nfs/dbraw/zinc/30/91/56/1028309156.db2.gz BZTHAJCRWQMSRS-KGLIPLIRSA-N 1 1 346.452 3.774 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC([NH3+])(CC)CC ZINC000423287905 1028326049 /nfs/dbraw/zinc/32/60/49/1028326049.db2.gz PEVHAWXOHCJRNT-ZDUSSCGKSA-N 1 1 325.478 3.573 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000016419057 1028436180 /nfs/dbraw/zinc/43/61/80/1028436180.db2.gz XMYKGZOUPYCNFJ-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000016419057 1028436193 /nfs/dbraw/zinc/43/61/93/1028436193.db2.gz XMYKGZOUPYCNFJ-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO CCc1ccccc1[C@@H]([NH3+])CN[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498600 1028464549 /nfs/dbraw/zinc/46/45/49/1028464549.db2.gz IHTHBDVDRFCBNK-KDOFPFPSSA-N 1 1 327.428 3.816 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](n3ncc4ccccc43)C2)cc1F ZINC000366969948 1028489621 /nfs/dbraw/zinc/48/96/21/1028489621.db2.gz OSFQMSUUZDBSBH-OAHLLOKOSA-N 1 1 340.358 3.531 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@]1(CO)CCCc2ccccc21 ZINC000440821164 1028998887 /nfs/dbraw/zinc/99/88/87/1028998887.db2.gz PUQUOJXRLDJOSB-SFHVURJKSA-N 1 1 346.814 3.562 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]CC2(N(C)C)CCCC2)cc1[N+](=O)[O-] ZINC000504899086 1029027863 /nfs/dbraw/zinc/02/78/63/1029027863.db2.gz AKCLYCXKCNELGQ-AWEZNQCLSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000532969076 1029116311 /nfs/dbraw/zinc/11/63/11/1029116311.db2.gz BWYPBOUOZIRMAH-IJLUTSLNSA-N 1 1 348.428 3.532 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446080043 1029392801 /nfs/dbraw/zinc/39/28/01/1029392801.db2.gz QXDZAGBTSXXJCU-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000525123971 1029696663 /nfs/dbraw/zinc/69/66/63/1029696663.db2.gz VHEMFJXDMGARTG-IFXJQAMLSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000525123971 1029696668 /nfs/dbraw/zinc/69/66/68/1029696668.db2.gz VHEMFJXDMGARTG-IFXJQAMLSA-N 1 1 344.386 3.738 20 5 EHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271803 1029768290 /nfs/dbraw/zinc/76/82/90/1029768290.db2.gz RUVNFWYNTYLZFP-LJQANCHMSA-N 1 1 325.412 3.998 20 5 EHBDMO CCCc1ncc(C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)o1 ZINC000453350547 1030141020 /nfs/dbraw/zinc/14/10/20/1030141020.db2.gz BQAANXOKFFRKOU-GFCCVEGCSA-N 1 1 333.388 3.785 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)n1 ZINC000481977713 1030143703 /nfs/dbraw/zinc/14/37/03/1030143703.db2.gz PGOWAPYKFRUVBK-MRXNPFEDSA-N 1 1 346.475 3.779 20 5 EHBDMO CN(C)C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574590 1030169823 /nfs/dbraw/zinc/16/98/23/1030169823.db2.gz DPBUGARPYHYUIA-QZTJIDSGSA-N 1 1 343.402 3.614 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000159411188 1030178361 /nfs/dbraw/zinc/17/83/61/1030178361.db2.gz NDNRVXJOIFWZPT-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000441268172 1030212421 /nfs/dbraw/zinc/21/24/21/1030212421.db2.gz YADADBSJLUBKHC-CYBMUJFWSA-N 1 1 348.374 3.814 20 5 EHBDMO C[C@@H](CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729481 1030441417 /nfs/dbraw/zinc/44/14/17/1030441417.db2.gz NWROGQFDYQHODM-DOTOQJQBSA-N 1 1 340.427 3.670 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000475744575 1031834974 /nfs/dbraw/zinc/83/49/74/1031834974.db2.gz RBVXSTGVJDEZRJ-BPLDGKMQSA-N 1 1 333.432 3.598 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000594497515 1033400122 /nfs/dbraw/zinc/40/01/22/1033400122.db2.gz CTYIGAYUEXHJTP-CABCVRRESA-N 1 1 330.771 3.959 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1OC(F)F ZINC000594597682 1033444559 /nfs/dbraw/zinc/44/45/59/1033444559.db2.gz DXMKCTXRFCIURB-CHWSQXEVSA-N 1 1 341.358 3.625 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)ccc2ncccc21 ZINC000594598790 1033445670 /nfs/dbraw/zinc/44/56/70/1033445670.db2.gz HYBMALIREUWTBL-NVXWUHKLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)ccc2ncccc21 ZINC000594598793 1033447049 /nfs/dbraw/zinc/44/70/49/1033447049.db2.gz HYBMALIREUWTBL-RDJZCZTQSA-N 1 1 326.400 3.572 20 5 EHBDMO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000595019111 1033611335 /nfs/dbraw/zinc/61/13/35/1033611335.db2.gz IGZMWIKDWWATEF-GUYCJALGSA-N 1 1 330.384 3.642 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595421724 1033796421 /nfs/dbraw/zinc/79/64/21/1033796421.db2.gz BVDJEILCOVHPJO-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000595467663 1033821897 /nfs/dbraw/zinc/82/18/97/1033821897.db2.gz SPTZADJTEBLXAR-JFIYKMOQSA-N 1 1 336.407 3.640 20 5 EHBDMO Cc1nc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)ncc1[N+](=O)[O-] ZINC000450223146 1033934248 /nfs/dbraw/zinc/93/42/48/1033934248.db2.gz JRHRHPGYKKAQBJ-UHFFFAOYSA-N 1 1 338.371 3.513 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115988 1033945711 /nfs/dbraw/zinc/94/57/11/1033945711.db2.gz KFOVTISVBVLTRF-HNNXBMFYSA-N 1 1 326.343 3.613 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593115988 1033945716 /nfs/dbraw/zinc/94/57/16/1033945716.db2.gz KFOVTISVBVLTRF-HNNXBMFYSA-N 1 1 326.343 3.613 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(Oc3cccc(F)c3)CC2)c1 ZINC000599505562 1033967383 /nfs/dbraw/zinc/96/73/83/1033967383.db2.gz RYQCZWYYFDHQNX-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976015 1033970676 /nfs/dbraw/zinc/97/06/76/1033970676.db2.gz KRQPAHPXSNRLEN-LIRRHRJNSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976015 1033970686 /nfs/dbraw/zinc/97/06/86/1033970686.db2.gz KRQPAHPXSNRLEN-LIRRHRJNSA-N 1 1 326.396 3.865 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CCCC2=O)CC1 ZINC000595804691 1033990181 /nfs/dbraw/zinc/99/01/81/1033990181.db2.gz CBTBNLRUNJHWAV-UHFFFAOYSA-N 1 1 346.427 3.717 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603869887 1033996131 /nfs/dbraw/zinc/99/61/31/1033996131.db2.gz WNQFCGNCVDQBHE-UHFFFAOYSA-N 1 1 344.411 3.683 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595787491 1033998896 /nfs/dbraw/zinc/99/88/96/1033998896.db2.gz JGGVRTRRNPPURH-SJKOYZFVSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595787491 1033998912 /nfs/dbraw/zinc/99/89/12/1033998912.db2.gz JGGVRTRRNPPURH-SJKOYZFVSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595787489 1033999992 /nfs/dbraw/zinc/99/99/92/1033999992.db2.gz JGGVRTRRNPPURH-PXAZEXFGSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c(F)c1 ZINC000595787489 1034000003 /nfs/dbraw/zinc/00/00/03/1034000003.db2.gz JGGVRTRRNPPURH-PXAZEXFGSA-N 1 1 340.370 3.654 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CC1(C)C ZINC000595909472 1034025227 /nfs/dbraw/zinc/02/52/27/1034025227.db2.gz OLRVGBRNXHMSRK-AAEUAGOBSA-N 1 1 330.388 3.684 20 5 EHBDMO Cc1noc(CS[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020527 1034060170 /nfs/dbraw/zinc/06/01/70/1034060170.db2.gz LFBZDOVVEUTLMM-OAHLLOKOSA-N 1 1 347.440 3.789 20 5 EHBDMO COc1cc(N[C@H]2CC[N@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336136 1034178931 /nfs/dbraw/zinc/17/89/31/1034178931.db2.gz NAYWQKQIFSODNZ-JTQLQIEISA-N 1 1 327.812 3.542 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000604435297 1034378140 /nfs/dbraw/zinc/37/81/40/1034378140.db2.gz CGCHEFXYVMOJKL-SFHVURJKSA-N 1 1 345.443 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)s1 ZINC000604472614 1034386567 /nfs/dbraw/zinc/38/65/67/1034386567.db2.gz GXGSJZBOIVCUJQ-OAHLLOKOSA-N 1 1 331.441 3.980 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CCOCC1 ZINC000534345543 1034418705 /nfs/dbraw/zinc/41/87/05/1034418705.db2.gz FWHRGNKVUJXLNZ-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)s1 ZINC000597231203 1034614257 /nfs/dbraw/zinc/61/42/57/1034614257.db2.gz OHBOIKSYPMEDCS-UONOGXRCSA-N 1 1 344.436 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000172257409 1034869159 /nfs/dbraw/zinc/86/91/59/1034869159.db2.gz GVBDBIZCTWNJOJ-IBGZPJMESA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000172257409 1034869171 /nfs/dbraw/zinc/86/91/71/1034869171.db2.gz GVBDBIZCTWNJOJ-IBGZPJMESA-N 1 1 344.386 3.606 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2cccs2)on1 ZINC000548934038 1034998590 /nfs/dbraw/zinc/99/85/90/1034998590.db2.gz NZQOFZBUGWRXMM-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2cccs2)on1 ZINC000548934038 1034998593 /nfs/dbraw/zinc/99/85/93/1034998593.db2.gz NZQOFZBUGWRXMM-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927680 1035077652 /nfs/dbraw/zinc/07/76/52/1035077652.db2.gz SQCFBAMUSNDDLZ-RDJZCZTQSA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927680 1035077658 /nfs/dbraw/zinc/07/76/58/1035077658.db2.gz SQCFBAMUSNDDLZ-RDJZCZTQSA-N 1 1 332.787 3.556 20 5 EHBDMO Cc1ccnc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338233 1035526664 /nfs/dbraw/zinc/52/66/64/1035526664.db2.gz LUXLRCNWWDHECX-BBRMVZONSA-N 1 1 346.456 3.855 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CCC[N@H+](C3CCCC3)CC2)ccc1Cl ZINC000178020695 1035532214 /nfs/dbraw/zinc/53/22/14/1035532214.db2.gz VVGPFLMZAKDPFL-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCN(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000511478036 1035544738 /nfs/dbraw/zinc/54/47/38/1035544738.db2.gz NFDWQWZJDLYMBM-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO CCOc1cc(C[N@H+](C)Cc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492376756 1035702177 /nfs/dbraw/zinc/70/21/77/1035702177.db2.gz NCKALAUDDPGWSK-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492376756 1035702196 /nfs/dbraw/zinc/70/21/96/1035702196.db2.gz NCKALAUDDPGWSK-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO COc1cc(C[NH+]2CCC(c3cccnc3)CC2)c([N+](=O)[O-])cc1F ZINC000613383096 1035720081 /nfs/dbraw/zinc/72/00/81/1035720081.db2.gz OECMZGRVHJULDV-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180152591 1035851338 /nfs/dbraw/zinc/85/13/38/1035851338.db2.gz CUJTXZVKEWATMC-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cc(C4CC4)no3)C2)cc1 ZINC000595527662 1035921458 /nfs/dbraw/zinc/92/14/58/1035921458.db2.gz WOQMFCSVBDBRIG-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000463956437 1035998097 /nfs/dbraw/zinc/99/80/97/1035998097.db2.gz ZWAJWHWSQANDCI-GASCZTMLSA-N 1 1 348.447 3.596 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492729410 1036219972 /nfs/dbraw/zinc/21/99/72/1036219972.db2.gz RZJOUGZHSMDSFA-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000589281440 1036340674 /nfs/dbraw/zinc/34/06/74/1036340674.db2.gz HFNRDCVUDKWDCV-DNVCBOLYSA-N 1 1 337.423 3.793 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026223578 1036394110 /nfs/dbraw/zinc/39/41/10/1036394110.db2.gz SROWMJDKJAUPPI-UHFFFAOYSA-N 1 1 341.411 3.618 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000589519800 1036487822 /nfs/dbraw/zinc/48/78/22/1036487822.db2.gz ANUWUELLRUGZPY-KYTCBBFDSA-N 1 1 346.818 3.795 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464778439 1036772919 /nfs/dbraw/zinc/77/29/19/1036772919.db2.gz QBOFURIBEFVLSQ-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO C[N@@H+](CCc1ccccc1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089886155 1036836609 /nfs/dbraw/zinc/83/66/09/1036836609.db2.gz PLCKDHOGIAIISC-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000152857528 1037000425 /nfs/dbraw/zinc/00/04/25/1037000425.db2.gz OXMLZPNPKKFNHV-HUUCEWRRSA-N 1 1 335.448 3.519 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000008339136 1037240801 /nfs/dbraw/zinc/24/08/01/1037240801.db2.gz CKIWPXGOPYOACI-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO CCc1[nH+]ccn1[C@@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310266 1037245930 /nfs/dbraw/zinc/24/59/30/1037245930.db2.gz JFXQREAJWQMPSS-CYBMUJFWSA-N 1 1 348.834 3.844 20 5 EHBDMO CC[C@]1(C)C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000443848597 1037787969 /nfs/dbraw/zinc/78/79/69/1037787969.db2.gz BAKHWBFSQHNUNP-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000443848597 1037787978 /nfs/dbraw/zinc/78/79/78/1037787978.db2.gz BAKHWBFSQHNUNP-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592181457 1037909370 /nfs/dbraw/zinc/90/93/70/1037909370.db2.gz DLFZCJVOKWRBFE-HNNXBMFYSA-N 1 1 348.443 3.773 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000784396701 1037919490 /nfs/dbraw/zinc/91/94/90/1037919490.db2.gz CSIBABXVHPNHCH-IBGZPJMESA-N 1 1 346.402 3.897 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc3n(n2)CCCC3)cc1[N+](=O)[O-] ZINC000592387715 1037953147 /nfs/dbraw/zinc/95/31/47/1037953147.db2.gz IRAZPHKINDWVAK-KGLIPLIRSA-N 1 1 328.416 3.848 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000538745613 1038511370 /nfs/dbraw/zinc/51/13/70/1038511370.db2.gz KFBXSKVIODDLME-GASCZTMLSA-N 1 1 347.459 3.513 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000554946535 1039967386 /nfs/dbraw/zinc/96/73/86/1039967386.db2.gz VJXBSBNBRKOKBW-LBPRGKRZSA-N 1 1 328.359 3.859 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000554946535 1039967404 /nfs/dbraw/zinc/96/74/04/1039967404.db2.gz VJXBSBNBRKOKBW-LBPRGKRZSA-N 1 1 328.359 3.859 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000027284839 1040158523 /nfs/dbraw/zinc/15/85/23/1040158523.db2.gz OIRKKXQVLBCPMW-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO CN(C)[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130763 1040364797 /nfs/dbraw/zinc/36/47/97/1040364797.db2.gz OJAKAUPAAHNFTQ-PMACEKPBSA-N 1 1 339.439 3.614 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc2cccnc2c([N+](=O)[O-])c1 ZINC001167752317 1040833679 /nfs/dbraw/zinc/83/36/79/1040833679.db2.gz DYDKKCOKJGHGPT-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000555584064 1040879863 /nfs/dbraw/zinc/87/98/63/1040879863.db2.gz ZGNNDZNUISQMIW-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@H]21 ZINC000555721020 1041042809 /nfs/dbraw/zinc/04/28/09/1041042809.db2.gz FJQLBDLEXLWSPX-CABCVRRESA-N 1 1 342.399 3.655 20 5 EHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874915 1041788454 /nfs/dbraw/zinc/78/84/54/1041788454.db2.gz MKILCEHEACYJLG-LBPRGKRZSA-N 1 1 335.429 3.740 20 5 EHBDMO C[C@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000093311403 1042184623 /nfs/dbraw/zinc/18/46/23/1042184623.db2.gz XNNNYXIPSXOZMQ-CQSZACIVSA-N 1 1 332.375 3.507 20 5 EHBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000093311403 1042184626 /nfs/dbraw/zinc/18/46/26/1042184626.db2.gz XNNNYXIPSXOZMQ-CQSZACIVSA-N 1 1 332.375 3.507 20 5 EHBDMO Cc1cc(C[C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000279114934 1043373516 /nfs/dbraw/zinc/37/35/16/1043373516.db2.gz PMSDKPHVTNPSSR-PIGZYNQJSA-N 1 1 328.416 3.570 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000183370869 1125544625 /nfs/dbraw/zinc/54/46/25/1125544625.db2.gz PUEUHYLRAIGBCX-GOSISDBHSA-N 1 1 340.423 3.942 20 5 EHBDMO Cc1nn(C[N@H+](C)C[C@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965542 1127559878 /nfs/dbraw/zinc/55/98/78/1127559878.db2.gz YBPJLEBKLLPBNC-AWEZNQCLSA-N 1 1 338.411 3.946 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068981 1127569955 /nfs/dbraw/zinc/56/99/55/1127569955.db2.gz UUHLSDBARMJYBS-IRXDYDNUSA-N 1 1 346.456 3.570 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])c1nccs1 ZINC000273134351 1128444200 /nfs/dbraw/zinc/44/42/00/1128444200.db2.gz UISXJBQKVMEFIA-JTQLQIEISA-N 1 1 325.821 3.940 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000301580677 1128499572 /nfs/dbraw/zinc/49/95/72/1128499572.db2.gz LERXKDZRKKMYGP-WFASDCNBSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000301580677 1128499575 /nfs/dbraw/zinc/49/95/75/1128499575.db2.gz LERXKDZRKKMYGP-WFASDCNBSA-N 1 1 345.424 3.820 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000301604783 1128516531 /nfs/dbraw/zinc/51/65/31/1128516531.db2.gz MBHKVWZMQVUBKR-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000554279120 1128636515 /nfs/dbraw/zinc/63/65/15/1128636515.db2.gz FELCITXMSFYHBP-HOTGVXAUSA-N 1 1 328.412 3.581 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(C)ccc1OC ZINC000172580836 1128651831 /nfs/dbraw/zinc/65/18/31/1128651831.db2.gz YOZVJAPGKLRMMP-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000109841421 1120126905 /nfs/dbraw/zinc/12/69/05/1120126905.db2.gz KBCYZTGSJDEXQM-OAHLLOKOSA-N 1 1 344.411 3.545 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000129724329 1120150830 /nfs/dbraw/zinc/15/08/30/1120150830.db2.gz OTENNZRWTPXREB-MNOVXSKESA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488974697 1128899567 /nfs/dbraw/zinc/89/95/67/1128899567.db2.gz IVNBWIURMNDNRF-CJNGLKHVSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488974697 1128899571 /nfs/dbraw/zinc/89/95/71/1128899571.db2.gz IVNBWIURMNDNRF-CJNGLKHVSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145106 1121125382 /nfs/dbraw/zinc/12/53/82/1121125382.db2.gz SYHRRDHGJLWWOI-AWEZNQCLSA-N 1 1 326.400 3.680 20 5 EHBDMO O=C(C[N@@H+](C1CC1)C1CCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064808018 1128965028 /nfs/dbraw/zinc/96/50/28/1128965028.db2.gz QGKVCRROFRHWDY-UHFFFAOYSA-N 1 1 337.807 3.594 20 5 EHBDMO C[N@@H+](CCSc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000193744480 1121602775 /nfs/dbraw/zinc/60/27/75/1121602775.db2.gz LFBPDEOADSTHJV-UHFFFAOYSA-N 1 1 348.453 3.528 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC1=CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272498706 1121664464 /nfs/dbraw/zinc/66/44/64/1121664464.db2.gz GIDBBHRMQLFKHD-SFHVURJKSA-N 1 1 340.427 3.898 20 5 EHBDMO C[C@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000301100703 1121692436 /nfs/dbraw/zinc/69/24/36/1121692436.db2.gz PWEYWRIDVFFBNL-LLVKDONJSA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180124 1121798145 /nfs/dbraw/zinc/79/81/45/1121798145.db2.gz GNNJYBDKEINUEP-DOMZBBRYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000301746012 1129023351 /nfs/dbraw/zinc/02/33/51/1129023351.db2.gz PDZVWBQZXVZMKJ-UHFFFAOYSA-N 1 1 334.807 3.707 20 5 EHBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000301139047 1122096834 /nfs/dbraw/zinc/09/68/34/1122096834.db2.gz BTVGCSAJWBZHRA-UHFFFAOYSA-N 1 1 339.439 3.943 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000272766301 1122129431 /nfs/dbraw/zinc/12/94/31/1122129431.db2.gz ABVJMHQGBBBZNF-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)[nH]n1 ZINC000272766301 1122129434 /nfs/dbraw/zinc/12/94/34/1122129434.db2.gz ABVJMHQGBBBZNF-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ncc([N+](=O)[O-])cc2C)cc1F ZINC000301182818 1122321056 /nfs/dbraw/zinc/32/10/56/1122321056.db2.gz IPPBBRNYPSUFCN-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2Cc2ccccc2Cl)c(C)c1[N+](=O)[O-] ZINC000919954377 1123245188 /nfs/dbraw/zinc/24/51/88/1123245188.db2.gz OXBCEEFXTWISLK-HNNXBMFYSA-N 1 1 348.834 3.726 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)c(C)c1[N+](=O)[O-] ZINC000919954377 1123245189 /nfs/dbraw/zinc/24/51/89/1123245189.db2.gz OXBCEEFXTWISLK-HNNXBMFYSA-N 1 1 348.834 3.726 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000609489643 1123591705 /nfs/dbraw/zinc/59/17/05/1123591705.db2.gz XLDAFUBPWGBZHZ-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000615837652 1123885297 /nfs/dbraw/zinc/88/52/97/1123885297.db2.gz SNGNOTOVPMBHPH-JVCXIRSZSA-N 1 1 337.423 3.958 20 5 EHBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000619895225 1125425109 /nfs/dbraw/zinc/42/51/09/1125425109.db2.gz RWTGHAKYJROUJW-MRXNPFEDSA-N 1 1 333.435 3.602 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCCC[C@H]1C ZINC000255958938 1129237793 /nfs/dbraw/zinc/23/77/93/1129237793.db2.gz JNCDXEFWSBVTQP-DYVFJYSZSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000327948569 1129539734 /nfs/dbraw/zinc/53/97/34/1129539734.db2.gz BLZQUFXLEHCQSE-KZNAEPCWSA-N 1 1 348.443 3.509 20 5 EHBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(Cl)cc1 ZINC000282390916 1129686932 /nfs/dbraw/zinc/68/69/32/1129686932.db2.gz DOIOXTMZUNFERN-OAHLLOKOSA-N 1 1 338.766 3.865 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000281116682 1129703661 /nfs/dbraw/zinc/70/36/61/1129703661.db2.gz XFGUYLVWYCAWSQ-NXHRZFHOSA-N 1 1 336.407 3.640 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000392391472 1129712319 /nfs/dbraw/zinc/71/23/19/1129712319.db2.gz VBOZPBKQUYNEOX-LLVKDONJSA-N 1 1 346.353 3.685 20 5 EHBDMO Cc1ccc(CNc2cccc(F)c2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302050957 1129765825 /nfs/dbraw/zinc/76/58/25/1129765825.db2.gz NWWHDGWILQJKLX-UHFFFAOYSA-N 1 1 330.363 3.650 20 5 EHBDMO Cc1cc(NC[C@@H](c2ccco2)N(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302151052 1129770789 /nfs/dbraw/zinc/77/07/89/1129770789.db2.gz HRWLHRPFOJNIMP-KRWDZBQOSA-N 1 1 340.383 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cscc2Br)cc1 ZINC000302709083 1129786493 /nfs/dbraw/zinc/78/64/93/1129786493.db2.gz XQNGIQACEQOINO-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1NCCc1cn2c([nH+]1)CCCC2 ZINC000302828677 1129794102 /nfs/dbraw/zinc/79/41/02/1129794102.db2.gz OMWNJVOSTWVVMD-UHFFFAOYSA-N 1 1 334.807 3.744 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303532715 1129852436 /nfs/dbraw/zinc/85/24/36/1129852436.db2.gz GEDUDFAOOCLTPT-KXBFYZLASA-N 1 1 343.427 3.744 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000245527505 1130230772 /nfs/dbraw/zinc/23/07/72/1130230772.db2.gz PWMXJYPBBDBJTG-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000245527505 1130230777 /nfs/dbraw/zinc/23/07/77/1130230777.db2.gz PWMXJYPBBDBJTG-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000246581888 1130393174 /nfs/dbraw/zinc/39/31/74/1130393174.db2.gz SMIVESIBAYNJRX-GUYCJALGSA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000246581888 1130393182 /nfs/dbraw/zinc/39/31/82/1130393182.db2.gz SMIVESIBAYNJRX-GUYCJALGSA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893300 1130854103 /nfs/dbraw/zinc/85/41/03/1130854103.db2.gz OYQRGHFUBZRXCT-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893300 1130854112 /nfs/dbraw/zinc/85/41/12/1130854112.db2.gz OYQRGHFUBZRXCT-CLCXKQKWSA-N 1 1 326.396 3.945 20 5 EHBDMO CCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000740881779 1131552319 /nfs/dbraw/zinc/55/23/19/1131552319.db2.gz CWSQXBYFLXWXKI-OIISXLGYSA-N 1 1 336.407 3.759 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)s1 ZINC000737413893 1131575774 /nfs/dbraw/zinc/57/57/74/1131575774.db2.gz DETZJJBNQIGOSS-UHFFFAOYSA-N 1 1 349.431 3.680 20 5 EHBDMO CCCC[N@@H+](CC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014611 1131935766 /nfs/dbraw/zinc/93/57/66/1131935766.db2.gz UKRINLGAQAHHCK-UHFFFAOYSA-N 1 1 341.402 3.964 20 5 EHBDMO CC[C@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017870 1131935827 /nfs/dbraw/zinc/93/58/27/1131935827.db2.gz LFGSABICPCNFGD-LBPRGKRZSA-N 1 1 339.386 3.716 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001173225013 1132005805 /nfs/dbraw/zinc/00/58/05/1132005805.db2.gz ARUOZBIDDPDJDI-RDJZCZTQSA-N 1 1 325.412 3.800 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227938 1132008136 /nfs/dbraw/zinc/00/81/36/1132008136.db2.gz SPMVACWSVHGVDQ-UZLBHIALSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](CC(=O)OC(C)(C)C)C1 ZINC001173230818 1132009085 /nfs/dbraw/zinc/00/90/85/1132009085.db2.gz GXZQIZWNHXLRFP-GOEBONIOSA-N 1 1 348.443 3.580 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173233364 1132010373 /nfs/dbraw/zinc/01/03/73/1132010373.db2.gz VTFBUPDVICOUTP-CQSZACIVSA-N 1 1 326.396 3.593 20 5 EHBDMO COC(=O)[C@@H]1CCCC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860260 1132582972 /nfs/dbraw/zinc/58/29/72/1132582972.db2.gz VYKFJNJSGUQUPC-MAUKXSAKSA-N 1 1 346.427 3.539 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048728 1132641816 /nfs/dbraw/zinc/64/18/16/1132641816.db2.gz BCEVZSGTKCSIOT-GWCFXTLKSA-N 1 1 329.227 3.797 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001175613445 1132726933 /nfs/dbraw/zinc/72/69/33/1132726933.db2.gz XIKSIWQEZXQVKW-UHFFFAOYSA-N 1 1 325.368 3.717 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc2cc[nH]c2c1 ZINC001175613445 1132726939 /nfs/dbraw/zinc/72/69/39/1132726939.db2.gz XIKSIWQEZXQVKW-UHFFFAOYSA-N 1 1 325.368 3.717 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[NH+](Cc2ccsc2)CC1 ZINC000804334019 1132809080 /nfs/dbraw/zinc/80/90/80/1132809080.db2.gz VZPGFLQTNRXDRD-UHFFFAOYSA-N 1 1 337.832 3.632 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234818 1132883544 /nfs/dbraw/zinc/88/35/44/1132883544.db2.gz IOYLJBAHHHHOKK-AWEZNQCLSA-N 1 1 343.452 3.920 20 5 EHBDMO OCCO[C@@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769384871 1133274346 /nfs/dbraw/zinc/27/43/46/1133274346.db2.gz XRFKCKXJMHNSDF-LJQANCHMSA-N 1 1 335.447 3.966 20 5 EHBDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769402992 1133277121 /nfs/dbraw/zinc/27/71/21/1133277121.db2.gz GEZAAXMJSYDNEU-SFHVURJKSA-N 1 1 332.447 3.951 20 5 EHBDMO OCCCC[NH+]1CCN(Cc2c3ccccc3cc3ccccc32)CC1 ZINC000769396183 1133286848 /nfs/dbraw/zinc/28/68/48/1133286848.db2.gz XIRKJBQTBOKEJD-UHFFFAOYSA-N 1 1 348.490 3.883 20 5 EHBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC001180332803 1133362593 /nfs/dbraw/zinc/36/25/93/1133362593.db2.gz UMTRUPSFZBQVBH-DOMZBBRYSA-N 1 1 346.349 3.597 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2c1NCCC2 ZINC001181697321 1133518624 /nfs/dbraw/zinc/51/86/24/1133518624.db2.gz HWONGCZLVVAIMP-UHFFFAOYSA-N 1 1 325.412 3.627 20 5 EHBDMO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774833926 1134035887 /nfs/dbraw/zinc/03/58/87/1134035887.db2.gz QVEVDYYWWGQDNF-UHFFFAOYSA-N 1 1 329.356 3.834 20 5 EHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774833926 1134035893 /nfs/dbraw/zinc/03/58/93/1134035893.db2.gz QVEVDYYWWGQDNF-UHFFFAOYSA-N 1 1 329.356 3.834 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886607 1134099991 /nfs/dbraw/zinc/09/99/91/1134099991.db2.gz WGAZCGAXJHFDSH-CZUORRHYSA-N 1 1 341.367 3.881 20 5 EHBDMO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788471799 1134129573 /nfs/dbraw/zinc/12/95/73/1134129573.db2.gz TYGBAICTBNDMGX-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788471799 1134129578 /nfs/dbraw/zinc/12/95/78/1134129578.db2.gz TYGBAICTBNDMGX-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606109 1134582752 /nfs/dbraw/zinc/58/27/52/1134582752.db2.gz QMDFJUOFNRJTQX-YLJYHZDGSA-N 1 1 340.423 3.735 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328776 1134749453 /nfs/dbraw/zinc/74/94/53/1134749453.db2.gz MHWFYAAUODDHSD-GFCCVEGCSA-N 1 1 328.359 3.656 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170354468 1134753826 /nfs/dbraw/zinc/75/38/26/1134753826.db2.gz LSFDCRUSIABEIC-AWEZNQCLSA-N 1 1 346.402 3.848 20 5 EHBDMO Cc1n[nH]cc1C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000792927909 1134828108 /nfs/dbraw/zinc/82/81/08/1134828108.db2.gz UKDHMSGLWUOSDQ-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443600 1134867454 /nfs/dbraw/zinc/86/74/54/1134867454.db2.gz CQSRDUZQAXIRIM-HNAYVOBHSA-N 1 1 326.396 3.852 20 5 EHBDMO C[C@@H]1C[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499132 1135024031 /nfs/dbraw/zinc/02/40/31/1135024031.db2.gz AKQSHVWAKIMBLF-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499132 1135024039 /nfs/dbraw/zinc/02/40/39/1135024039.db2.gz AKQSHVWAKIMBLF-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO Cn1cc([C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000775548690 1135059460 /nfs/dbraw/zinc/05/94/60/1135059460.db2.gz JBELTIFZZJTUNU-OAHLLOKOSA-N 1 1 336.823 3.859 20 5 EHBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc(N)cc1[N+](=O)[O-] ZINC000804620748 1135143560 /nfs/dbraw/zinc/14/35/60/1135143560.db2.gz UJYWJDXANQMESV-SFHVURJKSA-N 1 1 342.443 3.746 20 5 EHBDMO CCCCC[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329083 1135546140 /nfs/dbraw/zinc/54/61/40/1135546140.db2.gz KZTXKRFUMCOYPX-MRXNPFEDSA-N 1 1 333.432 3.629 20 5 EHBDMO CCC(CC)CCC[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001196505886 1135570983 /nfs/dbraw/zinc/57/09/83/1135570983.db2.gz IGXPUFXAHCRKKB-UHFFFAOYSA-N 1 1 335.448 3.990 20 5 EHBDMO C[N@@H+](Cc1cc2ccccc2o1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000747466324 1135631565 /nfs/dbraw/zinc/63/15/65/1135631565.db2.gz DRHCQCFFZSDGPP-UHFFFAOYSA-N 1 1 336.351 3.780 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000747466324 1135631566 /nfs/dbraw/zinc/63/15/66/1135631566.db2.gz DRHCQCFFZSDGPP-UHFFFAOYSA-N 1 1 336.351 3.780 20 5 EHBDMO C[C@@H](C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001197600014 1135713398 /nfs/dbraw/zinc/71/33/98/1135713398.db2.gz BXQWTLHQFPLKGR-NSHDSACASA-N 1 1 341.839 3.801 20 5 EHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761689 1135729041 /nfs/dbraw/zinc/72/90/41/1135729041.db2.gz QNAMVDLEQMFLHH-RBUKOAKNSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000775892107 1135857956 /nfs/dbraw/zinc/85/79/56/1135857956.db2.gz RARCPSHSRJONMA-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000775892107 1135857961 /nfs/dbraw/zinc/85/79/61/1135857961.db2.gz RARCPSHSRJONMA-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809739123 1135883579 /nfs/dbraw/zinc/88/35/79/1135883579.db2.gz YCZPOVPFWMTUKT-UHFFFAOYSA-N 1 1 347.846 3.942 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@H+]3CCCC[C@H]23)o1 ZINC001199345321 1135896597 /nfs/dbraw/zinc/89/65/97/1135896597.db2.gz QDLQPASTHANODS-FUHWJXTLSA-N 1 1 341.411 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCN3CCCC[C@H]23)o1 ZINC001199345321 1135896600 /nfs/dbraw/zinc/89/66/00/1135896600.db2.gz QDLQPASTHANODS-FUHWJXTLSA-N 1 1 341.411 3.571 20 5 EHBDMO C[N@@H+]1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006294 1135912883 /nfs/dbraw/zinc/91/28/83/1135912883.db2.gz IONOOZLGSUXEGB-SJLPKXTDSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006294 1135912887 /nfs/dbraw/zinc/91/28/87/1135912887.db2.gz IONOOZLGSUXEGB-SJLPKXTDSA-N 1 1 345.830 3.783 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000811474565 1136096444 /nfs/dbraw/zinc/09/64/44/1136096444.db2.gz LVQMHQZRVZDYEH-OLZOCXBDSA-N 1 1 344.242 3.618 20 5 EHBDMO CO[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(F)(F)F ZINC000811479768 1136097350 /nfs/dbraw/zinc/09/73/50/1136097350.db2.gz LFJMRHKNDNTSQI-SECBINFHSA-N 1 1 347.120 3.569 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000850428325 1136257283 /nfs/dbraw/zinc/25/72/83/1136257283.db2.gz MVOUMJBOOFVYPX-NEPJUHHUSA-N 1 1 345.355 3.923 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000851832826 1136412008 /nfs/dbraw/zinc/41/20/08/1136412008.db2.gz DXRBVBHQSGKEDX-IEBWSBKVSA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587824 1136447431 /nfs/dbraw/zinc/44/74/31/1136447431.db2.gz OVMJBAXDFKHCDC-LIRRHRJNSA-N 1 1 326.396 3.854 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1OC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000852727678 1136480357 /nfs/dbraw/zinc/48/03/57/1136480357.db2.gz OHAZRPAMVHVGNB-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814641787 1136488578 /nfs/dbraw/zinc/48/85/78/1136488578.db2.gz LEGZXNDZYLDQDG-HKUYNNGSSA-N 1 1 326.396 3.508 20 5 EHBDMO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815600329 1136616870 /nfs/dbraw/zinc/61/68/70/1136616870.db2.gz QNULMCVIYTVRNR-LBPRGKRZSA-N 1 1 344.415 3.600 20 5 EHBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815617765 1136619485 /nfs/dbraw/zinc/61/94/85/1136619485.db2.gz VAKIUSLJICFBDO-WBMJQRKESA-N 1 1 343.431 3.683 20 5 EHBDMO COc1c(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)oc2ccccc21 ZINC000815619842 1136619911 /nfs/dbraw/zinc/61/99/11/1136619911.db2.gz ZKRSFQADRIBSCI-NSHDSACASA-N 1 1 341.367 3.783 20 5 EHBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774781 1136661284 /nfs/dbraw/zinc/66/12/84/1136661284.db2.gz OKJBUSBDADPSKT-KSZLIROESA-N 1 1 340.427 3.715 20 5 EHBDMO Cn1ccnc1[C@H](Nc1cccc(C2CC2)[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000816636378 1136747005 /nfs/dbraw/zinc/74/70/05/1136747005.db2.gz SAUQTUSYRWBWTE-GOSISDBHSA-N 1 1 349.394 3.802 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001170858992 1136792430 /nfs/dbraw/zinc/79/24/30/1136792430.db2.gz CRDOCZLZBWESRQ-DLBZAZTESA-N 1 1 341.411 3.668 20 5 EHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001170858992 1136792432 /nfs/dbraw/zinc/79/24/32/1136792432.db2.gz CRDOCZLZBWESRQ-DLBZAZTESA-N 1 1 341.411 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1 ZINC000824696057 1137148719 /nfs/dbraw/zinc/14/87/19/1137148719.db2.gz GWWMZPCYPOIPOE-UAGQMJEPSA-N 1 1 338.835 3.764 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+](CC1CCCCC1)C1CC1 ZINC000794624252 1137221557 /nfs/dbraw/zinc/22/15/57/1137221557.db2.gz TYYCMEIKDNULNH-UHFFFAOYSA-N 1 1 345.399 3.505 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+](CC1CCCCC1)C1CC1 ZINC000794624252 1137221559 /nfs/dbraw/zinc/22/15/59/1137221559.db2.gz TYYCMEIKDNULNH-UHFFFAOYSA-N 1 1 345.399 3.505 20 5 EHBDMO CCCCN1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866250204 1137339353 /nfs/dbraw/zinc/33/93/53/1137339353.db2.gz WIGLTAGFASOXMK-CQSZACIVSA-N 1 1 337.439 3.519 20 5 EHBDMO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308940 1137408522 /nfs/dbraw/zinc/40/85/22/1137408522.db2.gz VDKSTEAYKZWVOI-HIFRSBDPSA-N 1 1 334.416 3.537 20 5 EHBDMO C[N@@H+]1CCc2c(NCC3(c4ccccc4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001171465876 1137489922 /nfs/dbraw/zinc/48/99/22/1137489922.db2.gz UKQRNFLCWJQHAT-UHFFFAOYSA-N 1 1 337.423 3.726 20 5 EHBDMO C[N@H+]1CCc2c(NCC3(c4ccccc4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001171465876 1137489923 /nfs/dbraw/zinc/48/99/23/1137489923.db2.gz UKQRNFLCWJQHAT-UHFFFAOYSA-N 1 1 337.423 3.726 20 5 EHBDMO COc1ncccc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872022720 1137565388 /nfs/dbraw/zinc/56/53/88/1137565388.db2.gz YXHSMUVVPAOLHD-NSHDSACASA-N 1 1 333.413 3.571 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064578 1137569213 /nfs/dbraw/zinc/56/92/13/1137569213.db2.gz ZXWSBENOBIDEKU-GFCCVEGCSA-N 1 1 332.375 3.812 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ncccc1N(C)C ZINC000872073137 1137569766 /nfs/dbraw/zinc/56/97/66/1137569766.db2.gz NERALDZNYKHUQC-GFCCVEGCSA-N 1 1 346.456 3.629 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000876773505 1137660978 /nfs/dbraw/zinc/66/09/78/1137660978.db2.gz SRCCJVHHWRZPBU-DEOSSOPVSA-N 1 1 346.452 3.581 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000876773505 1137660979 /nfs/dbraw/zinc/66/09/79/1137660979.db2.gz SRCCJVHHWRZPBU-DEOSSOPVSA-N 1 1 346.452 3.581 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(Cl)cc1O ZINC000877557020 1137681091 /nfs/dbraw/zinc/68/10/91/1137681091.db2.gz DNBPMNGKHRLBOF-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966239 1137697361 /nfs/dbraw/zinc/69/73/61/1137697361.db2.gz DXQYDBVYFMXNAO-OLZOCXBDSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC1CC1 ZINC000878097775 1137702215 /nfs/dbraw/zinc/70/22/15/1137702215.db2.gz NYJHNFVSVMKJCB-UHFFFAOYSA-N 1 1 336.779 3.530 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061728 1137766871 /nfs/dbraw/zinc/76/68/71/1137766871.db2.gz ZZQYIJYKJGGYST-SUNKGSAMSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061728 1137766872 /nfs/dbraw/zinc/76/68/72/1137766872.db2.gz ZZQYIJYKJGGYST-SUNKGSAMSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061727 1137767019 /nfs/dbraw/zinc/76/70/19/1137767019.db2.gz ZZQYIJYKJGGYST-JTNHKYCSSA-N 1 1 332.322 3.698 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)O[C@H](C)C1 ZINC000880061727 1137767020 /nfs/dbraw/zinc/76/70/20/1137767020.db2.gz ZZQYIJYKJGGYST-JTNHKYCSSA-N 1 1 332.322 3.698 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)cc1[N+](=O)[O-] ZINC000111312373 1137904234 /nfs/dbraw/zinc/90/42/34/1137904234.db2.gz MHCBZZDZCJEMDK-AWEZNQCLSA-N 1 1 347.440 3.878 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208718 1137935807 /nfs/dbraw/zinc/93/58/07/1137935807.db2.gz FRHQGQKCWPCWQJ-SFHVURJKSA-N 1 1 336.432 3.773 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)c1c(F)cccc1F)C1CC1 ZINC000135231663 1137964691 /nfs/dbraw/zinc/96/46/91/1137964691.db2.gz JPRXWEAXDIFHIF-QGZVFWFLSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1c(F)cccc1F)C1CC1 ZINC000135231663 1137964692 /nfs/dbraw/zinc/96/46/92/1137964692.db2.gz JPRXWEAXDIFHIF-QGZVFWFLSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC4(CCC4)C3)o2)c1 ZINC000123495474 1138270841 /nfs/dbraw/zinc/27/08/41/1138270841.db2.gz NMPDCIKZQAXANS-UHFFFAOYSA-N 1 1 327.384 3.668 20 5 EHBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000180101690 1139809059 /nfs/dbraw/zinc/80/90/59/1139809059.db2.gz IXJHWCPPPSLQNG-UHFFFAOYSA-N 1 1 348.321 3.529 20 5 EHBDMO Cc1cnn([C@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760509 1139990884 /nfs/dbraw/zinc/99/08/84/1139990884.db2.gz CXSDBPBANURGEM-WBVHZDCISA-N 1 1 328.416 3.806 20 5 EHBDMO COc1cc(F)c([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000183496318 1140042446 /nfs/dbraw/zinc/04/24/46/1140042446.db2.gz CKZXMZULOZMHTL-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000192184970 1140509628 /nfs/dbraw/zinc/50/96/28/1140509628.db2.gz HMXQZDDVVWSQDP-GFCCVEGCSA-N 1 1 333.413 3.577 20 5 EHBDMO CO[C@@H](C)c1nc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cs1 ZINC000267644700 1140814846 /nfs/dbraw/zinc/81/48/46/1140814846.db2.gz SBIDBBPHNJHEMY-PZBABLGHSA-N 1 1 333.413 3.562 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CCCc4c[nH]nc43)o2)c1 ZINC000268861397 1141011037 /nfs/dbraw/zinc/01/10/37/1141011037.db2.gz SEZQRQRNEWZPQY-MRXNPFEDSA-N 1 1 338.367 3.745 20 5 EHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CCC2)CC1 ZINC000269011504 1141046813 /nfs/dbraw/zinc/04/68/13/1141046813.db2.gz NTBQZVAIMLEXTH-HNNXBMFYSA-N 1 1 331.460 3.522 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000269629389 1141129926 /nfs/dbraw/zinc/12/99/26/1141129926.db2.gz DUKDFKAULIORRT-SFHVURJKSA-N 1 1 330.384 3.666 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000269894103 1141155019 /nfs/dbraw/zinc/15/50/19/1141155019.db2.gz BXDBVXYTWLMVBE-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271490626 1141380257 /nfs/dbraw/zinc/38/02/57/1141380257.db2.gz OVVIBSFXKAMMRV-WBMJQRKESA-N 1 1 348.374 3.517 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000271650805 1141412405 /nfs/dbraw/zinc/41/24/05/1141412405.db2.gz VBIJGUSTKBHLAS-CHWSQXEVSA-N 1 1 345.374 3.720 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137751 1141507291 /nfs/dbraw/zinc/50/72/91/1141507291.db2.gz GBVYMPDFSRTHBX-AAEUAGOBSA-N 1 1 346.349 3.739 20 5 EHBDMO COc1cc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248617890 1032069373 /nfs/dbraw/zinc/06/93/73/1032069373.db2.gz JOCTYIWNKJCBKK-CJNGLKHVSA-N 1 1 340.420 3.603 20 5 EHBDMO COc1cc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248617890 1032069392 /nfs/dbraw/zinc/06/93/92/1032069392.db2.gz JOCTYIWNKJCBKK-CJNGLKHVSA-N 1 1 340.420 3.603 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000430160269 1014484932 /nfs/dbraw/zinc/48/49/32/1014484932.db2.gz FWIYKJFUIJRHTA-KAPURRDVSA-N 1 1 330.428 3.747 20 5 EHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430222797 1015093897 /nfs/dbraw/zinc/09/38/97/1015093897.db2.gz TVMDVHMAHSCFOV-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000430242914 1015207704 /nfs/dbraw/zinc/20/77/04/1015207704.db2.gz YYTRFVYBVVVZBM-ZDUSSCGKSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001167122481 1016177262 /nfs/dbraw/zinc/17/72/62/1016177262.db2.gz IPOXKASFUYCFFY-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO CC(C)n1cc(C2=CCC[N@H+](Cc3csc([N+](=O)[O-])c3)CC2)nn1 ZINC000449468185 1032588613 /nfs/dbraw/zinc/58/86/13/1032588613.db2.gz CZDZKBWROUFLNB-UHFFFAOYSA-N 1 1 347.444 3.508 20 5 EHBDMO CC(C)n1cc(C2=CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)CC2)nn1 ZINC000449468185 1032588628 /nfs/dbraw/zinc/58/86/28/1032588628.db2.gz CZDZKBWROUFLNB-UHFFFAOYSA-N 1 1 347.444 3.508 20 5 EHBDMO CC(C)(C)n1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501158 1032680655 /nfs/dbraw/zinc/68/06/55/1032680655.db2.gz PARZJEHSTJVMKI-KRWDZBQOSA-N 1 1 342.443 3.926 20 5 EHBDMO C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]C1 ZINC000414850944 1017250858 /nfs/dbraw/zinc/25/08/58/1017250858.db2.gz IVYKYAYRLANTTP-KBPBESRZSA-N 1 1 345.468 3.801 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000468033651 1017504820 /nfs/dbraw/zinc/50/48/20/1017504820.db2.gz MWZGSFFKUXUJEX-ABAIWWIYSA-N 1 1 346.358 3.917 20 5 EHBDMO C[C@H]1CCN(c2ccsc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610284381 1017656049 /nfs/dbraw/zinc/65/60/49/1017656049.db2.gz QGTQGPAUBOPQOQ-AWEZNQCLSA-N 1 1 331.441 3.757 20 5 EHBDMO C[C@@]1(CNc2ncc([N+](=O)[O-])s2)CCC[N@H+]1Cc1ccccc1 ZINC000336943108 1018007087 /nfs/dbraw/zinc/00/70/87/1018007087.db2.gz ZYFIVQNCDMLZCD-INIZCTEOSA-N 1 1 332.429 3.518 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cccc2c1OCCCO2 ZINC000893142285 1018625464 /nfs/dbraw/zinc/62/54/64/1018625464.db2.gz ORNJIQRRHRNONH-UHFFFAOYSA-N 1 1 348.786 3.699 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000137063181 1018777050 /nfs/dbraw/zinc/77/70/50/1018777050.db2.gz GGAGMRADXFUKGU-INIZCTEOSA-N 1 1 330.384 3.980 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000137063181 1018777091 /nfs/dbraw/zinc/77/70/91/1018777091.db2.gz GGAGMRADXFUKGU-INIZCTEOSA-N 1 1 330.384 3.980 20 5 EHBDMO C[N@H+]1CC[C@@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000729264092 1019252394 /nfs/dbraw/zinc/25/23/94/1019252394.db2.gz VLWZLZMESYOENG-QMMMGPOBSA-N 1 1 337.729 3.631 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000052907286 1019308330 /nfs/dbraw/zinc/30/83/30/1019308330.db2.gz IAFNLVBPVSRTIR-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000052907286 1019308344 /nfs/dbraw/zinc/30/83/44/1019308344.db2.gz IAFNLVBPVSRTIR-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1cc(NC(=O)[C@@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC001266630957 1019734387 /nfs/dbraw/zinc/73/43/87/1019734387.db2.gz HPJCKXPMWRVRQP-MRXNPFEDSA-N 1 1 347.802 3.798 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1cccc([N+](=O)[O-])c1 ZINC000610451270 1019771383 /nfs/dbraw/zinc/77/13/83/1019771383.db2.gz KOVXXJPJVVQJAI-QGZVFWFLSA-N 1 1 339.439 3.691 20 5 EHBDMO CCN(CCC[NH+]1CCCC1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000579776481 1019857480 /nfs/dbraw/zinc/85/74/80/1019857480.db2.gz OVYWTANSNSQQPX-VKAVYKQESA-N 1 1 331.460 3.806 20 5 EHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070681 1020058889 /nfs/dbraw/zinc/05/88/89/1020058889.db2.gz NERQALGUEKEALP-SNVBAGLBSA-N 1 1 332.347 3.825 20 5 EHBDMO CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000602448226 1032895750 /nfs/dbraw/zinc/89/57/50/1032895750.db2.gz HKIPYIJUCHUERF-LBPRGKRZSA-N 1 1 328.372 3.658 20 5 EHBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000602448226 1032895757 /nfs/dbraw/zinc/89/57/57/1032895757.db2.gz HKIPYIJUCHUERF-LBPRGKRZSA-N 1 1 328.372 3.658 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183188776 1020546831 /nfs/dbraw/zinc/54/68/31/1020546831.db2.gz DKNFGLYDYGIMST-ZMSDIMECSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183188776 1020546833 /nfs/dbraw/zinc/54/68/33/1020546833.db2.gz DKNFGLYDYGIMST-ZMSDIMECSA-N 1 1 331.460 3.898 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(Cl)cc1O ZINC000602517289 1032927830 /nfs/dbraw/zinc/92/78/30/1032927830.db2.gz FNPKPDZMMFYULW-SNVBAGLBSA-N 1 1 336.775 3.813 20 5 EHBDMO CCc1nc(C)c(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000426323240 1021262784 /nfs/dbraw/zinc/26/27/84/1021262784.db2.gz LVECVXVPFQRAHQ-OAHLLOKOSA-N 1 1 329.400 3.966 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C(C)C)C1CCCCC1 ZINC000120850656 1021282127 /nfs/dbraw/zinc/28/21/27/1021282127.db2.gz LJMGXASIQUDDCV-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000505916310 1021445540 /nfs/dbraw/zinc/44/55/40/1021445540.db2.gz AIXOTVMNLMOLOW-UHFFFAOYSA-N 1 1 349.450 3.822 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601389 1032995752 /nfs/dbraw/zinc/99/57/52/1032995752.db2.gz KSACGIJXUOUYTI-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO CCCC[N@@H+](CC)Cc1cccc(CNc2c([N+](=O)[O-])ncn2C)c1 ZINC000471749847 1021975023 /nfs/dbraw/zinc/97/50/23/1021975023.db2.gz VYSUVYIOYZAXCI-UHFFFAOYSA-N 1 1 345.447 3.562 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cccc(Cl)c1 ZINC000016632093 1033030624 /nfs/dbraw/zinc/03/06/24/1033030624.db2.gz RFTYQXBHGGCFGC-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000016632093 1033030635 /nfs/dbraw/zinc/03/06/35/1033030635.db2.gz RFTYQXBHGGCFGC-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO CC(=O)c1cc(NCCCC[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000341568001 1022346610 /nfs/dbraw/zinc/34/66/10/1022346610.db2.gz UNPQRKXFBCNXTN-CQSZACIVSA-N 1 1 333.432 3.864 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000602656822 1033056039 /nfs/dbraw/zinc/05/60/39/1033056039.db2.gz YNZXFUBVIRLZCU-DZGCQCFKSA-N 1 1 344.333 3.757 20 5 EHBDMO CCC1(CC)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000438508046 1022746675 /nfs/dbraw/zinc/74/66/75/1022746675.db2.gz XKIGWDOPDKKYQE-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378894 1023038316 /nfs/dbraw/zinc/03/83/16/1023038316.db2.gz GMQFXNJPEAGILE-HNNXBMFYSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378894 1023038324 /nfs/dbraw/zinc/03/83/24/1023038324.db2.gz GMQFXNJPEAGILE-HNNXBMFYSA-N 1 1 332.425 3.934 20 5 EHBDMO CC(C)C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C ZINC000518270151 1023180282 /nfs/dbraw/zinc/18/02/82/1023180282.db2.gz XDYWENXAEHWAAN-QGZVFWFLSA-N 1 1 345.443 3.921 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475572 1023239499 /nfs/dbraw/zinc/23/94/99/1023239499.db2.gz XZOSWXDIZVTYQY-CVEARBPZSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000602733565 1033122470 /nfs/dbraw/zinc/12/24/70/1033122470.db2.gz WBPUBNXSAQSSSC-WMZOPIPTSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000602733565 1033122478 /nfs/dbraw/zinc/12/24/78/1033122478.db2.gz WBPUBNXSAQSSSC-WMZOPIPTSA-N 1 1 346.814 3.946 20 5 EHBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449754978 1033172233 /nfs/dbraw/zinc/17/22/33/1033172233.db2.gz LGODNOWIOREHSQ-SAABIXHNSA-N 1 1 326.396 3.981 20 5 EHBDMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769839 1033182964 /nfs/dbraw/zinc/18/29/64/1033182964.db2.gz COYCVBHBQCCXKR-CYBMUJFWSA-N 1 1 334.416 3.719 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CC(C)C)C1CCCC1 ZINC000434902163 1024493275 /nfs/dbraw/zinc/49/32/75/1024493275.db2.gz AZLHKJKQGASNJG-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(C[N@@H+](C)CCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000520784024 1024770338 /nfs/dbraw/zinc/77/03/38/1024770338.db2.gz JTRWYUBSGZZAOA-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=O ZINC000511068314 1025205818 /nfs/dbraw/zinc/20/58/18/1025205818.db2.gz ZLJVHMCHIFDJMS-UHFFFAOYSA-N 1 1 337.379 3.523 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000521476559 1025413036 /nfs/dbraw/zinc/41/30/36/1025413036.db2.gz GYCYLPMZGMCNNF-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000521476559 1025413055 /nfs/dbraw/zinc/41/30/55/1025413055.db2.gz GYCYLPMZGMCNNF-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000436307283 1025572389 /nfs/dbraw/zinc/57/23/89/1025572389.db2.gz KIUPCLDMCZQHHO-GHMZBOCLSA-N 1 1 346.353 3.541 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436319135 1025582601 /nfs/dbraw/zinc/58/26/01/1025582601.db2.gz QPWCQKGTEGIZRN-LLVKDONJSA-N 1 1 346.353 3.541 20 5 EHBDMO Cc1ccccc1[C@H]([C@H](C)NCc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000442997127 1025640023 /nfs/dbraw/zinc/64/00/23/1025640023.db2.gz YZNSVQYINLHLBN-KXBFYZLASA-N 1 1 327.428 3.684 20 5 EHBDMO Cc1ccccc1[C@H]([C@H](C)NCc1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000443004422 1025656146 /nfs/dbraw/zinc/65/61/46/1025656146.db2.gz DCUCOYVGOFRNTM-JXFKEZNVSA-N 1 1 341.455 3.993 20 5 EHBDMO Cc1ccc(N2CC[N@H+](Cc3ccccc3[N+](=O)[O-])[C@H](C)C2)cc1C ZINC001167558300 1025678090 /nfs/dbraw/zinc/67/80/90/1025678090.db2.gz LIZSUDKRWNLPTH-QGZVFWFLSA-N 1 1 339.439 3.922 20 5 EHBDMO Cc1ccc(N2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])[C@H](C)C2)cc1C ZINC001167558300 1025678103 /nfs/dbraw/zinc/67/81/03/1025678103.db2.gz LIZSUDKRWNLPTH-QGZVFWFLSA-N 1 1 339.439 3.922 20 5 EHBDMO CC(C)c1ccc(C[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000521821379 1025709803 /nfs/dbraw/zinc/70/98/03/1025709803.db2.gz OBKSBDAQOMJQEO-IBGZPJMESA-N 1 1 333.476 3.928 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)Cc2cccc([N+](=O)[O-])c2C)c1C ZINC000451379880 1025880666 /nfs/dbraw/zinc/88/06/66/1025880666.db2.gz WCIQQDYOGDFGKS-UHFFFAOYSA-N 1 1 329.400 3.556 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)C2CCCCC2)n1 ZINC000478439749 1026103353 /nfs/dbraw/zinc/10/33/53/1026103353.db2.gz YTZPMEUGXMNAKG-UHFFFAOYSA-N 1 1 328.416 3.626 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1Cl ZINC000783676750 1026220765 /nfs/dbraw/zinc/22/07/65/1026220765.db2.gz NVJGHXOFVYMEBH-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1Cl ZINC000783676750 1026220769 /nfs/dbraw/zinc/22/07/69/1026220769.db2.gz NVJGHXOFVYMEBH-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000338999656 1026332314 /nfs/dbraw/zinc/33/23/14/1026332314.db2.gz ISLHUAMZGWXMMO-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc3cccc(Cl)c3n2C)cc1[N+](=O)[O-] ZINC000479418533 1026627492 /nfs/dbraw/zinc/62/74/92/1026627492.db2.gz JRTRWQMQALXZHG-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCCO)[C@H]2CCCc3ccccc32)c1 ZINC000531164424 1026639128 /nfs/dbraw/zinc/63/91/28/1026639128.db2.gz NZMKIVXXADUGGY-FQEVSTJZSA-N 1 1 340.423 3.857 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000186438475 1026901885 /nfs/dbraw/zinc/90/18/85/1026901885.db2.gz JTYPHWYMYWUGND-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000186438475 1026901899 /nfs/dbraw/zinc/90/18/99/1026901899.db2.gz JTYPHWYMYWUGND-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501150418 1027099513 /nfs/dbraw/zinc/09/95/13/1027099513.db2.gz MPIVSGKYQNWVTE-CQSZACIVSA-N 1 1 333.432 3.824 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)[C@H]2C=C[C@H](CO)C2)c1 ZINC000347330984 1027710913 /nfs/dbraw/zinc/71/09/13/1027710913.db2.gz HXZWHAHNRKNKHR-HOTGVXAUSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)[C@H]2C=C[C@H](CO)C2)c1 ZINC000347330984 1027710926 /nfs/dbraw/zinc/71/09/26/1027710926.db2.gz HXZWHAHNRKNKHR-HOTGVXAUSA-N 1 1 344.436 3.596 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420941970 1027884016 /nfs/dbraw/zinc/88/40/16/1027884016.db2.gz GODBTWNUYPXGPV-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420941970 1027884036 /nfs/dbraw/zinc/88/40/36/1027884036.db2.gz GODBTWNUYPXGPV-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](CC(F)(F)F)C3)nc2c1 ZINC000420938268 1027891472 /nfs/dbraw/zinc/89/14/72/1027891472.db2.gz APGLWMSTLQKYPD-SNVBAGLBSA-N 1 1 343.305 3.900 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](CC(F)(F)F)C3)nc2c1 ZINC000420938268 1027891496 /nfs/dbraw/zinc/89/14/96/1027891496.db2.gz APGLWMSTLQKYPD-SNVBAGLBSA-N 1 1 343.305 3.900 20 5 EHBDMO N[C@@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915000 1028051056 /nfs/dbraw/zinc/05/10/56/1028051056.db2.gz AFEQBXDCYLHTAI-MOPGFXCFSA-N 1 1 325.412 3.652 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648909 1028111464 /nfs/dbraw/zinc/11/14/64/1028111464.db2.gz OUZKRECSXAJAKA-CZUORRHYSA-N 1 1 336.395 3.849 20 5 EHBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444650158 1028113249 /nfs/dbraw/zinc/11/32/49/1028113249.db2.gz NTJVKZQISMTLGS-UHFFFAOYSA-N 1 1 344.802 3.799 20 5 EHBDMO Cc1cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444743892 1028229011 /nfs/dbraw/zinc/22/90/11/1028229011.db2.gz NGEPAXDKRHNRDS-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](C(C)C)C1 ZINC000444749216 1028235175 /nfs/dbraw/zinc/23/51/75/1028235175.db2.gz QOPYCIOTSDTLHZ-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@H](C)c2ccccc2SC)c1[N+](=O)[O-] ZINC000894258208 1028355781 /nfs/dbraw/zinc/35/57/81/1028355781.db2.gz LYRHFRCHTYMJHF-LLVKDONJSA-N 1 1 348.424 3.882 20 5 EHBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000237228713 1028472875 /nfs/dbraw/zinc/47/28/75/1028472875.db2.gz CGOKNVUKITZUFL-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293743367 1028551585 /nfs/dbraw/zinc/55/15/85/1028551585.db2.gz VZJTUPPDWVQBRY-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000293743367 1028551600 /nfs/dbraw/zinc/55/16/00/1028551600.db2.gz VZJTUPPDWVQBRY-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO C[C@H]1CC[C@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429593000 1028882786 /nfs/dbraw/zinc/88/27/86/1028882786.db2.gz RHUGFYJFCTXPGQ-ZFWWWQNUSA-N 1 1 329.400 3.913 20 5 EHBDMO Cc1ccccc1[C@H](C)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532930526 1029057298 /nfs/dbraw/zinc/05/72/98/1029057298.db2.gz WWQACEZVUNBBBS-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccccc1[C@H](C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532930526 1029057317 /nfs/dbraw/zinc/05/73/17/1029057317.db2.gz WWQACEZVUNBBBS-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000532970068 1029119521 /nfs/dbraw/zinc/11/95/21/1029119521.db2.gz UKWAFLRJDVOPSI-AWEZNQCLSA-N 1 1 339.823 3.697 20 5 EHBDMO O=C(C[N@@H+](CC1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000532955036 1029121994 /nfs/dbraw/zinc/12/19/94/1029121994.db2.gz OSYXTCFKXVMIEX-UHFFFAOYSA-N 1 1 331.416 3.578 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC4(CCCC4)C3)n2)cc1 ZINC000615000609 1029213220 /nfs/dbraw/zinc/21/32/20/1029213220.db2.gz JFTPDDPYDZWCJA-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC(C)(C)C1 ZINC000446075583 1029391895 /nfs/dbraw/zinc/39/18/95/1029391895.db2.gz ZONLGULYEGXGSR-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192492635 1029708778 /nfs/dbraw/zinc/70/87/78/1029708778.db2.gz GGZIGXVNTFJLLM-CYBMUJFWSA-N 1 1 338.477 3.532 20 5 EHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446715755 1029768720 /nfs/dbraw/zinc/76/87/20/1029768720.db2.gz FDWDGULNQNHVQD-LJQANCHMSA-N 1 1 337.379 3.900 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000533820159 1029879693 /nfs/dbraw/zinc/87/96/93/1029879693.db2.gz UACJZUQGTUBNNV-CQSZACIVSA-N 1 1 349.337 3.795 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000525636776 1029988014 /nfs/dbraw/zinc/98/80/14/1029988014.db2.gz LJVIFZZPLRZQQS-QGZVFWFLSA-N 1 1 326.396 3.538 20 5 EHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453349653 1030137670 /nfs/dbraw/zinc/13/76/70/1030137670.db2.gz LTFLPXGZUFUELY-BLLLJJGKSA-N 1 1 328.416 3.884 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCOc1ccccc1F)C1CC1 ZINC000441265663 1030215184 /nfs/dbraw/zinc/21/51/84/1030215184.db2.gz SFULNNLESSIWPB-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCOc1ccccc1F)C1CC1 ZINC000441265663 1030215202 /nfs/dbraw/zinc/21/52/02/1030215202.db2.gz SFULNNLESSIWPB-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453441177 1030259659 /nfs/dbraw/zinc/25/96/59/1030259659.db2.gz MVOJNVOGVFRGOT-YQVWRLOYSA-N 1 1 342.443 3.832 20 5 EHBDMO CC(C)[C@@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+]1CCCC1 ZINC000583604380 1030266203 /nfs/dbraw/zinc/26/62/03/1030266203.db2.gz MWXQUWDIQZVKFA-RBUKOAKNSA-N 1 1 331.460 3.682 20 5 EHBDMO COC(=O)c1ccc(Cl)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000482439923 1030419217 /nfs/dbraw/zinc/41/92/17/1030419217.db2.gz PJSGLUUMGXISFF-UHFFFAOYSA-N 1 1 348.786 3.633 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCCOc1ccccc1)C2 ZINC000527116961 1030662908 /nfs/dbraw/zinc/66/29/08/1030662908.db2.gz NPDGGGXOWCBWHX-UHFFFAOYSA-N 1 1 326.396 3.812 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881636 1030787793 /nfs/dbraw/zinc/78/77/93/1030787793.db2.gz DQYMNIKSRBDWAP-LLVKDONJSA-N 1 1 327.812 3.555 20 5 EHBDMO C[C@@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@H+]1C ZINC000343436000 1030868059 /nfs/dbraw/zinc/86/80/59/1030868059.db2.gz LJGSGCBFLROKBB-AUUYWEPGSA-N 1 1 333.435 3.601 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026207664 1031000345 /nfs/dbraw/zinc/00/03/45/1031000345.db2.gz MPETWIJSCVZCBP-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO CC[C@H](N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807234 1031342227 /nfs/dbraw/zinc/34/22/27/1031342227.db2.gz LZSWMABKDKUVPZ-HKUYNNGSSA-N 1 1 331.460 3.900 20 5 EHBDMO CC[C@H]([NH2+][C@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807234 1031342238 /nfs/dbraw/zinc/34/22/38/1031342238.db2.gz LZSWMABKDKUVPZ-HKUYNNGSSA-N 1 1 331.460 3.900 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721012 1031529962 /nfs/dbraw/zinc/52/99/62/1031529962.db2.gz ZQTCPRFYHHFFOQ-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO COCc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000179233646 1033493620 /nfs/dbraw/zinc/49/36/20/1033493620.db2.gz LKNPZAUYJDUWKT-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289203 1033500098 /nfs/dbraw/zinc/50/00/98/1033500098.db2.gz DHUDKSQQBDRODN-UHFFFAOYSA-N 1 1 344.440 3.837 20 5 EHBDMO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595015905 1033609639 /nfs/dbraw/zinc/60/96/39/1033609639.db2.gz VYPQFFFXAKBPHF-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599058116 1033698686 /nfs/dbraw/zinc/69/86/86/1033698686.db2.gz REFXUFPBAQFOMR-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595289831 1033728819 /nfs/dbraw/zinc/72/88/19/1033728819.db2.gz UUYBICORKVKLOI-OAHLLOKOSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595289831 1033728835 /nfs/dbraw/zinc/72/88/35/1033728835.db2.gz UUYBICORKVKLOI-OAHLLOKOSA-N 1 1 331.372 3.627 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000595351751 1033776338 /nfs/dbraw/zinc/77/63/38/1033776338.db2.gz NRIJTCDZSHPPRJ-INIZCTEOSA-N 1 1 329.400 3.879 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599164702 1033779948 /nfs/dbraw/zinc/77/99/48/1033779948.db2.gz KDAZBASUXXDAEY-HNNXBMFYSA-N 1 1 331.416 3.616 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834320 1033958877 /nfs/dbraw/zinc/95/88/77/1033958877.db2.gz QNUWPUOEJHIVET-CJNGLKHVSA-N 1 1 326.400 3.634 20 5 EHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000603854801 1033979370 /nfs/dbraw/zinc/97/93/70/1033979370.db2.gz LENOZZXKJQPQKR-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000603854801 1033979383 /nfs/dbraw/zinc/97/93/83/1033979383.db2.gz LENOZZXKJQPQKR-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(C)cc1C ZINC000603894826 1034015268 /nfs/dbraw/zinc/01/52/68/1034015268.db2.gz VDJYZFDGZJOBMM-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594354 1034034558 /nfs/dbraw/zinc/03/45/58/1034034558.db2.gz GGPISTBYGQZJIB-CPUCHLNUSA-N 1 1 348.443 3.956 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080909 1034073549 /nfs/dbraw/zinc/07/35/49/1034073549.db2.gz PMGOPXZSZYGHPK-CYBMUJFWSA-N 1 1 342.399 3.813 20 5 EHBDMO COc1cc(NCCCCn2cc[nH+]c2C)c(Cl)cc1[N+](=O)[O-] ZINC000596147106 1034091697 /nfs/dbraw/zinc/09/16/97/1034091697.db2.gz SSJNCDYMWUCFJS-UHFFFAOYSA-N 1 1 338.795 3.654 20 5 EHBDMO C[C@@H]1[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1(C)C ZINC000537624167 1034260991 /nfs/dbraw/zinc/26/09/91/1034260991.db2.gz RWTUPPGNMRGOLB-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1(C)C ZINC000537624167 1034261004 /nfs/dbraw/zinc/26/10/04/1034261004.db2.gz RWTUPPGNMRGOLB-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413041 1034298953 /nfs/dbraw/zinc/29/89/53/1034298953.db2.gz SKMDWINSCADWGZ-RDTXWAMCSA-N 1 1 345.443 3.569 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000604484499 1034387747 /nfs/dbraw/zinc/38/77/47/1034387747.db2.gz XTIZHPBZDJBEGL-INIZCTEOSA-N 1 1 328.368 3.516 20 5 EHBDMO CC[N@@H+](CCCNC(=O)c1cccc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000593252378 1034476784 /nfs/dbraw/zinc/47/67/84/1034476784.db2.gz YDHDUAGXVXUSQC-UHFFFAOYSA-N 1 1 347.459 3.678 20 5 EHBDMO COCC[C@@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928394 1034900797 /nfs/dbraw/zinc/90/07/97/1034900797.db2.gz QBLXSTUKZZYGEG-IBGZPJMESA-N 1 1 328.412 3.847 20 5 EHBDMO Cc1ccnc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338235 1035523745 /nfs/dbraw/zinc/52/37/45/1035523745.db2.gz LUXLRCNWWDHECX-CJNGLKHVSA-N 1 1 346.456 3.855 20 5 EHBDMO CN(C)c1cccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000534840826 1035688573 /nfs/dbraw/zinc/68/85/73/1035688573.db2.gz GOUJODKZPDNHEY-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000534840826 1035688584 /nfs/dbraw/zinc/68/85/84/1035688584.db2.gz GOUJODKZPDNHEY-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC2CCN(c3cccc(C)[nH+]3)CC2)c1 ZINC000088723891 1035730306 /nfs/dbraw/zinc/73/03/06/1035730306.db2.gz ARCGFVNKHWEWQE-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000588214986 1035825176 /nfs/dbraw/zinc/82/51/76/1035825176.db2.gz WDWKSDOGXADMAB-GJZGRUSLSA-N 1 1 346.402 3.720 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](O)C1CC1 ZINC000589197041 1036304427 /nfs/dbraw/zinc/30/44/27/1036304427.db2.gz VGJGAQJHJOCOTR-INIZCTEOSA-N 1 1 332.425 3.526 20 5 EHBDMO CC[N@H+](CCOc1ccccc1OC)Cc1csc([N+](=O)[O-])c1 ZINC000595876218 1036773017 /nfs/dbraw/zinc/77/30/17/1036773017.db2.gz AXGIUKXYCOFPAZ-UHFFFAOYSA-N 1 1 336.413 3.566 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1OC)Cc1csc([N+](=O)[O-])c1 ZINC000595876218 1036773034 /nfs/dbraw/zinc/77/30/34/1036773034.db2.gz AXGIUKXYCOFPAZ-UHFFFAOYSA-N 1 1 336.413 3.566 20 5 EHBDMO CCn1c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000180418461 1036778086 /nfs/dbraw/zinc/77/80/86/1036778086.db2.gz SIHQTTXTYCCPNL-GFCCVEGCSA-N 1 1 342.374 3.954 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cccnc2OCC)cc1[N+](=O)[O-] ZINC000152838724 1036889062 /nfs/dbraw/zinc/88/90/62/1036889062.db2.gz RGOSGGLFJWPULP-ZDUSSCGKSA-N 1 1 345.399 3.638 20 5 EHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169927 1036916936 /nfs/dbraw/zinc/91/69/36/1036916936.db2.gz VLZICBROBABZKZ-SCLBCKFNSA-N 1 1 349.406 3.575 20 5 EHBDMO Cc1ccn2cc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000278805566 1037227895 /nfs/dbraw/zinc/22/78/95/1037227895.db2.gz RNHDIJNCTHMPAA-SFHVURJKSA-N 1 1 336.395 3.718 20 5 EHBDMO CC[C@@H](O)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850729 1037280777 /nfs/dbraw/zinc/28/07/77/1037280777.db2.gz OVBWTWHPUMFJCJ-YRVHBARZSA-N 1 1 340.423 3.881 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000386376619 1037319006 /nfs/dbraw/zinc/31/90/06/1037319006.db2.gz SONDOXPHDAAXQS-KRWDZBQOSA-N 1 1 340.427 3.704 20 5 EHBDMO CN(C)c1nc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000591348051 1037369134 /nfs/dbraw/zinc/36/91/34/1037369134.db2.gz 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346.402 3.753 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@@H]1O ZINC000555420387 1040556878 /nfs/dbraw/zinc/55/68/78/1040556878.db2.gz GXVWRWVKWOIUED-NHYWBVRUSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600198325 1040817939 /nfs/dbraw/zinc/81/79/39/1040817939.db2.gz WMOWPLBDTPRTQR-GOEBONIOSA-N 1 1 348.443 3.703 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)c(Cl)c1 ZINC000600213456 1040834410 /nfs/dbraw/zinc/83/44/10/1040834410.db2.gz GESTWNZQBMORMP-CYBMUJFWSA-N 1 1 332.787 3.943 20 5 EHBDMO O=[N+]([O-])c1ccc(S[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000425289225 1041098097 /nfs/dbraw/zinc/09/80/97/1041098097.db2.gz ZCYUOCBMWBBVOP-INIZCTEOSA-N 1 1 329.425 3.747 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1 ZINC000150062049 1041108359 /nfs/dbraw/zinc/10/83/59/1041108359.db2.gz ZHQICSHGJHCXHA-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2n[nH]cc2c1 ZINC000513022619 1041396104 /nfs/dbraw/zinc/39/61/04/1041396104.db2.gz WIODFPZCMILGOG-JTQLQIEISA-N 1 1 330.775 3.975 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000511881138 1041846131 /nfs/dbraw/zinc/84/61/31/1041846131.db2.gz YVIVGZIVKGBHAZ-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000511881138 1041846137 /nfs/dbraw/zinc/84/61/37/1041846137.db2.gz YVIVGZIVKGBHAZ-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1csc(Br)c1 ZINC000048068864 1042275644 /nfs/dbraw/zinc/27/56/44/1042275644.db2.gz XDBMAHLCYWIBKA-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO COc1ccccc1CCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541872387 1042758539 /nfs/dbraw/zinc/75/85/39/1042758539.db2.gz RHQZIUHCCTUWQG-UHFFFAOYSA-N 1 1 326.396 3.594 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1Cl ZINC000069222469 1042798917 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345.468 3.849 20 5 EHBDMO C[C@H]1CC[N@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225228 1127723289 /nfs/dbraw/zinc/72/32/89/1127723289.db2.gz DXQIURAFJTZACS-AWEZNQCLSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225228 1127723294 /nfs/dbraw/zinc/72/32/94/1127723294.db2.gz DXQIURAFJTZACS-AWEZNQCLSA-N 1 1 345.468 3.849 20 5 EHBDMO COc1cc(NC[C@@H](C)[N@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301340984 1127738240 /nfs/dbraw/zinc/73/82/40/1127738240.db2.gz FQLRPFOXRQGIQL-GFCCVEGCSA-N 1 1 347.440 3.524 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000091080481 1128445814 /nfs/dbraw/zinc/44/58/14/1128445814.db2.gz JKNSKHPVHJHOQZ-KRWDZBQOSA-N 1 1 344.415 3.541 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301572544 1128499210 /nfs/dbraw/zinc/49/92/10/1128499210.db2.gz YSJKTOHZIMEZHZ-RDJZCZTQSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Cl)cc2n1C ZINC000091372560 1128653950 /nfs/dbraw/zinc/65/39/50/1128653950.db2.gz VYGRDWYRSYUXEJ-NSHDSACASA-N 1 1 344.802 3.986 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCCC[N@@H+]2CC)cc1[N+](=O)[O-] ZINC000153723587 1128655164 /nfs/dbraw/zinc/65/51/64/1128655164.db2.gz JAKUJWWHJAJSBM-HOCLYGCPSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000153723587 1128655166 /nfs/dbraw/zinc/65/51/66/1128655166.db2.gz JAKUJWWHJAJSBM-HOCLYGCPSA-N 1 1 335.448 3.519 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000265739033 1128731904 /nfs/dbraw/zinc/73/19/04/1128731904.db2.gz DLCWOCOPMQPYAZ-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542929863 1128856129 /nfs/dbraw/zinc/85/61/29/1128856129.db2.gz GYBBSAGJJOBKQV-CQSZACIVSA-N 1 1 325.840 3.554 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(O)(c3ccccc3Cl)CC2)c1 ZINC000193141480 1120934824 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1133155374 /nfs/dbraw/zinc/15/53/74/1133155374.db2.gz OCMHGKBYLOKVAI-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO CC[C@@H](CSC)[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774640340 1133815365 /nfs/dbraw/zinc/81/53/65/1133815365.db2.gz RDBITTDCCDSFMF-NSHDSACASA-N 1 1 342.852 3.629 20 5 EHBDMO CC[C@H](C[N@@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000774708672 1133891343 /nfs/dbraw/zinc/89/13/43/1133891343.db2.gz YSUHSFPNLLRTKL-MRXNPFEDSA-N 1 1 330.432 3.881 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746663010 1133974826 /nfs/dbraw/zinc/97/48/26/1133974826.db2.gz KSZTYLKIVUECOB-UHFFFAOYSA-N 1 1 325.840 3.554 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001185565154 1134107217 /nfs/dbraw/zinc/10/72/17/1134107217.db2.gz ISLJTFBYVJEQHO-MRXNPFEDSA-N 1 1 340.427 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1F ZINC000788484245 1134138185 /nfs/dbraw/zinc/13/81/85/1134138185.db2.gz YJZABBQNAQDPCN-OAHLLOKOSA-N 1 1 344.342 3.800 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1F ZINC000788484245 1134138189 /nfs/dbraw/zinc/13/81/89/1134138189.db2.gz YJZABBQNAQDPCN-OAHLLOKOSA-N 1 1 344.342 3.800 20 5 EHBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788566209 1134145823 /nfs/dbraw/zinc/14/58/23/1134145823.db2.gz ZDDHYDRRLIPUHL-CYBMUJFWSA-N 1 1 344.415 3.602 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CC(C)C)C2CCCC2)c1 ZINC001190571890 1134719563 /nfs/dbraw/zinc/71/95/63/1134719563.db2.gz QYIJYHWBTZPQFS-UHFFFAOYSA-N 1 1 334.416 3.782 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329564 1134749189 /nfs/dbraw/zinc/74/91/89/1134749189.db2.gz RMAHSEWKPYDGIL-SJKOYZFVSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329564 1134749194 /nfs/dbraw/zinc/74/91/94/1134749194.db2.gz RMAHSEWKPYDGIL-SJKOYZFVSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329563 1134749374 /nfs/dbraw/zinc/74/93/74/1134749374.db2.gz RMAHSEWKPYDGIL-SJCJKPOMSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329563 1134749378 /nfs/dbraw/zinc/74/93/78/1134749378.db2.gz RMAHSEWKPYDGIL-SJCJKPOMSA-N 1 1 345.399 3.668 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC001191075713 1134788409 /nfs/dbraw/zinc/78/84/09/1134788409.db2.gz CLXJFNCSLIKQJW-WWGRRREGSA-N 1 1 332.400 3.534 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792909801 1134822662 /nfs/dbraw/zinc/82/26/62/1134822662.db2.gz OZJDRHWDGDUFFF-KGLIPLIRSA-N 1 1 345.226 3.619 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789196 1134923876 /nfs/dbraw/zinc/92/38/76/1134923876.db2.gz GKABKYFLPKOGBC-WMLDXEAASA-N 1 1 333.432 3.742 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001194101955 1135232973 /nfs/dbraw/zinc/23/29/73/1135232973.db2.gz SSHWULMHTFZTQC-KRWDZBQOSA-N 1 1 348.830 3.938 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001194101955 1135232980 /nfs/dbraw/zinc/23/29/80/1135232980.db2.gz SSHWULMHTFZTQC-KRWDZBQOSA-N 1 1 348.830 3.938 20 5 EHBDMO C[C@]1(C2CCCCC2)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001197238023 1135663973 /nfs/dbraw/zinc/66/39/73/1135663973.db2.gz CQLCQDPPPVFUCT-GOSISDBHSA-N 1 1 331.416 3.578 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700320 1135869089 /nfs/dbraw/zinc/86/90/89/1135869089.db2.gz CPTYFTGQFHIUPE-OCCSQVGLSA-N 1 1 326.824 3.764 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H](CO)C(C)(C)C ZINC000809966024 1135904377 /nfs/dbraw/zinc/90/43/77/1135904377.db2.gz UCTCXOAEQXPYSX-LBPRGKRZSA-N 1 1 335.231 3.740 20 5 EHBDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809981122 1135908428 /nfs/dbraw/zinc/90/84/28/1135908428.db2.gz ZRUFPCGUEGSEGJ-LBPRGKRZSA-N 1 1 335.231 3.740 20 5 EHBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000810618308 1135980969 /nfs/dbraw/zinc/98/09/69/1135980969.db2.gz DKPDVZALINCQMQ-GFCCVEGCSA-N 1 1 345.399 3.643 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccnc(Cl)c1Cl ZINC000811501849 1136100528 /nfs/dbraw/zinc/10/05/28/1136100528.db2.gz AAMHZMONJOPNIF-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccnc(Cl)c1Cl ZINC000811501849 1136100530 /nfs/dbraw/zinc/10/05/30/1136100530.db2.gz AAMHZMONJOPNIF-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](Cc2ccccc2)CC2CCC2)cc1 ZINC000776275053 1136129262 /nfs/dbraw/zinc/12/92/62/1136129262.db2.gz FVHQKPVRPOBJFF-FQEVSTJZSA-N 1 1 340.423 3.931 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000776279803 1136133845 /nfs/dbraw/zinc/13/38/45/1136133845.db2.gz XZQHMGCUIUITKC-SFHVURJKSA-N 1 1 342.351 3.517 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849005 1136260812 /nfs/dbraw/zinc/26/08/12/1136260812.db2.gz NSPWHADXAJSQLL-AUUYWEPGSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000776583343 1136441933 /nfs/dbraw/zinc/44/19/33/1136441933.db2.gz DNXJTSNBXZBCOU-IAGOWNOFSA-N 1 1 330.384 3.839 20 5 EHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585277 1136442617 /nfs/dbraw/zinc/44/26/17/1136442617.db2.gz SXEMQMUQDHNZJK-ACWOFJMJSA-N 1 1 344.386 3.645 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000814909698 1136523640 /nfs/dbraw/zinc/52/36/40/1136523640.db2.gz PJALSZQRMZKFCN-HNNXBMFYSA-N 1 1 344.242 3.824 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1[N+](=O)[O-] ZINC000844439015 1137223009 /nfs/dbraw/zinc/22/30/09/1137223009.db2.gz HKAZSTVOMRKYCA-OAHLLOKOSA-N 1 1 326.343 3.615 20 5 EHBDMO Cc1c(C[NH2+]Cc2ccc(OC(F)F)cc2F)cccc1[N+](=O)[O-] ZINC000865543216 1137293536 /nfs/dbraw/zinc/29/35/36/1137293536.db2.gz VNHPEBQKBGUGOJ-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865576389 1137296452 /nfs/dbraw/zinc/29/64/52/1137296452.db2.gz LDKVOAJMPVUPLL-ZDUSSCGKSA-N 1 1 339.386 3.701 20 5 EHBDMO CCOc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(F)cc1OC ZINC000865787488 1137312040 /nfs/dbraw/zinc/31/20/40/1137312040.db2.gz ODSAAEFMRIGHAZ-UHFFFAOYSA-N 1 1 348.374 3.739 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)c1c[nH]cn1 ZINC001147252614 1137402475 /nfs/dbraw/zinc/40/24/75/1137402475.db2.gz JCWDLHHKMISBIH-UHFFFAOYSA-N 1 1 345.406 3.738 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023198 1137565404 /nfs/dbraw/zinc/56/54/04/1137565404.db2.gz CZRCRVJCVPEKQF-ZIAGYGMSSA-N 1 1 337.489 3.699 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CCO)c1ccco1 ZINC000872062538 1137568995 /nfs/dbraw/zinc/56/89/95/1137568995.db2.gz IDMZOFCWWIKYSX-SMDDNHRTSA-N 1 1 336.413 3.684 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872275580 1137577190 /nfs/dbraw/zinc/57/71/90/1137577190.db2.gz HTXCNZVTDKQIDF-KRWDZBQOSA-N 1 1 334.416 3.527 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(C(F)(F)F)nc1 ZINC000873185698 1137593136 /nfs/dbraw/zinc/59/31/36/1137593136.db2.gz PSVLGEQYQRASJS-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000877797519 1137690198 /nfs/dbraw/zinc/69/01/98/1137690198.db2.gz WGRMGYJVAMTLQV-OAHLLOKOSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@H]([NH2+][C@H]1c2ccccc2CC[C@@H]1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883376760 1137858124 /nfs/dbraw/zinc/85/81/24/1137858124.db2.gz SJGFSBXFASNPQY-GYOIFBIXSA-N 1 1 329.375 3.853 20 5 EHBDMO C[C@H](NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708409 1137917869 /nfs/dbraw/zinc/91/78/69/1137917869.db2.gz BWGDENVWHVUCBW-KSSFIOAISA-N 1 1 345.443 3.569 20 5 EHBDMO CCCOc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1OC ZINC000886106818 1138047318 /nfs/dbraw/zinc/04/73/18/1138047318.db2.gz DLIADILWJLQLPA-CYBMUJFWSA-N 1 1 345.399 3.638 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@@H]1CCc2cccnc21 ZINC000886651858 1138107447 /nfs/dbraw/zinc/10/74/47/1138107447.db2.gz UCOMFDCGJVPEAA-CYBMUJFWSA-N 1 1 348.200 3.529 20 5 EHBDMO CC[C@H]1C[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000072862148 1138108658 /nfs/dbraw/zinc/10/86/58/1138108658.db2.gz ROWMOXKRFSTZEG-FZMZJTMJSA-N 1 1 348.428 3.533 20 5 EHBDMO CC[C@H]1C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCS1 ZINC000072862148 1138108660 /nfs/dbraw/zinc/10/86/60/1138108660.db2.gz ROWMOXKRFSTZEG-FZMZJTMJSA-N 1 1 348.428 3.533 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000886818579 1138148739 /nfs/dbraw/zinc/14/87/39/1138148739.db2.gz HEXBYZWSLIVAKH-IINYFYTJSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000886818579 1138148740 /nfs/dbraw/zinc/14/87/40/1138148740.db2.gz HEXBYZWSLIVAKH-IINYFYTJSA-N 1 1 345.226 3.903 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000124729189 1138293752 /nfs/dbraw/zinc/29/37/52/1138293752.db2.gz RGDXIMALXZBQFY-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758601 1138421234 /nfs/dbraw/zinc/42/12/34/1138421234.db2.gz VOSRONDVTTYQQS-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758601 1138421237 /nfs/dbraw/zinc/42/12/37/1138421237.db2.gz VOSRONDVTTYQQS-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO Cc1cc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000336941633 1138431529 /nfs/dbraw/zinc/43/15/29/1138431529.db2.gz YNMCMMZPANCMGQ-OAHLLOKOSA-N 1 1 340.427 3.820 20 5 EHBDMO C[N@H+](Cc1ccc2c(c1)COC(C)(C)O2)Cc1ccccc1[N+](=O)[O-] ZINC000186619214 1140213600 /nfs/dbraw/zinc/21/36/00/1140213600.db2.gz LVZVMCYQALCGHT-UHFFFAOYSA-N 1 1 342.395 3.872 20 5 EHBDMO C[N@@H+](Cc1ccc2c(c1)COC(C)(C)O2)Cc1ccccc1[N+](=O)[O-] ZINC000186619214 1140213604 /nfs/dbraw/zinc/21/36/04/1140213604.db2.gz LVZVMCYQALCGHT-UHFFFAOYSA-N 1 1 342.395 3.872 20 5 EHBDMO C[C@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192460164 1140534292 /nfs/dbraw/zinc/53/42/92/1140534292.db2.gz BFEMBQSIUVIRLB-ZFWWWQNUSA-N 1 1 346.456 3.541 20 5 EHBDMO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000268849014 1141008681 /nfs/dbraw/zinc/00/86/81/1141008681.db2.gz ORHQYZXQLNJPMM-BBRMVZONSA-N 1 1 343.431 3.715 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000183163812 1125463707 /nfs/dbraw/zinc/46/37/07/1125463707.db2.gz FGMSOXGTQVYRCN-CYBMUJFWSA-N 1 1 340.358 3.770 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000430216300 1015040699 /nfs/dbraw/zinc/04/06/99/1015040699.db2.gz FCZXOWMJYURMRP-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1nc(C)cc(C)c1[N+](=O)[O-] ZINC000339967836 1016085168 /nfs/dbraw/zinc/08/51/68/1016085168.db2.gz LNKRURDNKTVVMM-UHFFFAOYSA-N 1 1 337.383 3.713 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432159 1016241667 /nfs/dbraw/zinc/24/16/67/1016241667.db2.gz RDKJEEDLWGEHKI-STQMWFEESA-N 1 1 336.823 3.569 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCOCC2)[C@@H]1C(C)C ZINC000414526633 1016954231 /nfs/dbraw/zinc/95/42/31/1016954231.db2.gz LLHGRXDTXZQQQL-SFHVURJKSA-N 1 1 348.443 3.631 20 5 EHBDMO C[C@H](NCCC[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901070 1032652729 /nfs/dbraw/zinc/65/27/29/1032652729.db2.gz AUKFHQQVZZOJLD-ZDUSSCGKSA-N 1 1 333.457 3.926 20 5 EHBDMO C[C@H]([NH2+]CCCN(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901070 1032652733 /nfs/dbraw/zinc/65/27/33/1032652733.db2.gz AUKFHQQVZZOJLD-ZDUSSCGKSA-N 1 1 333.457 3.926 20 5 EHBDMO Cc1cc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610281961 1017614172 /nfs/dbraw/zinc/61/41/72/1017614172.db2.gz MKQYVOBZIOYWDA-GOSISDBHSA-N 1 1 325.412 3.614 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022473 1017779259 /nfs/dbraw/zinc/77/92/59/1017779259.db2.gz ZXMMVFXIQQVCLL-JTQLQIEISA-N 1 1 332.347 3.683 20 5 EHBDMO C[C@]1(CNc2ncc([N+](=O)[O-])s2)CCC[N@H+]1Cc1ccccc1 ZINC000336943109 1018000203 /nfs/dbraw/zinc/00/02/03/1018000203.db2.gz ZYFIVQNCDMLZCD-MRXNPFEDSA-N 1 1 332.429 3.518 20 5 EHBDMO C[N@@H+](CCCn1ccnc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290397733 1018583662 /nfs/dbraw/zinc/58/36/62/1018583662.db2.gz JFOKOEZGYGUYKL-UHFFFAOYSA-N 1 1 340.383 3.573 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432140713 1019017371 /nfs/dbraw/zinc/01/73/71/1019017371.db2.gz REWGZXLEEVUURT-UHFFFAOYSA-N 1 1 347.802 3.999 20 5 EHBDMO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000536638046 1019216721 /nfs/dbraw/zinc/21/67/21/1019216721.db2.gz SXEBRCZPUKCHCQ-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000536638046 1019216732 /nfs/dbraw/zinc/21/67/32/1019216732.db2.gz SXEBRCZPUKCHCQ-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427640 1032817127 /nfs/dbraw/zinc/81/71/27/1032817127.db2.gz LTBKCWBPURVAGN-SUMWQHHRSA-N 1 1 345.468 3.883 20 5 EHBDMO CCC(=O)c1ccc(NCCCCn2cc[nH+]c2C)c([N+](=O)[O-])c1 ZINC000280163337 1020143118 /nfs/dbraw/zinc/14/31/18/1020143118.db2.gz CDKSKIHVFKHQRA-UHFFFAOYSA-N 1 1 330.388 3.585 20 5 EHBDMO C[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000177954052 1020586799 /nfs/dbraw/zinc/58/67/99/1020586799.db2.gz KIWLGJJSRYGTLZ-NSHDSACASA-N 1 1 328.397 3.897 20 5 EHBDMO CC(C)N(C)c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000348670263 1021046565 /nfs/dbraw/zinc/04/65/65/1021046565.db2.gz INCJICMSFPCOPW-UHFFFAOYSA-N 1 1 342.443 3.509 20 5 EHBDMO C[N@H+]1C[C@@H]2CCN(C(=O)c3ccc4cc5ccccc5cc4c3)[C@@H]2C1 ZINC001270141102 1021382441 /nfs/dbraw/zinc/38/24/41/1021382441.db2.gz QWEMMZBZECXKAZ-PZJWPPBQSA-N 1 1 330.431 3.769 20 5 EHBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000120878104 1021436462 /nfs/dbraw/zinc/43/64/62/1021436462.db2.gz SMIVESIBAYNJRX-CXAGYDPISA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000120878104 1021436467 /nfs/dbraw/zinc/43/64/67/1021436467.db2.gz SMIVESIBAYNJRX-CXAGYDPISA-N 1 1 332.425 3.661 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cccc3c2NCCC3)c1 ZINC000894332031 1021726724 /nfs/dbraw/zinc/72/67/24/1021726724.db2.gz MGTWOAWCSMZQHZ-UHFFFAOYSA-N 1 1 331.803 3.896 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1CCC(C)(C)CC1 ZINC000438486182 1022025681 /nfs/dbraw/zinc/02/56/81/1022025681.db2.gz OPWWYXHLHMXQEB-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000550079251 1022362418 /nfs/dbraw/zinc/36/24/18/1022362418.db2.gz KSBMYMARPMGBNT-WMLDXEAASA-N 1 1 345.443 3.742 20 5 EHBDMO CCC1(CC)CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438507904 1022745155 /nfs/dbraw/zinc/74/51/55/1022745155.db2.gz LBMBGYFPYHUHHJ-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675770 1033079457 /nfs/dbraw/zinc/07/94/57/1033079457.db2.gz NEQNHMIFNNKDIG-UWVGGRQHSA-N 1 1 343.305 3.899 20 5 EHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675770 1033079470 /nfs/dbraw/zinc/07/94/70/1033079470.db2.gz NEQNHMIFNNKDIG-UWVGGRQHSA-N 1 1 343.305 3.899 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000058933018 1033086239 /nfs/dbraw/zinc/08/62/39/1033086239.db2.gz ONAJWPBSGHYVJG-SFHVURJKSA-N 1 1 330.359 3.950 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000075740995 1033093305 /nfs/dbraw/zinc/09/33/05/1033093305.db2.gz UPNMSOQLMODUQD-HUUCEWRRSA-N 1 1 347.459 3.530 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000507159033 1023153408 /nfs/dbraw/zinc/15/34/08/1023153408.db2.gz GJFBHRXXXZAZHM-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO COCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000507158412 1023153533 /nfs/dbraw/zinc/15/35/33/1023153533.db2.gz DSFBVEDEOPQHMG-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475574 1023240027 /nfs/dbraw/zinc/24/00/27/1023240027.db2.gz XZOSWXDIZVTYQY-HOTGVXAUSA-N 1 1 349.450 3.820 20 5 EHBDMO Cc1ccccc1[C@H](C)[N@H+](Cc1c([N+](=O)[O-])ncn1C)CC(C)C ZINC000342067408 1023816522 /nfs/dbraw/zinc/81/65/22/1023816522.db2.gz SITALTKDSACGOS-HNNXBMFYSA-N 1 1 330.432 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000065202258 1023891474 /nfs/dbraw/zinc/89/14/74/1023891474.db2.gz PGYYOFYOGWMALW-KRWDZBQOSA-N 1 1 325.412 3.919 20 5 EHBDMO CCOc1ccccc1C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065223094 1023986077 /nfs/dbraw/zinc/98/60/77/1023986077.db2.gz FAVGFJWRCLQEDN-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CO[C@H](C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000514078273 1024109512 /nfs/dbraw/zinc/10/95/12/1024109512.db2.gz IRMHRCOOWJIESN-GOSISDBHSA-N 1 1 346.814 3.994 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000320358383 1024322877 /nfs/dbraw/zinc/32/28/77/1024322877.db2.gz MIQUXUDRGXVUBY-LLVKDONJSA-N 1 1 331.338 3.756 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000430112698 1024380576 /nfs/dbraw/zinc/38/05/76/1024380576.db2.gz DZMVXDRVKUWYJT-AWFASNGWSA-N 1 1 343.471 3.660 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@H](c3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000602857679 1033213020 /nfs/dbraw/zinc/21/30/20/1033213020.db2.gz XQFWKZAIVHONFC-AWEZNQCLSA-N 1 1 345.374 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H](c3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000602857679 1033213033 /nfs/dbraw/zinc/21/30/33/1033213033.db2.gz XQFWKZAIVHONFC-AWEZNQCLSA-N 1 1 345.374 3.517 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000602857680 1033212020 /nfs/dbraw/zinc/21/20/20/1033212020.db2.gz XQFWKZAIVHONFC-CQSZACIVSA-N 1 1 345.374 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])cc1F ZINC000602857680 1033212029 /nfs/dbraw/zinc/21/20/29/1033212029.db2.gz XQFWKZAIVHONFC-CQSZACIVSA-N 1 1 345.374 3.517 20 5 EHBDMO C/C(=C/c1ccccc1)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737319 1024499530 /nfs/dbraw/zinc/49/95/30/1024499530.db2.gz VVQCPKXQVUSWFV-JBXOJTMHSA-N 1 1 338.411 3.580 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957237 1024526072 /nfs/dbraw/zinc/52/60/72/1024526072.db2.gz ZMKBBUVSXQAOEL-DOMZBBRYSA-N 1 1 346.818 3.891 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844726 1033220614 /nfs/dbraw/zinc/22/06/14/1033220614.db2.gz FAPVENFJJXLWGD-INIZCTEOSA-N 1 1 340.427 3.572 20 5 EHBDMO C[NH2+]C[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372024 1024855933 /nfs/dbraw/zinc/85/59/33/1024855933.db2.gz QEOLQUWUJLBKJC-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3cccnc3s2)cc1[N+](=O)[O-] ZINC000342319783 1024858508 /nfs/dbraw/zinc/85/85/08/1024858508.db2.gz FKUCRDMQADLPQK-LLVKDONJSA-N 1 1 328.397 3.759 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000185438483 1025075273 /nfs/dbraw/zinc/07/52/73/1025075273.db2.gz UJIPHRYRKCZJAY-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1F ZINC000895147182 1025096779 /nfs/dbraw/zinc/09/67/79/1025096779.db2.gz PQGOBJHJFPKXKU-AWEZNQCLSA-N 1 1 334.347 3.689 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCc1nccs1 ZINC000157765407 1025125185 /nfs/dbraw/zinc/12/51/85/1025125185.db2.gz BSBXHHSBKOJCEL-UHFFFAOYSA-N 1 1 335.429 3.513 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCc1nccs1 ZINC000157765407 1025125192 /nfs/dbraw/zinc/12/51/92/1025125192.db2.gz BSBXHHSBKOJCEL-UHFFFAOYSA-N 1 1 335.429 3.513 20 5 EHBDMO Cc1cc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n(C)n1 ZINC000551516628 1025348035 /nfs/dbraw/zinc/34/80/35/1025348035.db2.gz UVGUAVOQFYDTAN-LJQANCHMSA-N 1 1 336.395 3.516 20 5 EHBDMO Cc1nn(C(C)C)cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000281737306 1025437294 /nfs/dbraw/zinc/43/72/94/1025437294.db2.gz VHUDELMCHFYCAU-UHFFFAOYSA-N 1 1 328.416 3.845 20 5 EHBDMO Cc1nn(C(C)C)cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000281737306 1025437301 /nfs/dbraw/zinc/43/73/01/1025437301.db2.gz VHUDELMCHFYCAU-UHFFFAOYSA-N 1 1 328.416 3.845 20 5 EHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606572 1025456160 /nfs/dbraw/zinc/45/61/60/1025456160.db2.gz CLJFPMMCJQSLOL-XJKSGUPXSA-N 1 1 329.400 3.913 20 5 EHBDMO Cc1ccccc1[C@@H]([C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1)N(C)C ZINC000443012254 1025662643 /nfs/dbraw/zinc/66/26/43/1025662643.db2.gz IQYHPLFWDOGUSL-SUMWQHHRSA-N 1 1 333.457 3.746 20 5 EHBDMO CC(C)c1ncc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000443065133 1025682892 /nfs/dbraw/zinc/68/28/92/1025682892.db2.gz HGKRHGQXJLSIQK-SOFGYWHQSA-N 1 1 326.400 3.653 20 5 EHBDMO CC(C)c1ncc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000443065133 1025682897 /nfs/dbraw/zinc/68/28/97/1025682897.db2.gz HGKRHGQXJLSIQK-SOFGYWHQSA-N 1 1 326.400 3.653 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(C(C)(C)C)CC1 ZINC000530361422 1025704355 /nfs/dbraw/zinc/70/43/55/1025704355.db2.gz LRKXHAXIVWSZQX-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000439694267 1025711946 /nfs/dbraw/zinc/71/19/46/1025711946.db2.gz VMTBQKJDWMPMFZ-GOSISDBHSA-N 1 1 339.439 3.943 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncccc1C(F)(F)F ZINC000511125550 1026269284 /nfs/dbraw/zinc/26/92/84/1026269284.db2.gz OGTJPOACGNROJT-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C2CC2)O1 ZINC000475291886 1026436682 /nfs/dbraw/zinc/43/66/82/1026436682.db2.gz QJWQXMRRUCFXRF-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C2CC2)O1 ZINC000475291886 1026436690 /nfs/dbraw/zinc/43/66/90/1026436690.db2.gz QJWQXMRRUCFXRF-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C2CC2)O1 ZINC000475282911 1026440856 /nfs/dbraw/zinc/44/08/56/1026440856.db2.gz VCOUGDBAKAQXCD-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C2CC2)O1 ZINC000475282911 1026440861 /nfs/dbraw/zinc/44/08/61/1026440861.db2.gz VCOUGDBAKAQXCD-DJJJIMSYSA-N 1 1 342.395 3.854 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375800 1026540575 /nfs/dbraw/zinc/54/05/75/1026540575.db2.gz UYKRTHWMFDLMEE-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000520058782 1026712582 /nfs/dbraw/zinc/71/25/82/1026712582.db2.gz YYTAKNUEFDFEIT-GOSISDBHSA-N 1 1 330.359 3.950 20 5 EHBDMO C[C@@H](CC[NH+](C)C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237552191 1026993701 /nfs/dbraw/zinc/99/37/01/1026993701.db2.gz JCCRKIYPHQKWIF-ZDUSSCGKSA-N 1 1 333.457 3.753 20 5 EHBDMO C[C@@H](CCN(C)C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237552191 1026993714 /nfs/dbraw/zinc/99/37/14/1026993714.db2.gz JCCRKIYPHQKWIF-ZDUSSCGKSA-N 1 1 333.457 3.753 20 5 EHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)C2)cc1OC ZINC001167602809 1027009247 /nfs/dbraw/zinc/00/92/47/1027009247.db2.gz QFMDWKXLGQLWAC-ZIAGYGMSSA-N 1 1 336.432 3.870 20 5 EHBDMO CC(C)[C@H](c1ccccc1Cl)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472247234 1027035353 /nfs/dbraw/zinc/03/53/53/1027035353.db2.gz CKRJVOTVOGVBIR-MRXNPFEDSA-N 1 1 336.823 3.774 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)CC2(O)CCCC2)cc1 ZINC000531634826 1027127971 /nfs/dbraw/zinc/12/79/71/1027127971.db2.gz VNKITZASCVRKPJ-UHFFFAOYSA-N 1 1 340.423 3.902 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCSC2(CCCCC2)C1 ZINC001167608597 1027389170 /nfs/dbraw/zinc/38/91/70/1027389170.db2.gz OJBSMNMRCMOXSI-UHFFFAOYSA-N 1 1 336.457 3.855 20 5 EHBDMO C[NH+](C)[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000783592552 1027539086 /nfs/dbraw/zinc/53/90/86/1027539086.db2.gz IMKJYSHHKSHSJV-MRXNPFEDSA-N 1 1 347.846 3.511 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C(C)(C)C ZINC000533428499 1027864766 /nfs/dbraw/zinc/86/47/66/1027864766.db2.gz VQKGHSRLEZVXDS-INIZCTEOSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ncc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1Cl ZINC000533558898 1028081224 /nfs/dbraw/zinc/08/12/24/1028081224.db2.gz YKSHNVBWAYQHSZ-UHFFFAOYSA-N 1 1 347.802 3.816 20 5 EHBDMO COc1ncc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1Cl ZINC000533558898 1028081237 /nfs/dbraw/zinc/08/12/37/1028081237.db2.gz YKSHNVBWAYQHSZ-UHFFFAOYSA-N 1 1 347.802 3.816 20 5 EHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444652905 1028113224 /nfs/dbraw/zinc/11/32/24/1028113224.db2.gz UPKVCVQLPVXKNI-IBGZPJMESA-N 1 1 336.395 3.635 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(CC(C)C)CC1 ZINC001167632817 1028125136 /nfs/dbraw/zinc/12/51/36/1028125136.db2.gz AHMNJCXONPRRDY-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000444699892 1028172193 /nfs/dbraw/zinc/17/21/93/1028172193.db2.gz FFXRMVRXKQZVPU-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000444699892 1028172206 /nfs/dbraw/zinc/17/22/06/1028172206.db2.gz FFXRMVRXKQZVPU-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2ccc(C)cc21 ZINC000178729562 1028375908 /nfs/dbraw/zinc/37/59/08/1028375908.db2.gz LANCBNIQHXYBQA-QGZVFWFLSA-N 1 1 342.395 3.915 20 5 EHBDMO COc1cccc(CCC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000446737239 1029784836 /nfs/dbraw/zinc/78/48/36/1029784836.db2.gz YXAWZMBJTBDGNN-UHFFFAOYSA-N 1 1 326.396 3.594 20 5 EHBDMO Cc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1Cl ZINC000446848050 1029817423 /nfs/dbraw/zinc/81/74/23/1029817423.db2.gz DMUNXWRYYKZUFP-UHFFFAOYSA-N 1 1 330.775 3.723 20 5 EHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525409897 1029838875 /nfs/dbraw/zinc/83/88/75/1029838875.db2.gz WRJHQJGHRPQAEU-RCCFBDPRSA-N 1 1 332.444 3.663 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1ccccn1 ZINC000035009612 1029840810 /nfs/dbraw/zinc/84/08/10/1029840810.db2.gz KIZLUHDSQRLVIN-SNVBAGLBSA-N 1 1 336.189 3.603 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](CCCc2ccccc2)C1 ZINC000441181640 1029880110 /nfs/dbraw/zinc/88/01/10/1029880110.db2.gz SQEWJVZXVMZLKH-QGZVFWFLSA-N 1 1 342.443 3.563 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441185392 1029917623 /nfs/dbraw/zinc/91/76/23/1029917623.db2.gz ZRAATVJVHHVDCU-AWEZNQCLSA-N 1 1 330.384 3.675 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2ccccc2F)c([N+](=O)[O-])c1 ZINC000441234415 1030085337 /nfs/dbraw/zinc/08/53/37/1030085337.db2.gz NTPIAGPVRRGXNB-CYBMUJFWSA-N 1 1 348.374 3.814 20 5 EHBDMO COc1cccnc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453347417 1030135146 /nfs/dbraw/zinc/13/51/46/1030135146.db2.gz CDSALRXVFVDXKB-HNNXBMFYSA-N 1 1 327.384 3.511 20 5 EHBDMO COC(=O)c1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000482081143 1030200846 /nfs/dbraw/zinc/20/08/46/1030200846.db2.gz KOHZKSYNEONSAS-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000159448815 1030203714 /nfs/dbraw/zinc/20/37/14/1030203714.db2.gz FAZQYTPBLRUVKC-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2CC[C@H](C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453405605 1030215182 /nfs/dbraw/zinc/21/51/82/1030215182.db2.gz JLWGSEAGZBVLNA-SOVGHPHASA-N 1 1 344.411 3.997 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922382 1030452179 /nfs/dbraw/zinc/45/21/79/1030452179.db2.gz OXVAKQYLEXKHSV-LJQANCHMSA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1ccc(CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922382 1030452186 /nfs/dbraw/zinc/45/21/86/1030452186.db2.gz OXVAKQYLEXKHSV-LJQANCHMSA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922382 1030452200 /nfs/dbraw/zinc/45/22/00/1030452200.db2.gz OXVAKQYLEXKHSV-LJQANCHMSA-N 1 1 339.439 3.515 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282036065 1030624907 /nfs/dbraw/zinc/62/49/07/1030624907.db2.gz WZJORGBAEQIKHU-ZDUSSCGKSA-N 1 1 344.390 3.651 20 5 EHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000026154221 1030630771 /nfs/dbraw/zinc/63/07/71/1030630771.db2.gz LHIHIRKXOXGEGW-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000448366173 1031020261 /nfs/dbraw/zinc/02/02/61/1031020261.db2.gz KPCZKMFZAOUKIJ-MRXNPFEDSA-N 1 1 332.425 3.526 20 5 EHBDMO COc1cc([C@H](C)[NH2+]Cc2cc(O)ccc2Cl)cc([N+](=O)[O-])c1 ZINC000903218537 1031292974 /nfs/dbraw/zinc/29/29/74/1031292974.db2.gz CZPKAVVUWMVXCR-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000536183625 1031351550 /nfs/dbraw/zinc/35/15/50/1031351550.db2.gz SQSBDIFZYDRUFS-HOCLYGCPSA-N 1 1 326.400 3.546 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161242912 1031426805 /nfs/dbraw/zinc/42/68/05/1031426805.db2.gz WRIXLILWBLKQTR-RISCZKNCSA-N 1 1 343.349 3.534 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803380 1031706374 /nfs/dbraw/zinc/70/63/74/1031706374.db2.gz FNMZTTLQLBFLBL-BLLLJJGKSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803380 1031706389 /nfs/dbraw/zinc/70/63/89/1031706389.db2.gz FNMZTTLQLBFLBL-BLLLJJGKSA-N 1 1 345.424 3.820 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1)CC1CC1 ZINC000537826370 1031943762 /nfs/dbraw/zinc/94/37/62/1031943762.db2.gz XSIXXYZEMQTVIJ-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000584247918 1032016901 /nfs/dbraw/zinc/01/69/01/1032016901.db2.gz RVJGHPVDMBYFEB-MRXNPFEDSA-N 1 1 330.432 3.834 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(OC)ccc2F)cc1[N+](=O)[O-] ZINC000598680020 1033379116 /nfs/dbraw/zinc/37/91/16/1033379116.db2.gz QMWMZBJCEDBJQV-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1COc2c1cccc2Cl ZINC000594497516 1033398387 /nfs/dbraw/zinc/39/83/87/1033398387.db2.gz CTYIGAYUEXHJTP-GJZGRUSLSA-N 1 1 330.771 3.959 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000026349233 1033525672 /nfs/dbraw/zinc/52/56/72/1033525672.db2.gz RNSBZVBYUHTGCH-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cccc(OC2CC2)c1F ZINC000594971913 1033578017 /nfs/dbraw/zinc/57/80/17/1033578017.db2.gz TWNAKRBOFMMGFS-UHFFFAOYSA-N 1 1 330.359 3.873 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057264 1033634931 /nfs/dbraw/zinc/63/49/31/1033634931.db2.gz VYNJIYOEZZSXNR-UKRRQHHQSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057264 1033634945 /nfs/dbraw/zinc/63/49/45/1033634945.db2.gz VYNJIYOEZZSXNR-UKRRQHHQSA-N 1 1 335.448 3.517 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000593660940 1033638183 /nfs/dbraw/zinc/63/81/83/1033638183.db2.gz SWBMHBSGQRNSQS-USXIJHARSA-N 1 1 342.443 3.832 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078562431 1033712867 /nfs/dbraw/zinc/71/28/67/1033712867.db2.gz NGACTHWTNBYZHC-LBPRGKRZSA-N 1 1 345.365 3.782 20 5 EHBDMO Cc1noc(C[N@@H+](CCc2ccc(Cl)cc2)CC2CC2)c1[N+](=O)[O-] ZINC000595320532 1033740509 /nfs/dbraw/zinc/74/05/09/1033740509.db2.gz GGQWIFWLNMYFOS-UHFFFAOYSA-N 1 1 349.818 3.999 20 5 EHBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCO2 ZINC000089512651 1033747278 /nfs/dbraw/zinc/74/72/78/1033747278.db2.gz VPVCRZKQCHUBFA-INIZCTEOSA-N 1 1 328.368 3.607 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363642 1033781709 /nfs/dbraw/zinc/78/17/09/1033781709.db2.gz FWYGDDRWLMOICJ-VBQJREDUSA-N 1 1 335.423 3.571 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@]2(C)Cc2cccc(F)c2)c1[N+](=O)[O-] ZINC000595564068 1033845189 /nfs/dbraw/zinc/84/51/89/1033845189.db2.gz WETIFXKNCLFLEQ-QGZVFWFLSA-N 1 1 333.363 3.628 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000599354546 1033888794 /nfs/dbraw/zinc/88/87/94/1033888794.db2.gz PZXWWQTYEBQODZ-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593119133 1033969704 /nfs/dbraw/zinc/96/97/04/1033969704.db2.gz UVZWEWWHKCXCFJ-LBPRGKRZSA-N 1 1 336.260 3.845 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593119133 1033969719 /nfs/dbraw/zinc/96/97/19/1033969719.db2.gz UVZWEWWHKCXCFJ-LBPRGKRZSA-N 1 1 336.260 3.845 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000603868005 1033994882 /nfs/dbraw/zinc/99/48/82/1033994882.db2.gz IHOVFOOKEXZFQA-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO COc1cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])cc1F ZINC000599573437 1034019171 /nfs/dbraw/zinc/01/91/71/1034019171.db2.gz HWYGZRPDDBOXRW-GOSISDBHSA-N 1 1 345.374 3.769 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590206 1034027714 /nfs/dbraw/zinc/02/77/14/1034027714.db2.gz VWYRBWFEUOOVTH-BBRMVZONSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610450 1034071577 /nfs/dbraw/zinc/07/15/77/1034071577.db2.gz MAWXHWOMPSNDJR-UZLBHIALSA-N 1 1 339.439 3.616 20 5 EHBDMO C[C@@H]1CCN(CC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610450 1034071599 /nfs/dbraw/zinc/07/15/99/1034071599.db2.gz MAWXHWOMPSNDJR-UZLBHIALSA-N 1 1 339.439 3.616 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000179314837 1034107000 /nfs/dbraw/zinc/10/70/00/1034107000.db2.gz BSNNCYSYBNKRHA-UHFFFAOYSA-N 1 1 336.395 3.925 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000179314837 1034107010 /nfs/dbraw/zinc/10/70/10/1034107010.db2.gz BSNNCYSYBNKRHA-UHFFFAOYSA-N 1 1 336.395 3.925 20 5 EHBDMO Cc1cc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])s1 ZINC000596225870 1034127804 /nfs/dbraw/zinc/12/78/04/1034127804.db2.gz FZPOAAXGPIEVCQ-CYBMUJFWSA-N 1 1 346.456 3.882 20 5 EHBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000596590227 1034307413 /nfs/dbraw/zinc/30/74/13/1034307413.db2.gz DPJUAROYPPDUPF-SFHVURJKSA-N 1 1 341.411 3.842 20 5 EHBDMO CC(C)C1CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000075833858 1034443965 /nfs/dbraw/zinc/44/39/65/1034443965.db2.gz WXJORLFIBFDEJL-UHFFFAOYSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210915 1034593763 /nfs/dbraw/zinc/59/37/63/1034593763.db2.gz ITTOXXHLTGWVBJ-FZKQIMNGSA-N 1 1 344.436 3.792 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000534530851 1034650270 /nfs/dbraw/zinc/65/02/70/1034650270.db2.gz READCXYWCOGFOB-SFHVURJKSA-N 1 1 334.379 3.742 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@@H](c2ccccc2F)[C@@H](C)O)cccc1[N+](=O)[O-] ZINC000581196323 1035479091 /nfs/dbraw/zinc/47/90/91/1035479091.db2.gz RTXLGSUNXNJKQH-VEVIJQCQSA-N 1 1 332.375 3.815 20 5 EHBDMO COc1cc(C[N@H+](C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000463486592 1035555014 /nfs/dbraw/zinc/55/50/14/1035555014.db2.gz IRGWMGMMSJPPQU-INIZCTEOSA-N 1 1 330.359 3.862 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000463486592 1035555027 /nfs/dbraw/zinc/55/50/27/1035555027.db2.gz IRGWMGMMSJPPQU-INIZCTEOSA-N 1 1 330.359 3.862 20 5 EHBDMO CC1(C)COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000511488953 1035634778 /nfs/dbraw/zinc/63/47/78/1035634778.db2.gz PZNJXKUHFZBMQG-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CC1(C)COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000511488953 1035634784 /nfs/dbraw/zinc/63/47/84/1035634784.db2.gz PZNJXKUHFZBMQG-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1ccccc1[C@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000541053864 1035947226 /nfs/dbraw/zinc/94/72/26/1035947226.db2.gz JBKRAAAUECICNB-SFHVURJKSA-N 1 1 344.411 3.514 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000463967293 1036015292 /nfs/dbraw/zinc/01/52/92/1036015292.db2.gz WJAGQGAEVONHBZ-HNNXBMFYSA-N 1 1 348.447 3.598 20 5 EHBDMO C[N@@H+](CCc1nccs1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180179889 1036062906 /nfs/dbraw/zinc/06/29/06/1036062906.db2.gz MNSDOJCAQYOFIN-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO CCOc1cc(CN2CCC(CCC[NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000492719395 1036213653 /nfs/dbraw/zinc/21/36/53/1036213653.db2.gz FBRLATWUOVVXCY-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000589180872 1036294322 /nfs/dbraw/zinc/29/43/22/1036294322.db2.gz LEQUIGCXBBAOKR-HNNXBMFYSA-N 1 1 335.451 3.848 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000589300213 1036328711 /nfs/dbraw/zinc/32/87/11/1036328711.db2.gz DZPLUVRBFZUSFE-JCGIZDLHSA-N 1 1 330.428 3.998 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342880 1036938041 /nfs/dbraw/zinc/93/80/41/1036938041.db2.gz QVHSOQRTDJUGPV-UHFFFAOYSA-N 1 1 347.440 3.734 20 5 EHBDMO C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135628 1037088372 /nfs/dbraw/zinc/08/83/72/1037088372.db2.gz AJQSHDVZEQQYCE-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135628 1037088390 /nfs/dbraw/zinc/08/83/90/1037088390.db2.gz AJQSHDVZEQQYCE-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H]1CC=CCC1 ZINC000542242644 1037207363 /nfs/dbraw/zinc/20/73/63/1037207363.db2.gz KOWUNHORRHGYDV-OAHLLOKOSA-N 1 1 331.416 3.520 20 5 EHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072491910 1037427888 /nfs/dbraw/zinc/42/78/88/1037427888.db2.gz QRUQBWLIZJBVBL-ZDUSSCGKSA-N 1 1 330.388 3.513 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+](C)C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462825983 1037449217 /nfs/dbraw/zinc/44/92/17/1037449217.db2.gz BMBLDALHLYUYJE-AWEZNQCLSA-N 1 1 346.452 3.867 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nccn1CC(F)(F)F ZINC000532497841 1037542819 /nfs/dbraw/zinc/54/28/19/1037542819.db2.gz SWZIZPPYSCZTIS-NSHDSACASA-N 1 1 342.321 3.513 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)cc2F)cc1[N+](=O)[O-] ZINC000540155642 1037630716 /nfs/dbraw/zinc/63/07/16/1037630716.db2.gz HANURBCHSIRVBX-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592529433 1038029430 /nfs/dbraw/zinc/02/94/30/1038029430.db2.gz ZIRDBJVHHPMVQO-IZNAZMGOSA-N 1 1 330.428 3.889 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000058528205 1038076592 /nfs/dbraw/zinc/07/65/92/1038076592.db2.gz LDQQYQWXGQBREN-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000492205302 1038123425 /nfs/dbraw/zinc/12/34/25/1038123425.db2.gz APHZQQGACXFZFE-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)[nH]n1 ZINC000492205302 1038123436 /nfs/dbraw/zinc/12/34/36/1038123436.db2.gz APHZQQGACXFZFE-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1ccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731434 1038497758 /nfs/dbraw/zinc/49/77/58/1038497758.db2.gz KKOWYLPPPZNHNW-IBGZPJMESA-N 1 1 340.423 3.775 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](C4CC4)C3)cs2)c1 ZINC000538752999 1038517863 /nfs/dbraw/zinc/51/78/63/1038517863.db2.gz BXWZMEFSVFSRCO-CQSZACIVSA-N 1 1 329.425 3.950 20 5 EHBDMO Cc1cc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)ccc1[N+](=O)[O-] ZINC000378527565 1038701576 /nfs/dbraw/zinc/70/15/76/1038701576.db2.gz VUNUVVZMSGYUIU-UHFFFAOYSA-N 1 1 337.379 3.634 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccc(F)cc1 ZINC000041888290 1038789242 /nfs/dbraw/zinc/78/92/42/1038789242.db2.gz QAEQWFSUCHMVHW-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000026854057 1039191156 /nfs/dbraw/zinc/19/11/56/1039191156.db2.gz GDSKISHTZZTMFW-CYBMUJFWSA-N 1 1 328.368 3.559 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000488587557 1039288314 /nfs/dbraw/zinc/28/83/14/1039288314.db2.gz PSHNWRIKIOULOJ-ZDUSSCGKSA-N 1 1 328.368 3.907 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000051454706 1039292940 /nfs/dbraw/zinc/29/29/40/1039292940.db2.gz BSPAYNYYLSWCKT-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000051454706 1039292952 /nfs/dbraw/zinc/29/29/52/1039292952.db2.gz BSPAYNYYLSWCKT-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cc(C)c(OC)c(C)c2)ccc1[N+](=O)[O-] ZINC000489177269 1039699116 /nfs/dbraw/zinc/69/91/16/1039699116.db2.gz QSGOHIBBRLDVFK-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1cccnc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417353840 1039713650 /nfs/dbraw/zinc/71/36/50/1039713650.db2.gz YFJZZTIFTHSLMT-MRXNPFEDSA-N 1 1 327.384 3.556 20 5 EHBDMO COc1ccc([C@@H](C)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549809206 1039925762 /nfs/dbraw/zinc/92/57/62/1039925762.db2.gz AHYACSUGECUIJP-HNNXBMFYSA-N 1 1 328.412 3.881 20 5 EHBDMO CCc1ccc([C@H](COC)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000573741477 1040214794 /nfs/dbraw/zinc/21/47/94/1040214794.db2.gz IXNNUZQCZWBIEN-CVEARBPZSA-N 1 1 330.384 3.715 20 5 EHBDMO CCC(O)(CC)C[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000600216160 1040853841 /nfs/dbraw/zinc/85/38/41/1040853841.db2.gz WAVURNOFLBJSQQ-UHFFFAOYSA-N 1 1 349.456 3.701 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](N[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022888 1040869219 /nfs/dbraw/zinc/86/92/19/1040869219.db2.gz QDAMCVZUECETNM-PXNSSMCTSA-N 1 1 337.423 3.511 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](N[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022888 1040869227 /nfs/dbraw/zinc/86/92/27/1040869227.db2.gz QDAMCVZUECETNM-PXNSSMCTSA-N 1 1 337.423 3.511 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078765 1040885747 /nfs/dbraw/zinc/88/57/47/1040885747.db2.gz QATRPIVWONYKFH-HZPDHXFCSA-N 1 1 349.450 3.820 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185700 1041377911 /nfs/dbraw/zinc/37/79/11/1041377911.db2.gz HQSDAPJWDSECDG-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000066900061 1042276117 /nfs/dbraw/zinc/27/61/17/1042276117.db2.gz GLNBCPKYKZQMSI-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000066900061 1042276124 /nfs/dbraw/zinc/27/61/24/1042276124.db2.gz GLNBCPKYKZQMSI-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000112659808 1042416564 /nfs/dbraw/zinc/41/65/64/1042416564.db2.gz KRYFRRSOJHCRTH-FQEVSTJZSA-N 1 1 342.439 3.656 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCCCC[C@@H]2CCO)o1 ZINC000585767852 1043029856 /nfs/dbraw/zinc/02/98/56/1043029856.db2.gz MVELHMATGVSUSW-OAHLLOKOSA-N 1 1 344.411 3.982 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2cc([N+](=O)[O-])ccc21 ZINC000279118020 1043380208 /nfs/dbraw/zinc/38/02/08/1043380208.db2.gz PVMVCVNBTGCICP-HOTGVXAUSA-N 1 1 326.400 3.708 20 5 EHBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000279669986 1044388971 /nfs/dbraw/zinc/38/89/71/1044388971.db2.gz NEGIUXHGCZGLFH-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO Cc1cccc(CC2(O)CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000279890125 1044798529 /nfs/dbraw/zinc/79/85/29/1044798529.db2.gz VEQIJBCRPITVAT-UHFFFAOYSA-N 1 1 346.452 3.534 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000072770477 1126877804 /nfs/dbraw/zinc/87/78/04/1126877804.db2.gz BWYPBOUOZIRMAH-UTUOFQBUSA-N 1 1 348.428 3.532 20 5 EHBDMO Cc1ccc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000765087372 1127572244 /nfs/dbraw/zinc/57/22/44/1127572244.db2.gz LEFXNLNZTZLSBD-AWEZNQCLSA-N 1 1 331.441 3.848 20 5 EHBDMO Cc1ccnc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302499 1127735959 /nfs/dbraw/zinc/73/59/59/1127735959.db2.gz RWQOYZXBWFEFJM-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477796 1131242370 /nfs/dbraw/zinc/24/23/70/1131242370.db2.gz UMDLYFQDCXRZKI-WMLDXEAASA-N 1 1 336.395 3.780 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1 ZINC000326686164 1128430393 /nfs/dbraw/zinc/43/03/93/1128430393.db2.gz IUXMHICALQSZCN-QRVBRYPASA-N 1 1 332.444 3.543 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c2ncccc12 ZINC000301477507 1128467517 /nfs/dbraw/zinc/46/75/17/1128467517.db2.gz UDUIVPLUKLTBNS-OAHLLOKOSA-N 1 1 340.427 3.819 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000301602885 1128520296 /nfs/dbraw/zinc/52/02/96/1128520296.db2.gz WQSNJLKTWAHSHV-QAPCUYQASA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000301647355 1128838693 /nfs/dbraw/zinc/83/86/93/1128838693.db2.gz IHUVHKJOSYHKSK-RHSMWYFYSA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000301650625 1128844734 /nfs/dbraw/zinc/84/47/34/1128844734.db2.gz GIMSDZFLZNMKGH-MRXNPFEDSA-N 1 1 346.475 3.779 20 5 EHBDMO C[C@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[NH+](C)C ZINC000609223408 1121562978 /nfs/dbraw/zinc/56/29/78/1121562978.db2.gz MVOQCFBOIDPBTD-CYBMUJFWSA-N 1 1 347.390 3.566 20 5 EHBDMO COc1c(C)c[nH+]c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000153295650 1121641533 /nfs/dbraw/zinc/64/15/33/1121641533.db2.gz SDIUYSNCNOMDOF-UHFFFAOYSA-N 1 1 341.411 3.780 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000282119447 1121798133 /nfs/dbraw/zinc/79/81/33/1121798133.db2.gz ARLBJMHYTCUNRL-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cccn2cc(C[NH2+]Cc3ccc(C(C)C)c([N+](=O)[O-])c3)nc12 ZINC000076894956 1121969604 /nfs/dbraw/zinc/96/96/04/1121969604.db2.gz ZBZNJOPXVVHNOQ-UHFFFAOYSA-N 1 1 338.411 3.964 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)ccc2c1 ZINC000311855804 1129048012 /nfs/dbraw/zinc/04/80/12/1129048012.db2.gz PTGIZRKYQFUCPL-QGZVFWFLSA-N 1 1 348.406 3.829 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301206518 1122512296 /nfs/dbraw/zinc/51/22/96/1122512296.db2.gz ZJBDHVVTSWPWFS-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccc(F)c1 ZINC000072701900 1123144910 /nfs/dbraw/zinc/14/49/10/1123144910.db2.gz FVLBFTXELTWTPR-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccc(F)c1 ZINC000072701900 1123144913 /nfs/dbraw/zinc/14/49/13/1123144913.db2.gz FVLBFTXELTWTPR-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131935 1123165336 /nfs/dbraw/zinc/16/53/36/1123165336.db2.gz BTHPXNWILXEPAA-WMZOPIPTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131935 1123165339 /nfs/dbraw/zinc/16/53/39/1123165339.db2.gz BTHPXNWILXEPAA-WMZOPIPTSA-N 1 1 339.439 3.768 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000065958732 1129115379 /nfs/dbraw/zinc/11/53/79/1129115379.db2.gz LMFMDJMLTJTHJS-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000301819843 1129120505 /nfs/dbraw/zinc/12/05/05/1129120505.db2.gz JETCAIPQNKJJFD-YPMHNXCESA-N 1 1 343.349 3.677 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249653 1123750765 /nfs/dbraw/zinc/75/07/65/1123750765.db2.gz CTPDUXWRMYUOHR-LSDHHAIUSA-N 1 1 335.423 3.825 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539666 1129160377 /nfs/dbraw/zinc/16/03/77/1129160377.db2.gz DNJUPBFKECSJOH-SWLSCSKDSA-N 1 1 330.388 3.655 20 5 EHBDMO C[NH+](C)CCCC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182384367 1125271120 /nfs/dbraw/zinc/27/11/20/1125271120.db2.gz NYLNULMDQXBDAJ-UHFFFAOYSA-N 1 1 339.867 3.802 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569528 1125363987 /nfs/dbraw/zinc/36/39/87/1125363987.db2.gz FMHJDRJJZXLORY-AXUOBQJMSA-N 1 1 332.444 3.746 20 5 EHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000081014218 1129394235 /nfs/dbraw/zinc/39/42/35/1129394235.db2.gz RRTLMMCUHZQVOS-MRXNPFEDSA-N 1 1 331.441 3.757 20 5 EHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000081014218 1129394239 /nfs/dbraw/zinc/39/42/39/1129394239.db2.gz RRTLMMCUHZQVOS-MRXNPFEDSA-N 1 1 331.441 3.757 20 5 EHBDMO Cn1cc(C[N@@H+](C)CC2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092667148 1129555604 /nfs/dbraw/zinc/55/56/04/1129555604.db2.gz AVZGFAXVGJCWPL-UHFFFAOYSA-N 1 1 328.416 3.617 20 5 EHBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482611 1129590679 /nfs/dbraw/zinc/59/06/79/1129590679.db2.gz IJKAJLKDYVRGLE-UONOGXRCSA-N 1 1 330.384 3.590 20 5 EHBDMO C[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000499960012 1129592382 /nfs/dbraw/zinc/59/23/82/1129592382.db2.gz ZMYDHGWXDFWYEY-BONVTDFDSA-N 1 1 338.766 3.772 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000330609975 1129641760 /nfs/dbraw/zinc/64/17/60/1129641760.db2.gz MUSTUFZWXDJIDU-KRWDZBQOSA-N 1 1 332.444 3.967 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000330640041 1129642535 /nfs/dbraw/zinc/64/25/35/1129642535.db2.gz HLCAUZVKNFNEBD-KSXIZUIISA-N 1 1 347.459 3.575 20 5 EHBDMO CO[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384176 1129674693 /nfs/dbraw/zinc/67/46/93/1129674693.db2.gz QWCRPNPRXCMMBZ-MLGOLLRUSA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384176 1129674695 /nfs/dbraw/zinc/67/46/95/1129674695.db2.gz QWCRPNPRXCMMBZ-MLGOLLRUSA-N 1 1 347.440 3.718 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302012151 1129763745 /nfs/dbraw/zinc/76/37/45/1129763745.db2.gz ZFBPAWKQQFNWOL-SJORKVTESA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302012151 1129763747 /nfs/dbraw/zinc/76/37/47/1129763747.db2.gz ZFBPAWKQQFNWOL-SJORKVTESA-N 1 1 333.338 3.730 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000132403330 1129898765 /nfs/dbraw/zinc/89/87/65/1129898765.db2.gz LJYQSGXYTKVIHI-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCn1cc[nH+]c1C(C)C ZINC000173611834 1130259632 /nfs/dbraw/zinc/25/96/32/1130259632.db2.gz UPQMBAAAPIHZIK-UHFFFAOYSA-N 1 1 330.388 3.560 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731205594 1130778506 /nfs/dbraw/zinc/77/85/06/1130778506.db2.gz ARVAFOIWTMAXBJ-LBPRGKRZSA-N 1 1 334.445 3.881 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208667 1130779469 /nfs/dbraw/zinc/77/94/69/1130779469.db2.gz CSRIBIGJRIOEQO-NEPJUHHUSA-N 1 1 334.445 3.737 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H]3CC[C@@H](C1)C3(F)F)CC2 ZINC001172906352 1131888351 /nfs/dbraw/zinc/88/83/51/1131888351.db2.gz XIRAOEVUTMKXSE-OWCLPIDISA-N 1 1 336.382 3.819 20 5 EHBDMO COc1cccc(C[N@@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172908608 1131888384 /nfs/dbraw/zinc/88/83/84/1131888384.db2.gz DYLSZBTYYCEWMO-GOSISDBHSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](COCC3CC3)C1)CC2 ZINC001172919274 1131904282 /nfs/dbraw/zinc/90/42/82/1131904282.db2.gz FLKBJKLQVMIMJE-LPHOPBHVSA-N 1 1 344.455 3.591 20 5 EHBDMO C[C@@H]1c2cccn2CC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912463 1131918303 /nfs/dbraw/zinc/91/83/03/1131918303.db2.gz ABVUQZXLILPUHF-PBHICJAKSA-N 1 1 325.412 3.721 20 5 EHBDMO C[C@@H]1c2cccn2CC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912463 1131918305 /nfs/dbraw/zinc/91/83/05/1131918305.db2.gz ABVUQZXLILPUHF-PBHICJAKSA-N 1 1 325.412 3.721 20 5 EHBDMO Cc1nc2c(s1)C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172912930 1131919452 /nfs/dbraw/zinc/91/94/52/1131919452.db2.gz MRXJKXPPHRDUFT-CQSZACIVSA-N 1 1 329.425 3.623 20 5 EHBDMO Cc1nc2c(s1)C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172912930 1131919461 /nfs/dbraw/zinc/91/94/61/1131919461.db2.gz MRXJKXPPHRDUFT-CQSZACIVSA-N 1 1 329.425 3.623 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001173226390 1132006565 /nfs/dbraw/zinc/00/65/65/1132006565.db2.gz JIWICESRZUYSAP-KXBFYZLASA-N 1 1 326.396 3.679 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)c1cccs1 ZINC001173230805 1132009640 /nfs/dbraw/zinc/00/96/40/1132009640.db2.gz GQEFQAZTXISVET-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO COc1ccc(CC[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173232746 1132010322 /nfs/dbraw/zinc/01/03/22/1132010322.db2.gz HNKHKFZLCJWVHP-HNNXBMFYSA-N 1 1 328.412 3.709 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C(=O)c2ccccc2)C1 ZINC001173233808 1132010568 /nfs/dbraw/zinc/01/05/68/1132010568.db2.gz YYWJXLCQEINBSN-QAPCUYQASA-N 1 1 338.407 3.731 20 5 EHBDMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CC1(C)C ZINC001174908310 1132501709 /nfs/dbraw/zinc/50/17/09/1132501709.db2.gz ZHHJKAJXEKURPT-NSHDSACASA-N 1 1 327.222 3.835 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052532 1132550407 /nfs/dbraw/zinc/55/04/07/1132550407.db2.gz HAWVDZIQYFGLBP-HSWBROFVSA-N 1 1 349.406 3.741 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030294 1132635922 /nfs/dbraw/zinc/63/59/22/1132635922.db2.gz YCUIASDNTPVIHF-PKOBYXMFSA-N 1 1 325.412 3.529 20 5 EHBDMO COC(=O)c1ccc(Cl)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC001176036470 1132825709 /nfs/dbraw/zinc/82/57/09/1132825709.db2.gz MWEFKEGHZDGUBW-NSHDSACASA-N 1 1 348.786 3.886 20 5 EHBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001169942268 1132903676 /nfs/dbraw/zinc/90/36/76/1132903676.db2.gz LDLTYHWENUFTNG-GFCCVEGCSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1OCCc2ccccc21 ZINC000768542754 1133153998 /nfs/dbraw/zinc/15/39/98/1133153998.db2.gz YNOOIDAUCCDFAG-SFHVURJKSA-N 1 1 346.814 3.994 20 5 EHBDMO O=C1CC[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCN1 ZINC000769326388 1133262851 /nfs/dbraw/zinc/26/28/51/1133262851.db2.gz LELHUUQHMPHLJF-UHFFFAOYSA-N 1 1 338.838 3.968 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)c1 ZINC000769933663 1133369208 /nfs/dbraw/zinc/36/92/08/1133369208.db2.gz HDLLHWSFQLSQEE-UHFFFAOYSA-N 1 1 346.770 3.756 20 5 EHBDMO c1ccc2c(c1)cc1ccccc1c2C[NH2+]Cc1nnnn1CC1CC1 ZINC000769937711 1133369497 /nfs/dbraw/zinc/36/94/97/1133369497.db2.gz ZNCVWVCOMTVLGE-UHFFFAOYSA-N 1 1 343.434 3.679 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001181999436 1133560512 /nfs/dbraw/zinc/56/05/12/1133560512.db2.gz YIUBKVUZEZEKDQ-QGZVFWFLSA-N 1 1 334.423 3.596 20 5 EHBDMO C[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C(C1CC1)C1CC1 ZINC000774625841 1133801191 /nfs/dbraw/zinc/80/11/91/1133801191.db2.gz GQXSMNXMELXUQM-UHFFFAOYSA-N 1 1 334.807 3.676 20 5 EHBDMO COC(=O)CC[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC001183631249 1133839257 /nfs/dbraw/zinc/83/92/57/1133839257.db2.gz QIQOAOGRRADIJI-UVQBRAAOSA-N 1 1 346.427 3.663 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000786880488 1133923626 /nfs/dbraw/zinc/92/36/26/1133923626.db2.gz QSCMDQWVTXCZKY-RDTXWAMCSA-N 1 1 346.427 3.914 20 5 EHBDMO C[C@H]1CCSCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000790480933 1134423555 /nfs/dbraw/zinc/42/35/55/1134423555.db2.gz NTFRFMWAZKTTSW-JTQLQIEISA-N 1 1 339.442 3.657 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000790480933 1134423559 /nfs/dbraw/zinc/42/35/59/1134423559.db2.gz NTFRFMWAZKTTSW-JTQLQIEISA-N 1 1 339.442 3.657 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344946 1134758578 /nfs/dbraw/zinc/75/85/78/1134758578.db2.gz FSOCCLMTBDCXFX-YPMHNXCESA-N 1 1 328.359 3.512 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346421 1134760010 /nfs/dbraw/zinc/76/00/10/1134760010.db2.gz NMMLDMXVCYYKEB-RDTXWAMCSA-N 1 1 341.411 3.767 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350552 1134760421 /nfs/dbraw/zinc/76/04/21/1134760421.db2.gz BCKOBKZPJAPXAH-KDOFPFPSSA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1nn(C[N@@H+](C)Cc2ccc(F)cc2C)c2cc([N+](=O)[O-])ccc12 ZINC000792707529 1134783749 /nfs/dbraw/zinc/78/37/49/1134783749.db2.gz PGJULDKSPMIJMP-UHFFFAOYSA-N 1 1 342.374 3.790 20 5 EHBDMO Cc1nn(C[N@H+](C)Cc2ccc(F)cc2C)c2cc([N+](=O)[O-])ccc12 ZINC000792707529 1134783754 /nfs/dbraw/zinc/78/37/54/1134783754.db2.gz PGJULDKSPMIJMP-UHFFFAOYSA-N 1 1 342.374 3.790 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804556386 1135125859 /nfs/dbraw/zinc/12/58/59/1135125859.db2.gz WCSYYSPQQGTRQY-HNNXBMFYSA-N 1 1 346.475 3.658 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001194029672 1135216953 /nfs/dbraw/zinc/21/69/53/1135216953.db2.gz JSCLMHSOXJXDDC-AWEZNQCLSA-N 1 1 336.432 3.883 20 5 EHBDMO CCC[C@@H](C)CCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001194724157 1135313432 /nfs/dbraw/zinc/31/34/32/1135313432.db2.gz QXKNUERNERXFNW-MRXNPFEDSA-N 1 1 347.459 3.569 20 5 EHBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834350 1135332351 /nfs/dbraw/zinc/33/23/51/1135332351.db2.gz FXIKGSHGOYLJKN-ROUUACIJSA-N 1 1 344.411 3.720 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820337 1135336363 /nfs/dbraw/zinc/33/63/63/1135336363.db2.gz KXSWGQJAYVUOAY-GJZGRUSLSA-N 1 1 346.402 3.720 20 5 EHBDMO Cc1ccc(C2([NH2+]CC[N+](=O)[O-])CCCCC2)c(Br)c1 ZINC001195350147 1135415527 /nfs/dbraw/zinc/41/55/27/1135415527.db2.gz RBBMVIQYYNNSBY-UHFFFAOYSA-N 1 1 341.249 3.783 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1ccsc1)[NH+](C)C ZINC000807923240 1135590303 /nfs/dbraw/zinc/59/03/03/1135590303.db2.gz OPJJMUQSVLZDCR-INIZCTEOSA-N 1 1 333.413 3.574 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000807926261 1135591561 /nfs/dbraw/zinc/59/15/61/1135591561.db2.gz GDEDVPAIAODRHL-AWEZNQCLSA-N 1 1 333.432 3.721 20 5 EHBDMO C[C@H](C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001197600013 1135713374 /nfs/dbraw/zinc/71/33/74/1135713374.db2.gz BXQWTLHQFPLKGR-LLVKDONJSA-N 1 1 341.839 3.801 20 5 EHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000808793772 1135738763 /nfs/dbraw/zinc/73/87/63/1135738763.db2.gz UCTKYVNUVRHIKP-GUTXKFCHSA-N 1 1 346.349 3.681 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000809965760 1135904328 /nfs/dbraw/zinc/90/43/28/1135904328.db2.gz OULNSURWTIIPRV-GHMZBOCLSA-N 1 1 345.226 3.760 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+](CCCCO)C1CC1 ZINC000809949104 1135905474 /nfs/dbraw/zinc/90/54/74/1135905474.db2.gz ZBPVPEOWJXHMNZ-UHFFFAOYSA-N 1 1 333.215 3.639 20 5 EHBDMO CC(C)c1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810836978 1136012069 /nfs/dbraw/zinc/01/20/69/1136012069.db2.gz JQJQZJOYOGOLAM-CABCVRRESA-N 1 1 332.400 3.502 20 5 EHBDMO CSc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000811454136 1136089129 /nfs/dbraw/zinc/08/91/29/1136089129.db2.gz WLCMPZRTQXDZDL-UHFFFAOYSA-N 1 1 349.481 3.700 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850653 1136261429 /nfs/dbraw/zinc/26/14/29/1136261429.db2.gz XTGQUSPTOIHAER-KUHUBIRLSA-N 1 1 344.411 3.547 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812853110 1136263017 /nfs/dbraw/zinc/26/30/17/1136263017.db2.gz AOSLJJQSAGCMBL-DNVCBOLYSA-N 1 1 328.412 3.581 20 5 EHBDMO CCCC[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173044 1136297638 /nfs/dbraw/zinc/29/76/38/1136297638.db2.gz SDRIELXOTGEIJI-PBHICJAKSA-N 1 1 334.416 3.539 20 5 EHBDMO CCCC[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173044 1136297641 /nfs/dbraw/zinc/29/76/41/1136297641.db2.gz SDRIELXOTGEIJI-PBHICJAKSA-N 1 1 334.416 3.539 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583162 1136441641 /nfs/dbraw/zinc/44/16/41/1136441641.db2.gz YPNOSGWVYQUSKZ-QZTJIDSGSA-N 1 1 348.349 3.744 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586086 1136445337 /nfs/dbraw/zinc/44/53/37/1136445337.db2.gz JLVZGAKNDBVMJS-QUCCMNQESA-N 1 1 342.439 3.971 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587639 1136447819 /nfs/dbraw/zinc/44/78/19/1136447819.db2.gz XPPZBTKYBXIYEC-ZMZPIMSZSA-N 1 1 348.349 3.526 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587639 1136447822 /nfs/dbraw/zinc/44/78/22/1136447822.db2.gz XPPZBTKYBXIYEC-ZMZPIMSZSA-N 1 1 348.349 3.526 20 5 EHBDMO Cc1c(COC(=O)[C@H]2CCCC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000815445467 1136596380 /nfs/dbraw/zinc/59/63/80/1136596380.db2.gz ZJWBRMGIBOBACX-GOSISDBHSA-N 1 1 346.427 3.744 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc([NH+]3CCCCC3)cc2)c1 ZINC000819393031 1136935213 /nfs/dbraw/zinc/93/52/13/1136935213.db2.gz JNQPKCMQFSVVOO-IBGZPJMESA-N 1 1 341.411 3.731 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1(O)CCCCCC1 ZINC000820632230 1136999072 /nfs/dbraw/zinc/99/90/72/1136999072.db2.gz GTYGGDLYPBEUPM-UHFFFAOYSA-N 1 1 326.824 3.765 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)cc1F ZINC000859928274 1137037191 /nfs/dbraw/zinc/03/71/91/1137037191.db2.gz IBGYIIYBAXMVFL-YESZJQIVSA-N 1 1 326.371 3.969 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483469 1137146782 /nfs/dbraw/zinc/14/67/82/1137146782.db2.gz UPRYHHFOWAQTDM-NSDNCLLMSA-N 1 1 338.407 3.592 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cccc(F)c2OC(F)F)cc1[N+](=O)[O-] ZINC000865787871 1137311876 /nfs/dbraw/zinc/31/18/76/1137311876.db2.gz ULTLYKPLYPGDLG-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO COCc1cc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1F ZINC000872037371 1137566779 /nfs/dbraw/zinc/56/67/79/1137566779.db2.gz DZEJAFKTNSAWNB-NSHDSACASA-N 1 1 336.338 3.870 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000872047685 1137567602 /nfs/dbraw/zinc/56/76/02/1137567602.db2.gz COJRLOYNOCUDQC-YGRLFVJLSA-N 1 1 332.429 3.768 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC[C@@H]1C=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000872107691 1137571444 /nfs/dbraw/zinc/57/14/44/1137571444.db2.gz QYEDLAMGXLZEBR-CRAIPNDOSA-N 1 1 340.427 3.754 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000877499120 1137678731 /nfs/dbraw/zinc/67/87/31/1137678731.db2.gz LIGJEYMWMKYZKD-UHFFFAOYSA-N 1 1 328.416 3.757 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000877499120 1137678732 /nfs/dbraw/zinc/67/87/32/1137678732.db2.gz LIGJEYMWMKYZKD-UHFFFAOYSA-N 1 1 328.416 3.757 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000877795128 1137690074 /nfs/dbraw/zinc/69/00/74/1137690074.db2.gz AAZGSDBUJZOKDM-NSHDSACASA-N 1 1 347.242 3.885 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000877795128 1137690075 /nfs/dbraw/zinc/69/00/75/1137690075.db2.gz AAZGSDBUJZOKDM-NSHDSACASA-N 1 1 347.242 3.885 20 5 EHBDMO CC1(C)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878048472 1137700602 /nfs/dbraw/zinc/70/06/02/1137700602.db2.gz QDDXTKGVCCKDCW-UHFFFAOYSA-N 1 1 336.779 3.673 20 5 EHBDMO CC1(C)CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878147983 1137704443 /nfs/dbraw/zinc/70/44/43/1137704443.db2.gz COXRAWWJDGGHPH-UHFFFAOYSA-N 1 1 336.779 3.530 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880028406 1137765918 /nfs/dbraw/zinc/76/59/18/1137765918.db2.gz CVQIFPIKGKONEZ-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880028406 1137765919 /nfs/dbraw/zinc/76/59/19/1137765919.db2.gz CVQIFPIKGKONEZ-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000886049405 1138035034 /nfs/dbraw/zinc/03/50/34/1138035034.db2.gz LRNYSNMEYAGOEH-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1C(F)(F)F ZINC000886111938 1138047958 /nfs/dbraw/zinc/04/79/58/1138047958.db2.gz LOFDKUYCMISJGG-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000089512144 1138200666 /nfs/dbraw/zinc/20/06/66/1138200666.db2.gz NUGJZXOQUFMVPV-GFCCVEGCSA-N 1 1 345.355 3.753 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)o1 ZINC000129968261 1138429677 /nfs/dbraw/zinc/42/96/77/1138429677.db2.gz ZSBFLRMHAIXUDB-AWEZNQCLSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cnn(C2CCCC2)c1 ZINC000337384435 1138552044 /nfs/dbraw/zinc/55/20/44/1138552044.db2.gz FFAJXLKAUQSRPM-CYBMUJFWSA-N 1 1 344.415 3.766 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607244 1139144379 /nfs/dbraw/zinc/14/43/79/1139144379.db2.gz YQPOBXYELWYWTR-HZPDHXFCSA-N 1 1 349.475 3.765 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000179408896 1139755579 /nfs/dbraw/zinc/75/55/79/1139755579.db2.gz RBFXCLXCSXMZNH-CYBMUJFWSA-N 1 1 329.400 3.520 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[N@H+](C2CCCC2)CC1 ZINC000179769265 1139781175 /nfs/dbraw/zinc/78/11/75/1139781175.db2.gz GXUIOFDNLLGDTH-VMPITWQZSA-N 1 1 329.444 3.558 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000181821351 1139934401 /nfs/dbraw/zinc/93/44/01/1139934401.db2.gz SYTYLIRJYJTNSY-GFCCVEGCSA-N 1 1 346.358 3.760 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC(C)(C)C)CC1 ZINC000268307794 1140918601 /nfs/dbraw/zinc/91/86/01/1140918601.db2.gz OWLKXBHGNLQPIH-UHFFFAOYSA-N 1 1 336.432 3.773 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625581 1141129132 /nfs/dbraw/zinc/12/91/32/1141129132.db2.gz CJVFZWRAJVFQOA-DOMZBBRYSA-N 1 1 349.456 3.649 20 5 EHBDMO COC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271212198 1141326762 /nfs/dbraw/zinc/32/67/62/1141326762.db2.gz YRTTYOFBONBLNM-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271656897 1141413523 /nfs/dbraw/zinc/41/35/23/1141413523.db2.gz WLIGCKAWIKSKGE-LSDHHAIUSA-N 1 1 341.411 3.889 20 5 EHBDMO Cc1ccc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271694561 1141419566 /nfs/dbraw/zinc/41/95/66/1141419566.db2.gz FZEZGPFTUAGORY-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000274278571 1141492821 /nfs/dbraw/zinc/49/28/21/1141492821.db2.gz COSWJHORBPCIKW-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283143444 1141561768 /nfs/dbraw/zinc/56/17/68/1141561768.db2.gz ODEZXFGDSVIJJB-CQSZACIVSA-N 1 1 332.375 3.507 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])cn1 ZINC000052245057 214123848 /nfs/dbraw/zinc/12/38/48/214123848.db2.gz SGTUHCHDERHDBF-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 ZINC000037775544 213167072 /nfs/dbraw/zinc/16/70/72/213167072.db2.gz PEZBCBXCQGTVDX-SECBINFHSA-N 1 1 325.162 3.801 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215073 1015005740 /nfs/dbraw/zinc/00/57/40/1015005740.db2.gz HNVKSADAKNJLIP-CYBMUJFWSA-N 1 1 349.456 3.994 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430223170 1015100029 /nfs/dbraw/zinc/10/00/29/1015100029.db2.gz ULPJHBSQJZENBF-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430223170 1015100043 /nfs/dbraw/zinc/10/00/43/1015100043.db2.gz ULPJHBSQJZENBF-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO CC1(C)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000127031208 1015188046 /nfs/dbraw/zinc/18/80/46/1015188046.db2.gz UJCBMBKQCAJOSV-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1 ZINC000471169679 1015234142 /nfs/dbraw/zinc/23/41/42/1015234142.db2.gz NJUFXDJOETZUDW-FQEVSTJZSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000339670822 1015492284 /nfs/dbraw/zinc/49/22/84/1015492284.db2.gz FUFRMWBBMHGYDF-TZMCWYRMSA-N 1 1 342.399 3.828 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154709188 1015771936 /nfs/dbraw/zinc/77/19/36/1015771936.db2.gz WXYPIVGOOPQQJI-AWEZNQCLSA-N 1 1 329.400 3.938 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000278723527 1032139854 /nfs/dbraw/zinc/13/98/54/1032139854.db2.gz KUQYKHNZJMTQKQ-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO Cc1nc(NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311219127 1016400031 /nfs/dbraw/zinc/40/00/31/1016400031.db2.gz TXBUVVVIACAFPX-IBGZPJMESA-N 1 1 340.427 3.622 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1OCc1ccncc1 ZINC000340175949 1016591495 /nfs/dbraw/zinc/59/14/95/1016591495.db2.gz RJIUKKMTTGBIDO-UHFFFAOYSA-N 1 1 349.390 3.859 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000074742655 1032219124 /nfs/dbraw/zinc/21/91/24/1032219124.db2.gz UCDXUVODZUSWTQ-GOEBONIOSA-N 1 1 326.400 3.546 20 5 EHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000449155731 1032258576 /nfs/dbraw/zinc/25/85/76/1032258576.db2.gz QJALSZDIOJRGOX-CQSZACIVSA-N 1 1 345.418 3.516 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038865 1032270642 /nfs/dbraw/zinc/27/06/42/1032270642.db2.gz UERRIUXWVZNHJE-KXBFYZLASA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038865 1032270650 /nfs/dbraw/zinc/27/06/50/1032270650.db2.gz UERRIUXWVZNHJE-KXBFYZLASA-N 1 1 331.460 3.682 20 5 EHBDMO Cn1cc(C[N@@H+](C)C2CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459723892 1032430784 /nfs/dbraw/zinc/43/07/84/1032430784.db2.gz DHBUYFABKQLIPT-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO CC(C)([NH2+]Cc1ccnn1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000449340717 1032454038 /nfs/dbraw/zinc/45/40/38/1032454038.db2.gz PWKSMIQJDOKXEE-UHFFFAOYSA-N 1 1 328.416 3.931 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1Cl ZINC000302035781 1032457570 /nfs/dbraw/zinc/45/75/70/1032457570.db2.gz UQLGDNNLCQVDQC-LBPRGKRZSA-N 1 1 334.807 3.576 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892729823 1017242060 /nfs/dbraw/zinc/24/20/60/1017242060.db2.gz CBQVLHWCORKEHC-LBPRGKRZSA-N 1 1 348.834 3.574 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584503 1017377518 /nfs/dbraw/zinc/37/75/18/1017377518.db2.gz ADZICILGQCIYDR-RBSFLKMASA-N 1 1 348.443 3.956 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC[C@H](C)[NH+]1CCCCC1 ZINC000468606009 1018019106 /nfs/dbraw/zinc/01/91/06/1018019106.db2.gz DXHPZVAWVQMDLH-NOCRFKNCSA-N 1 1 331.460 3.852 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCc3[nH]cnc3C2)c(Cl)c1 ZINC000580017510 1018121459 /nfs/dbraw/zinc/12/14/59/1018121459.db2.gz NIEFYKFFHGGLJD-SSDOTTSWSA-N 1 1 327.171 3.594 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCc3[nH+]c[nH]c3C2)c(Cl)c1 ZINC000580017510 1018121464 /nfs/dbraw/zinc/12/14/64/1018121464.db2.gz NIEFYKFFHGGLJD-SSDOTTSWSA-N 1 1 327.171 3.594 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCc3[nH]c[nH+]c3C2)c(Cl)c1 ZINC000580017510 1018121473 /nfs/dbraw/zinc/12/14/73/1018121473.db2.gz NIEFYKFFHGGLJD-SSDOTTSWSA-N 1 1 327.171 3.594 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000083211418 1018547724 /nfs/dbraw/zinc/54/77/24/1018547724.db2.gz KTFFUEFGBXOICH-OAHLLOKOSA-N 1 1 337.379 3.801 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026191 1032797297 /nfs/dbraw/zinc/79/72/97/1032797297.db2.gz FLAQUJADDWBYHN-QGZVFWFLSA-N 1 1 334.416 3.527 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000594026191 1032797310 /nfs/dbraw/zinc/79/73/10/1032797310.db2.gz FLAQUJADDWBYHN-QGZVFWFLSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1cccc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111385 1018973005 /nfs/dbraw/zinc/97/30/05/1018973005.db2.gz DFSMWKCWEXNGRC-GDBMZVCRSA-N 1 1 341.411 3.678 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000513502738 1019760421 /nfs/dbraw/zinc/76/04/21/1019760421.db2.gz DZLFICHXTSJNPB-JXMROGBWSA-N 1 1 326.396 3.791 20 5 EHBDMO CC[N@@H+](C)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000126321600 1019863761 /nfs/dbraw/zinc/86/37/61/1019863761.db2.gz RWNSDZRLZZESDH-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000262107566 1019927272 /nfs/dbraw/zinc/92/72/72/1019927272.db2.gz WCNOCIJVANMVRP-GOSISDBHSA-N 1 1 343.452 3.509 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])C1 ZINC000109966622 1020377650 /nfs/dbraw/zinc/37/76/50/1020377650.db2.gz LRABUATUZVFTBS-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO CC[C@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000168006243 1020390507 /nfs/dbraw/zinc/39/05/07/1020390507.db2.gz WMPPUUPDTOSYME-HOTGVXAUSA-N 1 1 343.431 3.886 20 5 EHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000610476444 1020397923 /nfs/dbraw/zinc/39/79/23/1020397923.db2.gz JCFNLZBHRGCOHT-WMLDXEAASA-N 1 1 328.416 3.610 20 5 EHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000610476444 1020397933 /nfs/dbraw/zinc/39/79/33/1020397933.db2.gz JCFNLZBHRGCOHT-WMLDXEAASA-N 1 1 328.416 3.610 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000610476529 1020422162 /nfs/dbraw/zinc/42/21/62/1020422162.db2.gz DEBQRVWYLIXFEB-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000610476529 1020422168 /nfs/dbraw/zinc/42/21/68/1020422168.db2.gz DEBQRVWYLIXFEB-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO CC(C)n1nccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000280618202 1020512386 /nfs/dbraw/zinc/51/23/86/1020512386.db2.gz PELDWUYEUUUWBV-UHFFFAOYSA-N 1 1 342.321 3.681 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CC[C@H](O)CC1 ZINC000276133249 1020688369 /nfs/dbraw/zinc/68/83/69/1020688369.db2.gz ZNTHRWZRLGSRBI-KOMQPUFPSA-N 1 1 330.384 3.590 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1cccnc1 ZINC000602503849 1032938524 /nfs/dbraw/zinc/93/85/24/1032938524.db2.gz SQAMHMVULBXRRV-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436043 1021147715 /nfs/dbraw/zinc/14/77/15/1021147715.db2.gz YAQLVGKIUURGKP-GOEBONIOSA-N 1 1 336.395 3.953 20 5 EHBDMO CCc1nc(C)c(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000426323103 1021261965 /nfs/dbraw/zinc/26/19/65/1021261965.db2.gz LVECVXVPFQRAHQ-HNNXBMFYSA-N 1 1 329.400 3.966 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507714655 1021467720 /nfs/dbraw/zinc/46/77/20/1021467720.db2.gz PEBGDKCOWBTJAN-KRWDZBQOSA-N 1 1 326.396 3.804 20 5 EHBDMO COc1cc(C[NH2+][C@@]2(C)CCOc3ccccc32)c([N+](=O)[O-])cc1F ZINC000933370534 1021499957 /nfs/dbraw/zinc/49/99/57/1021499957.db2.gz MGUVUIPDTQELTM-SFHVURJKSA-N 1 1 346.358 3.530 20 5 EHBDMO NC(=[NH2+])N(c1ccc(F)cc1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001167992020 1022295234 /nfs/dbraw/zinc/29/52/34/1022295234.db2.gz NTAYBCNRZVVVAH-UHFFFAOYSA-N 1 1 342.252 3.784 20 5 EHBDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000058887107 1033059574 /nfs/dbraw/zinc/05/95/74/1033059574.db2.gz CEGUZYPVKSPZCB-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000729469205 1022843610 /nfs/dbraw/zinc/84/36/10/1022843610.db2.gz KKXWUDMVLQHCJI-AWEZNQCLSA-N 1 1 340.358 3.531 20 5 EHBDMO C[N@H+](CC1=CCSC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602717102 1033102281 /nfs/dbraw/zinc/10/22/81/1033102281.db2.gz LPZDXIDWYXXPKT-UHFFFAOYSA-N 1 1 332.347 3.719 20 5 EHBDMO C[N@@H+](CC1=CCSC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602717102 1033102292 /nfs/dbraw/zinc/10/22/92/1033102292.db2.gz LPZDXIDWYXXPKT-UHFFFAOYSA-N 1 1 332.347 3.719 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000507152660 1023160576 /nfs/dbraw/zinc/16/05/76/1023160576.db2.gz XQZZWNIGUUWGBI-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO Cc1cccc2ncc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)n21 ZINC000507176738 1023164238 /nfs/dbraw/zinc/16/42/38/1023164238.db2.gz ZDJLEFZZZBILQH-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1cccc2ncc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)n21 ZINC000507176738 1023164242 /nfs/dbraw/zinc/16/42/42/1023164242.db2.gz ZDJLEFZZZBILQH-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000610720142 1023352485 /nfs/dbraw/zinc/35/24/85/1023352485.db2.gz WWGQFDNZVLIQDW-LJQANCHMSA-N 1 1 338.407 3.875 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@@H](Oc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001226586688 1024432503 /nfs/dbraw/zinc/43/25/03/1024432503.db2.gz YJMBFAQDZKCWMO-GFCCVEGCSA-N 1 1 343.221 3.609 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](Oc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001226586688 1024432507 /nfs/dbraw/zinc/43/25/07/1024432507.db2.gz YJMBFAQDZKCWMO-GFCCVEGCSA-N 1 1 343.221 3.609 20 5 EHBDMO Cc1cc(NC[C@H](C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748266 1024609740 /nfs/dbraw/zinc/60/97/40/1024609740.db2.gz GSGFYDULYOGLPX-HNNXBMFYSA-N 1 1 325.412 3.762 20 5 EHBDMO Cc1c(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235678 1024625485 /nfs/dbraw/zinc/62/54/85/1024625485.db2.gz DIAFLKZVIUYGRT-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235678 1024625499 /nfs/dbraw/zinc/62/54/99/1024625499.db2.gz DIAFLKZVIUYGRT-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1c(C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235678 1024625505 /nfs/dbraw/zinc/62/55/05/1024625505.db2.gz DIAFLKZVIUYGRT-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000548625535 1024843172 /nfs/dbraw/zinc/84/31/72/1024843172.db2.gz WOELTTOJIBIOOK-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000508017253 1024846521 /nfs/dbraw/zinc/84/65/21/1024846521.db2.gz SYVNJKOIOGYZML-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000508017253 1024846541 /nfs/dbraw/zinc/84/65/41/1024846541.db2.gz SYVNJKOIOGYZML-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO CC(C)n1cncc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369121 1024886535 /nfs/dbraw/zinc/88/65/35/1024886535.db2.gz LETUNNZTAPQTRX-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO COc1cc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435585071 1025019072 /nfs/dbraw/zinc/01/90/72/1025019072.db2.gz RUDJUSZQOQCMOI-INIZCTEOSA-N 1 1 333.432 3.812 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C(C)C)C1CCCC1 ZINC000068449278 1025033069 /nfs/dbraw/zinc/03/30/69/1025033069.db2.gz CHCLKDGOJKNZCL-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO Cc1cc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n(C)n1 ZINC000551516627 1025349168 /nfs/dbraw/zinc/34/91/68/1025349168.db2.gz UVGUAVOQFYDTAN-IBGZPJMESA-N 1 1 336.395 3.516 20 5 EHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240799 1025489990 /nfs/dbraw/zinc/48/99/90/1025489990.db2.gz RFGPMOAFHOPEDG-OCCSQVGLSA-N 1 1 333.432 3.741 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334244 1025506606 /nfs/dbraw/zinc/50/66/06/1025506606.db2.gz UIYFFZSXAPYMGB-KGLIPLIRSA-N 1 1 331.441 3.985 20 5 EHBDMO O=C(C[N@@H+]1CCCC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000515722115 1025519205 /nfs/dbraw/zinc/51/92/05/1025519205.db2.gz JWHCCEOFARVXPR-KRWDZBQOSA-N 1 1 339.395 3.761 20 5 EHBDMO O=C(C[N@H+]1CCCC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000515722115 1025519221 /nfs/dbraw/zinc/51/92/21/1025519221.db2.gz JWHCCEOFARVXPR-KRWDZBQOSA-N 1 1 339.395 3.761 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213767 1025682969 /nfs/dbraw/zinc/68/29/69/1025682969.db2.gz WFIMYFNFGPIAOV-KSSFIOAISA-N 1 1 341.411 3.972 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425544180 1025703795 /nfs/dbraw/zinc/70/37/95/1025703795.db2.gz BTSWTBKYIUCRHH-RDTXWAMCSA-N 1 1 330.428 3.937 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC000263865786 1025736531 /nfs/dbraw/zinc/73/65/31/1025736531.db2.gz BMDRJFOWRICSKV-ZDUSSCGKSA-N 1 1 334.416 3.710 20 5 EHBDMO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544353 1026092631 /nfs/dbraw/zinc/09/26/31/1026092631.db2.gz DYUHQBKSZYUJLL-DOMZBBRYSA-N 1 1 342.399 3.796 20 5 EHBDMO C[C@H](c1nc(C2CC2)no1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544353 1026092650 /nfs/dbraw/zinc/09/26/50/1026092650.db2.gz DYUHQBKSZYUJLL-DOMZBBRYSA-N 1 1 342.399 3.796 20 5 EHBDMO C[C@@H](C[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1 ZINC000516220846 1026129678 /nfs/dbraw/zinc/12/96/78/1026129678.db2.gz BYPAAXUXVAFWEB-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO CCc1ccc([C@H]([NH2+]CC(C)(C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544381206 1026404504 /nfs/dbraw/zinc/40/45/04/1026404504.db2.gz JNWMCVNWNVSLJR-QGZVFWFLSA-N 1 1 332.400 3.854 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl ZINC000186444524 1027049059 /nfs/dbraw/zinc/04/90/59/1027049059.db2.gz BCQMWZKRKSRZTK-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)ccc1Cl ZINC000186444524 1027049070 /nfs/dbraw/zinc/04/90/70/1027049070.db2.gz BCQMWZKRKSRZTK-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO Cc1c(CN[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663382 1027579767 /nfs/dbraw/zinc/57/97/67/1027579767.db2.gz FKFXORYIULODQB-BEFAXECRSA-N 1 1 339.439 3.656 20 5 EHBDMO Cc1c(CN[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663382 1027579781 /nfs/dbraw/zinc/57/97/81/1027579781.db2.gz FKFXORYIULODQB-BEFAXECRSA-N 1 1 339.439 3.656 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@H]3CCCc4ccccc43)C2)nc1 ZINC000440486076 1028086399 /nfs/dbraw/zinc/08/63/99/1028086399.db2.gz JBFKATVZRJARLJ-QAPCUYQASA-N 1 1 338.411 3.554 20 5 EHBDMO CN1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000237169220 1028115788 /nfs/dbraw/zinc/11/57/88/1028115788.db2.gz XJBHMNZDVPDBRB-UHFFFAOYSA-N 1 1 349.818 3.692 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000444687340 1028161254 /nfs/dbraw/zinc/16/12/54/1028161254.db2.gz ANAZSCRBZKSTPG-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000444687340 1028161267 /nfs/dbraw/zinc/16/12/67/1028161267.db2.gz ANAZSCRBZKSTPG-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444736118 1028200055 /nfs/dbraw/zinc/20/00/55/1028200055.db2.gz MWYDLYQEIJQNRZ-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444736118 1028200074 /nfs/dbraw/zinc/20/00/74/1028200074.db2.gz MWYDLYQEIJQNRZ-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](C(C)C)C1 ZINC000444774972 1028262693 /nfs/dbraw/zinc/26/26/93/1028262693.db2.gz YXPJXOJFDNRTFF-HNNXBMFYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H](NC[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202082 1028270091 /nfs/dbraw/zinc/27/00/91/1028270091.db2.gz ALHMPRDMDCBAIC-ZIAGYGMSSA-N 1 1 345.468 3.974 20 5 EHBDMO COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000519917882 1028380925 /nfs/dbraw/zinc/38/09/25/1028380925.db2.gz OREATMPERFCALH-MRXNPFEDSA-N 1 1 344.411 3.683 20 5 EHBDMO CCc1ccc([C@H](N[C@@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438985 1028446260 /nfs/dbraw/zinc/44/62/60/1028446260.db2.gz RWWVTGUBHYVZOG-IFXJQAMLSA-N 1 1 345.443 3.947 20 5 EHBDMO CCc1ccccc1[C@@H]([NH3+])CN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498601 1028464838 /nfs/dbraw/zinc/46/48/38/1028464838.db2.gz IHTHBDVDRFCBNK-KSSFIOAISA-N 1 1 327.428 3.816 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1OC ZINC000026738759 1028844422 /nfs/dbraw/zinc/84/44/22/1028844422.db2.gz ITZXFAFRCNCYPH-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]CC2(N(C)C)CCCC2)cc1[N+](=O)[O-] ZINC000504899087 1029027498 /nfs/dbraw/zinc/02/74/98/1029027498.db2.gz AKCLYCXKCNELGQ-CQSZACIVSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@@H]1CCSCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819296 1029029819 /nfs/dbraw/zinc/02/98/19/1029029819.db2.gz KZUZSGRDVWVGFU-SNVBAGLBSA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819296 1029029834 /nfs/dbraw/zinc/02/98/34/1029029834.db2.gz KZUZSGRDVWVGFU-SNVBAGLBSA-N 1 1 332.372 3.524 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000504906029 1029049545 /nfs/dbraw/zinc/04/95/45/1029049545.db2.gz RQQSDTYTUNCIDO-MAUKXSAKSA-N 1 1 349.475 3.765 20 5 EHBDMO CCCC[N@@H+](CCCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000583408631 1029778327 /nfs/dbraw/zinc/77/83/27/1029778327.db2.gz GWWIJRJPIPIBSL-UHFFFAOYSA-N 1 1 349.456 3.703 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000441172296 1029866499 /nfs/dbraw/zinc/86/64/99/1029866499.db2.gz AEXLDJZZTUAUDF-FMQWLBJXSA-N 1 1 340.427 3.786 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000441172296 1029866504 /nfs/dbraw/zinc/86/65/04/1029866504.db2.gz AEXLDJZZTUAUDF-FMQWLBJXSA-N 1 1 340.427 3.786 20 5 EHBDMO CC[N@@H+](CCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000537635225 1030200744 /nfs/dbraw/zinc/20/07/44/1030200744.db2.gz YWPPXJUFTJNNRP-UHFFFAOYSA-N 1 1 348.374 3.731 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509099 1030257293 /nfs/dbraw/zinc/25/72/93/1030257293.db2.gz LUISUPNLAKOLBL-BEFAXECRSA-N 1 1 331.460 3.826 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594502 1030331681 /nfs/dbraw/zinc/33/16/81/1030331681.db2.gz ZHZQKXUOYBHFRW-RHSMWYFYSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594502 1030331697 /nfs/dbraw/zinc/33/16/97/1030331697.db2.gz ZHZQKXUOYBHFRW-RHSMWYFYSA-N 1 1 347.459 3.661 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1F ZINC000593064815 1030367754 /nfs/dbraw/zinc/36/77/54/1030367754.db2.gz PXUHUHAWJBBZPC-KRWDZBQOSA-N 1 1 346.358 3.841 20 5 EHBDMO C[NH+](C)C[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776187 1030704232 /nfs/dbraw/zinc/70/42/32/1030704232.db2.gz TXLRGRAJRBHTFZ-SUQGKYDKSA-N 1 1 343.402 3.640 20 5 EHBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073322 1030939785 /nfs/dbraw/zinc/93/97/85/1030939785.db2.gz XVXJDYUZOQPIGB-AUUYWEPGSA-N 1 1 342.395 3.675 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](C)[C@@H]1C ZINC000475744578 1031834667 /nfs/dbraw/zinc/83/46/67/1031834667.db2.gz RBVXSTGVJDEZRJ-YUELXQCFSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C1CCCC1 ZINC000063551555 1033447772 /nfs/dbraw/zinc/44/77/72/1033447772.db2.gz UQABKOFDHMNJKZ-SFHVURJKSA-N 1 1 345.443 3.886 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000059374628 1033591941 /nfs/dbraw/zinc/59/19/41/1033591941.db2.gz AGPUQCSGGSKIPK-INIZCTEOSA-N 1 1 330.359 3.950 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)cc1OC ZINC000598955209 1033609622 /nfs/dbraw/zinc/60/96/22/1033609622.db2.gz JJLKWTJVABZSON-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1ccc(C2([NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC000595021746 1033614657 /nfs/dbraw/zinc/61/46/57/1033614657.db2.gz CYYCRVGQMCSZIM-CYBMUJFWSA-N 1 1 342.395 3.952 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c(F)c1 ZINC000595026288 1033624447 /nfs/dbraw/zinc/62/44/47/1033624447.db2.gz KGDQDFCIVINHKR-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595005484 1033628272 /nfs/dbraw/zinc/62/82/72/1033628272.db2.gz ZDGANGNKIUIXAA-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000599048309 1033678295 /nfs/dbraw/zinc/67/82/95/1033678295.db2.gz JVHLWXURGDSTQY-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000595288465 1033729150 /nfs/dbraw/zinc/72/91/50/1033729150.db2.gz JKLLBUWAEFCOID-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO CN(c1ccccc1)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595345256 1033736295 /nfs/dbraw/zinc/73/62/95/1033736295.db2.gz WVJDVVGXGFAQTG-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO CC(=O)c1cc(NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125690 1033745348 /nfs/dbraw/zinc/74/53/48/1033745348.db2.gz AKAOUAKENKXAMB-INIZCTEOSA-N 1 1 331.416 3.616 20 5 EHBDMO CCCCCC[N@H+](C)Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000761342788 1033917836 /nfs/dbraw/zinc/91/78/36/1033917836.db2.gz FJGVQKXLQZLJEB-UHFFFAOYSA-N 1 1 332.404 3.581 20 5 EHBDMO CCCCCC[N@@H+](C)Cc1nc(Cc2ccccc2[N+](=O)[O-])no1 ZINC000761342788 1033917852 /nfs/dbraw/zinc/91/78/52/1033917852.db2.gz FJGVQKXLQZLJEB-UHFFFAOYSA-N 1 1 332.404 3.581 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC)cc1 ZINC000603854628 1033979337 /nfs/dbraw/zinc/97/93/37/1033979337.db2.gz IGZMLGHLWJZUDO-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000595782268 1033997211 /nfs/dbraw/zinc/99/72/11/1033997211.db2.gz IMLDTFIWSBAXCW-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1 ZINC000595788256 1033999731 /nfs/dbraw/zinc/99/97/31/1033999731.db2.gz HOEYLHIGZDOHEK-APWZRJJASA-N 1 1 348.443 3.645 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599676925 1034085258 /nfs/dbraw/zinc/08/52/58/1034085258.db2.gz FTUCXCFPFOQAFZ-MRXNPFEDSA-N 1 1 344.386 3.775 20 5 EHBDMO Cc1cc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])s1 ZINC000596225871 1034126547 /nfs/dbraw/zinc/12/65/47/1034126547.db2.gz FZPOAAXGPIEVCQ-ZDUSSCGKSA-N 1 1 346.456 3.882 20 5 EHBDMO COc1cc(NCCCC[N@@H+](C)C2CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596260233 1034154999 /nfs/dbraw/zinc/15/49/99/1034154999.db2.gz BXBNLKYCWRDWQM-UHFFFAOYSA-N 1 1 327.812 3.543 20 5 EHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1CCC1CCCCC1 ZINC000534136283 1034181493 /nfs/dbraw/zinc/18/14/93/1034181493.db2.gz BOYLEADRFWXLIW-KRWDZBQOSA-N 1 1 347.459 3.581 20 5 EHBDMO CC(=O)c1cc(N[C@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000596481055 1034255074 /nfs/dbraw/zinc/25/50/74/1034255074.db2.gz WPFBSDGTZOGFCI-HNNXBMFYSA-N 1 1 331.416 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484206 1034388839 /nfs/dbraw/zinc/38/88/39/1034388839.db2.gz FGHYIMXUQKUYBW-SFHVURJKSA-N 1 1 328.368 3.516 20 5 EHBDMO C[C@@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212095 1034596362 /nfs/dbraw/zinc/59/63/62/1034596362.db2.gz RPSMVSYVNXMZIZ-RDTXWAMCSA-N 1 1 344.436 3.792 20 5 EHBDMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212089 1034597031 /nfs/dbraw/zinc/59/70/31/1034597031.db2.gz RPSMVSYVNXMZIZ-KBXCAEBGSA-N 1 1 344.436 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC4(COC4)C3)s2)cc1 ZINC000597229312 1034610764 /nfs/dbraw/zinc/61/07/64/1034610764.db2.gz KWBMLZUDWRIFMH-UHFFFAOYSA-N 1 1 330.409 3.546 20 5 EHBDMO COc1ccc(NC(=O)CC[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000411361335 1034869532 /nfs/dbraw/zinc/86/95/32/1034869532.db2.gz HBMPPYKDKNJKHT-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO COc1ccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cn1 ZINC000180051473 1035284600 /nfs/dbraw/zinc/28/46/00/1035284600.db2.gz JZUKOWBSBPKWRV-HXUWFJFHSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000075865948 1035570261 /nfs/dbraw/zinc/57/02/61/1035570261.db2.gz GPVRWZGFGIYJPG-GOSISDBHSA-N 1 1 340.423 3.942 20 5 EHBDMO CCC[N@@H+](C)[C@@H](CNc1ncc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000588061765 1035716837 /nfs/dbraw/zinc/71/68/37/1035716837.db2.gz RFOGMVXHUWMOKF-HNNXBMFYSA-N 1 1 349.822 3.533 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492660032 1036153074 /nfs/dbraw/zinc/15/30/74/1036153074.db2.gz XWNLNJKYVKFKBM-KRWDZBQOSA-N 1 1 326.396 3.983 20 5 EHBDMO CC(C)(CO)[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccs1 ZINC000589268764 1036334764 /nfs/dbraw/zinc/33/47/64/1036334764.db2.gz ZJLOEZVCEZLYNR-OAHLLOKOSA-N 1 1 338.404 3.645 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135585 1036783983 /nfs/dbraw/zinc/78/39/83/1036783983.db2.gz OASBPCYQDKYZBE-VXGBXAGGSA-N 1 1 343.349 3.961 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cnn(Cc2ccccc2)c1 ZINC000180413011 1036784227 /nfs/dbraw/zinc/78/42/27/1036784227.db2.gz MELJWFQUJZRDKI-OAHLLOKOSA-N 1 1 336.395 3.690 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000549674503 1036844350 /nfs/dbraw/zinc/84/43/50/1036844350.db2.gz VNJZALUIVWGPAB-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000549674503 1036844371 /nfs/dbraw/zinc/84/43/71/1036844371.db2.gz VNJZALUIVWGPAB-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2C1 ZINC000590369317 1036856336 /nfs/dbraw/zinc/85/63/36/1036856336.db2.gz CNIRHANQTDXFLQ-UHFFFAOYSA-N 1 1 331.803 3.700 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1occc1C ZINC000412026011 1036858803 /nfs/dbraw/zinc/85/88/03/1036858803.db2.gz KMKIYPUVSQCMSG-UHFFFAOYSA-N 1 1 345.399 3.655 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000464844079 1036881784 /nfs/dbraw/zinc/88/17/84/1036881784.db2.gz CYUWGYHMOSSUEX-SFHVURJKSA-N 1 1 333.432 3.826 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cccnc2OCC)cc1[N+](=O)[O-] ZINC000152838622 1036888989 /nfs/dbraw/zinc/88/89/89/1036888989.db2.gz RGOSGGLFJWPULP-CYBMUJFWSA-N 1 1 345.399 3.638 20 5 EHBDMO CC(C)[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907087 1036938537 /nfs/dbraw/zinc/93/85/37/1036938537.db2.gz JFRSKFFJFMCMPG-MRXNPFEDSA-N 1 1 347.440 3.823 20 5 EHBDMO CC(C)[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907087 1036938558 /nfs/dbraw/zinc/93/85/58/1036938558.db2.gz JFRSKFFJFMCMPG-MRXNPFEDSA-N 1 1 347.440 3.823 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC(C)(C)C[C@@H]1C ZINC000412031155 1036990660 /nfs/dbraw/zinc/99/06/60/1036990660.db2.gz AMUPJCXCPXKGKX-RYUDHWBXSA-N 1 1 330.388 3.826 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000462461797 1036992295 /nfs/dbraw/zinc/99/22/95/1036992295.db2.gz FKMLQZBYFGYBQT-HNNXBMFYSA-N 1 1 345.468 3.578 20 5 EHBDMO C[C@@H](c1ccsc1)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000462461797 1036992310 /nfs/dbraw/zinc/99/23/10/1036992310.db2.gz FKMLQZBYFGYBQT-HNNXBMFYSA-N 1 1 345.468 3.578 20 5 EHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521358 1037098722 /nfs/dbraw/zinc/09/87/22/1037098722.db2.gz GDASIXUJNDKPIR-ZDUSSCGKSA-N 1 1 339.867 3.848 20 5 EHBDMO C[C@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521358 1037098735 /nfs/dbraw/zinc/09/87/35/1037098735.db2.gz GDASIXUJNDKPIR-ZDUSSCGKSA-N 1 1 339.867 3.848 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)o1 ZINC000539891715 1037315020 /nfs/dbraw/zinc/31/50/20/1037315020.db2.gz ZJAGFPLPTUJVIX-PBHICJAKSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1cc(NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786735 1037395617 /nfs/dbraw/zinc/39/56/17/1037395617.db2.gz BFAUKNSKCRGYRM-GASCZTMLSA-N 1 1 335.448 3.773 20 5 EHBDMO CCOc1cc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992811 1037429748 /nfs/dbraw/zinc/42/97/48/1037429748.db2.gz FZIHWPDOENKNNF-HLLBOEOZSA-N 1 1 347.459 3.835 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462838720 1037463431 /nfs/dbraw/zinc/46/34/31/1037463431.db2.gz ZHTZOUYKINCVNN-ZDUSSCGKSA-N 1 1 343.374 3.873 20 5 EHBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786893 1037535266 /nfs/dbraw/zinc/53/52/66/1037535266.db2.gz GTABYMUDLFIOSS-LBTNJELSSA-N 1 1 344.411 3.836 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2Cl)[NH+](C)C)c1 ZINC000462916320 1037545058 /nfs/dbraw/zinc/54/50/58/1037545058.db2.gz CGCJAOWQJSPMGI-KRWDZBQOSA-N 1 1 349.818 3.972 20 5 EHBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+](C)C ZINC000491599681 1037578030 /nfs/dbraw/zinc/57/80/30/1037578030.db2.gz UHHGDNNIRCIVKR-CYBMUJFWSA-N 1 1 333.457 3.611 20 5 EHBDMO C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CN(C)C ZINC000491599681 1037578038 /nfs/dbraw/zinc/57/80/38/1037578038.db2.gz UHHGDNNIRCIVKR-CYBMUJFWSA-N 1 1 333.457 3.611 20 5 EHBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150545 1037622932 /nfs/dbraw/zinc/62/29/32/1037622932.db2.gz FURLWNZUSZQCEC-SJORKVTESA-N 1 1 333.476 3.922 20 5 EHBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150545 1037622939 /nfs/dbraw/zinc/62/29/39/1037622939.db2.gz FURLWNZUSZQCEC-SJORKVTESA-N 1 1 333.476 3.922 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000532610169 1037887919 /nfs/dbraw/zinc/88/79/19/1037887919.db2.gz OVCJUTVTORIJSU-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000532610169 1037887935 /nfs/dbraw/zinc/88/79/35/1037887935.db2.gz OVCJUTVTORIJSU-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@@H]3C3CCC3)n2)c1 ZINC000592198799 1037944479 /nfs/dbraw/zinc/94/44/79/1037944479.db2.gz VNIWTCRFQSIQMN-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1C ZINC000538937423 1038604095 /nfs/dbraw/zinc/60/40/95/1038604095.db2.gz RXEDLIPLELGNDY-AAEUAGOBSA-N 1 1 343.374 3.505 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777581 1038604304 /nfs/dbraw/zinc/60/43/04/1038604304.db2.gz GAZOAXQHFAARTN-SNVBAGLBSA-N 1 1 329.322 3.571 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1ccccc1[N+](=O)[O-] ZINC000539381848 1038873326 /nfs/dbraw/zinc/87/33/26/1038873326.db2.gz BJPDZSNPYIZCAB-SNVBAGLBSA-N 1 1 334.759 3.828 20 5 EHBDMO CCc1ccc(C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000007790913 1039040174 /nfs/dbraw/zinc/04/01/74/1039040174.db2.gz MWRAECGNFOOBBA-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000007790913 1039040192 /nfs/dbraw/zinc/04/01/92/1039040192.db2.gz MWRAECGNFOOBBA-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000015312511 1039127293 /nfs/dbraw/zinc/12/72/93/1039127293.db2.gz YROHMYMZJMWJJU-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000015312511 1039127312 /nfs/dbraw/zinc/12/73/12/1039127312.db2.gz YROHMYMZJMWJJU-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000015312513 1039128052 /nfs/dbraw/zinc/12/80/52/1039128052.db2.gz YROHMYMZJMWJJU-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000015312513 1039128059 /nfs/dbraw/zinc/12/80/59/1039128059.db2.gz YROHMYMZJMWJJU-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO CC(C)[N@H+](CC(=O)N1[C@@H](C)CCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138399974 1039150164 /nfs/dbraw/zinc/15/01/64/1039150164.db2.gz OXLLUGHVHOLFFV-HOTGVXAUSA-N 1 1 347.459 3.595 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N1[C@@H](C)CCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138399974 1039150175 /nfs/dbraw/zinc/15/01/75/1039150175.db2.gz OXLLUGHVHOLFFV-HOTGVXAUSA-N 1 1 347.459 3.595 20 5 EHBDMO CCOCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000500770289 1039458727 /nfs/dbraw/zinc/45/87/27/1039458727.db2.gz IKANEHBREPGRCL-UHFFFAOYSA-N 1 1 338.791 3.977 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cn3ccccc3n1)CCCC2 ZINC000417308085 1039660434 /nfs/dbraw/zinc/66/04/34/1039660434.db2.gz FAMNDVICFNRUJH-GOSISDBHSA-N 1 1 336.395 3.800 20 5 EHBDMO Cc1cc(C[C@H](C)[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000417312936 1039668603 /nfs/dbraw/zinc/66/86/03/1039668603.db2.gz UCXDSOJUPVPIEI-KPZWWZAWSA-N 1 1 328.416 3.615 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H](CC)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000573409968 1040092416 /nfs/dbraw/zinc/09/24/16/1040092416.db2.gz XDFGUFWQSMDZRS-FUHWJXTLSA-N 1 1 332.400 3.854 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769531 1040425390 /nfs/dbraw/zinc/42/53/90/1040425390.db2.gz FFQDXJPJAMMJGN-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000512677954 1040496429 /nfs/dbraw/zinc/49/64/29/1040496429.db2.gz NJHWUTKDBDNDDS-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO COc1ccc(F)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490826117 1040752329 /nfs/dbraw/zinc/75/23/29/1040752329.db2.gz LEMJHLFWIOONFA-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc(F)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490826117 1040752339 /nfs/dbraw/zinc/75/23/39/1040752339.db2.gz LEMJHLFWIOONFA-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C1CCC(C(C)C)CC1 ZINC000433144002 1040909420 /nfs/dbraw/zinc/90/94/20/1040909420.db2.gz AQMZKIKHCGLKTF-UHFFFAOYSA-N 1 1 347.459 3.988 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c(F)c1 ZINC000586768621 1041007136 /nfs/dbraw/zinc/00/71/36/1041007136.db2.gz TXWJYHSIXCUWJE-OLZOCXBDSA-N 1 1 340.370 3.512 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c(F)c1 ZINC000586768621 1041007150 /nfs/dbraw/zinc/00/71/50/1041007150.db2.gz TXWJYHSIXCUWJE-OLZOCXBDSA-N 1 1 340.370 3.512 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000066869376 1041980383 /nfs/dbraw/zinc/98/03/83/1041980383.db2.gz RRMKPCLDIAJKNO-CYBMUJFWSA-N 1 1 346.818 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1 ZINC000108086118 1042009675 /nfs/dbraw/zinc/00/96/75/1042009675.db2.gz GUHLIAGHEAMTPI-KRWDZBQOSA-N 1 1 346.452 3.880 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CCCCCC1 ZINC000109093461 1042130984 /nfs/dbraw/zinc/13/09/84/1042130984.db2.gz LDILUHMMHGQPQK-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000330945802 1042911546 /nfs/dbraw/zinc/91/15/46/1042911546.db2.gz ABSGBCMDOZGHTE-CYBMUJFWSA-N 1 1 332.322 3.636 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)C1 ZINC000344075662 1043219853 /nfs/dbraw/zinc/21/98/53/1043219853.db2.gz VHDGSHNNMZVKLM-GFCCVEGCSA-N 1 1 330.388 3.513 20 5 EHBDMO CCOCC[N@@H+](CC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000512300224 1044563266 /nfs/dbraw/zinc/56/32/66/1044563266.db2.gz QRUPEZHOHHJFAD-UHFFFAOYSA-N 1 1 348.399 3.722 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000178568451 1044637961 /nfs/dbraw/zinc/63/79/61/1044637961.db2.gz BLYZQVSFFUZECA-LJQANCHMSA-N 1 1 342.370 3.557 20 5 EHBDMO C[N@@H+](CCc1ccncc1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183756959 1125773536 /nfs/dbraw/zinc/77/35/36/1125773536.db2.gz NHKQSHCEPVTZHY-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000072597907 1126793279 /nfs/dbraw/zinc/79/32/79/1126793279.db2.gz RVLZOBDLRYCXMO-IFXJQAMLSA-N 1 1 326.396 3.902 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)o1 ZINC000131339825 1127626441 /nfs/dbraw/zinc/62/64/41/1127626441.db2.gz RXAUPRJXIMDHKP-QGZVFWFLSA-N 1 1 346.383 3.550 20 5 EHBDMO COC(=O)c1csc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000552275259 1127728169 /nfs/dbraw/zinc/72/81/69/1127728169.db2.gz PNLCMCUPRXDAGX-QWRGUYRKSA-N 1 1 334.397 3.855 20 5 EHBDMO COc1cc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301328075 1127737352 /nfs/dbraw/zinc/73/73/52/1127737352.db2.gz JFBHYQSTXSSBJD-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO Cc1cc(NCC(C)(C)[N@H+]2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000301420069 1127742590 /nfs/dbraw/zinc/74/25/90/1127742590.db2.gz DSOOFJRYQOPSKX-UHFFFAOYSA-N 1 1 340.427 3.547 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000301467877 1128440584 /nfs/dbraw/zinc/44/05/84/1128440584.db2.gz YNQPOBNNAXVEAV-QGZVFWFLSA-N 1 1 325.412 3.553 20 5 EHBDMO Cc1ccnc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000301562894 1128497575 /nfs/dbraw/zinc/49/75/75/1128497575.db2.gz IWOZSXXQNCVHOU-DOTOQJQBSA-N 1 1 340.427 3.621 20 5 EHBDMO O=C(CC[N@H+]1CCCC2(CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000554077188 1128612520 /nfs/dbraw/zinc/61/25/20/1128612520.db2.gz IUACYOAEZVRJPA-UHFFFAOYSA-N 1 1 345.443 3.970 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000462862129 1128751353 /nfs/dbraw/zinc/75/13/53/1128751353.db2.gz LMAQECXBLITDOQ-DGCLKSJQSA-N 1 1 345.365 3.780 20 5 EHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@H]1CCc2ccccc21 ZINC000595876755 1120362216 /nfs/dbraw/zinc/36/22/16/1120362216.db2.gz GFSDTZPNVRFPRO-CQSZACIVSA-N 1 1 336.395 3.633 20 5 EHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200549 1120560560 /nfs/dbraw/zinc/56/05/60/1120560560.db2.gz OLHZXCQAFXQZPP-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200549 1120560565 /nfs/dbraw/zinc/56/05/65/1120560565.db2.gz OLHZXCQAFXQZPP-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200552 1120563052 /nfs/dbraw/zinc/56/30/52/1120563052.db2.gz OLHZXCQAFXQZPP-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272200552 1120563054 /nfs/dbraw/zinc/56/30/54/1120563054.db2.gz OLHZXCQAFXQZPP-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2cc(C)ccc2C)c(C)c1[N+](=O)[O-] ZINC000761829808 1120975000 /nfs/dbraw/zinc/97/50/00/1120975000.db2.gz CGZIIRHXJNVXAX-KRWDZBQOSA-N 1 1 328.416 3.820 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)c(C)c1[N+](=O)[O-] ZINC000761829808 1120975002 /nfs/dbraw/zinc/97/50/02/1120975002.db2.gz CGZIIRHXJNVXAX-KRWDZBQOSA-N 1 1 328.416 3.820 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301067846 1121302235 /nfs/dbraw/zinc/30/22/35/1121302235.db2.gz RIFJBPIMMTXEGV-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000542977374 1128982518 /nfs/dbraw/zinc/98/25/18/1128982518.db2.gz FSJCNUHSBLNQES-DHSIGJKJSA-N 1 1 345.443 3.742 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCOCC(F)(F)F)C2CC2)c1 ZINC000153269337 1121556067 /nfs/dbraw/zinc/55/60/67/1121556067.db2.gz PHLPMWDECVJDEO-UHFFFAOYSA-N 1 1 332.322 3.528 20 5 EHBDMO Cc1cnn(CCCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153295208 1121641089 /nfs/dbraw/zinc/64/10/89/1121641089.db2.gz VDLHDTRVLIDCPK-UHFFFAOYSA-N 1 1 342.443 3.935 20 5 EHBDMO CCCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272472858 1121660064 /nfs/dbraw/zinc/66/00/64/1121660064.db2.gz APPNRRKTLDUIOW-INIZCTEOSA-N 1 1 328.416 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c(Cl)c1 ZINC000322895818 1121681365 /nfs/dbraw/zinc/68/13/65/1121681365.db2.gz BSPBGKWGCYTILD-OIISXLGYSA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(N[C@H]3CC[N@@H+](Cc4ccccc4)C3)ccc2c1 ZINC000311855801 1129047806 /nfs/dbraw/zinc/04/78/06/1129047806.db2.gz PTGIZRKYQFUCPL-KRWDZBQOSA-N 1 1 348.406 3.829 20 5 EHBDMO C[N@H+](CCOc1cccc(Cl)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916972952 1122426318 /nfs/dbraw/zinc/42/63/18/1122426318.db2.gz FGVCBHAYLAFNPS-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916972952 1122426321 /nfs/dbraw/zinc/42/63/21/1122426321.db2.gz FGVCBHAYLAFNPS-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087091 1122490927 /nfs/dbraw/zinc/49/09/27/1122490927.db2.gz QDNOISIUONMIMZ-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301206519 1122528397 /nfs/dbraw/zinc/52/83/97/1122528397.db2.gz ZJBDHVVTSWPWFS-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2C)C1 ZINC000609489224 1123590529 /nfs/dbraw/zinc/59/05/29/1123590529.db2.gz CDIYRPCRMZNMEM-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO COc1ccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609800394 1123664551 /nfs/dbraw/zinc/66/45/51/1123664551.db2.gz FEYUTJRMHRJUKA-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609800394 1123664553 /nfs/dbraw/zinc/66/45/53/1123664553.db2.gz FEYUTJRMHRJUKA-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610133497 1123739263 /nfs/dbraw/zinc/73/92/63/1123739263.db2.gz TXKNXJHAQJDJTI-JLZZUVOBSA-N 1 1 336.407 3.759 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301827772 1129142345 /nfs/dbraw/zinc/14/23/45/1129142345.db2.gz FUTNLCPLXOIZSC-RDJZCZTQSA-N 1 1 333.338 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CSCC[N@@H+]2Cc2ccccc2)s1 ZINC000617474763 1124589546 /nfs/dbraw/zinc/58/95/46/1124589546.db2.gz WJZSRFYWMCNMFY-AWEZNQCLSA-N 1 1 349.481 3.686 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)s1 ZINC000617474763 1124589550 /nfs/dbraw/zinc/58/95/50/1124589550.db2.gz WJZSRFYWMCNMFY-AWEZNQCLSA-N 1 1 349.481 3.686 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000068842009 1129402740 /nfs/dbraw/zinc/40/27/40/1129402740.db2.gz YBUAUBRFYVHSDA-QPJJXVBHSA-N 1 1 341.386 3.569 20 5 EHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000543447883 1129494479 /nfs/dbraw/zinc/49/44/79/1129494479.db2.gz FBRUKQFIZXNOIQ-SFHVURJKSA-N 1 1 328.412 3.676 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c(C(F)(F)F)c1 ZINC000390049142 1129602105 /nfs/dbraw/zinc/60/21/05/1129602105.db2.gz FOUFXAYQYJZNRJ-JTQLQIEISA-N 1 1 329.322 3.510 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330623888 1129641819 /nfs/dbraw/zinc/64/18/19/1129641819.db2.gz QIIWWNGJSKPQJN-CQSZACIVSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000330623888 1129641822 /nfs/dbraw/zinc/64/18/22/1129641822.db2.gz QIIWWNGJSKPQJN-CQSZACIVSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304730 1129660156 /nfs/dbraw/zinc/66/01/56/1129660156.db2.gz UJLAKCPTEFGDAT-LSDHHAIUSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032643 1129764519 /nfs/dbraw/zinc/76/45/19/1129764519.db2.gz SPQUPQLHOYTZMS-HIFRSBDPSA-N 1 1 331.441 3.979 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1 ZINC000304785580 1129902328 /nfs/dbraw/zinc/90/23/28/1129902328.db2.gz OKOPZWXTGXKPDX-GOEBONIOSA-N 1 1 332.425 3.744 20 5 EHBDMO CC[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246107120 1130344685 /nfs/dbraw/zinc/34/46/85/1130344685.db2.gz DJEJMQDPYMIZCT-NVXWUHKLSA-N 1 1 326.400 3.627 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107247 1130345597 /nfs/dbraw/zinc/34/55/97/1130345597.db2.gz DOGKNZKQZLWAKG-XJKCOSOUSA-N 1 1 342.399 3.798 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246198435 1130356006 /nfs/dbraw/zinc/35/60/06/1130356006.db2.gz AQECGINYVMOCIP-SJKOYZFVSA-N 1 1 334.803 3.975 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000730454182 1130711329 /nfs/dbraw/zinc/71/13/29/1130711329.db2.gz IONRHSXAXOMGDC-ZDUSSCGKSA-N 1 1 340.358 3.531 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCCC3(CCCCC3)C2)c1 ZINC000732190678 1130892138 /nfs/dbraw/zinc/89/21/38/1130892138.db2.gz KEFBZBVKWQKYMR-UHFFFAOYSA-N 1 1 328.416 3.948 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000738221954 1131464131 /nfs/dbraw/zinc/46/41/31/1131464131.db2.gz QFUGDAQOGSULIR-OAHLLOKOSA-N 1 1 334.445 3.510 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237611 1131465517 /nfs/dbraw/zinc/46/55/17/1131465517.db2.gz ANAAIQWZGNLNFJ-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO C[C@@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000741029548 1131571360 /nfs/dbraw/zinc/57/13/60/1131571360.db2.gz PPWVKMUTFQEQCA-LBPRGKRZSA-N 1 1 340.807 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](COCC3CC3)C1)CC2 ZINC001172919276 1131904158 /nfs/dbraw/zinc/90/41/58/1131904158.db2.gz FLKBJKLQVMIMJE-VQIMIIECSA-N 1 1 344.455 3.591 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224435 1132005696 /nfs/dbraw/zinc/00/56/96/1132005696.db2.gz FTZBDHPIQANQQO-CQSZACIVSA-N 1 1 326.396 3.593 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001173225506 1132006711 /nfs/dbraw/zinc/00/67/11/1132006711.db2.gz CTAUERXGTCDXFH-PBHICJAKSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C(=O)OC(C)(C)C ZINC001173225506 1132006716 /nfs/dbraw/zinc/00/67/16/1132006716.db2.gz CTAUERXGTCDXFH-PBHICJAKSA-N 1 1 348.443 3.722 20 5 EHBDMO COc1ccc(OCC[N@@H+]2Cc3ccccc3[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000744385196 1132085466 /nfs/dbraw/zinc/08/54/66/1132085466.db2.gz MXXGFTSPRNBWMS-CQSZACIVSA-N 1 1 342.395 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+](CCc2ccccc2)C2CC2)c1 ZINC000746023456 1132350770 /nfs/dbraw/zinc/35/07/70/1132350770.db2.gz VEOCYGMJQWNJRL-UHFFFAOYSA-N 1 1 336.395 3.609 20 5 EHBDMO CC(C)(C)OC(=O)NCc1cc(Nc2ccc([N+](=O)[O-])cc2)cc[nH+]1 ZINC001174476923 1132381114 /nfs/dbraw/zinc/38/11/14/1132381114.db2.gz CKVKPAUDNLGXHP-UHFFFAOYSA-N 1 1 344.371 3.758 20 5 EHBDMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169045714 1132642046 /nfs/dbraw/zinc/64/20/46/1132642046.db2.gz JTISPAKFDIDFTR-UKRRQHHQSA-N 1 1 330.350 3.973 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC001169604454 1132793018 /nfs/dbraw/zinc/79/30/18/1132793018.db2.gz MJSRNRVGEMEJCU-AWEZNQCLSA-N 1 1 334.441 3.988 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086170 1132830716 /nfs/dbraw/zinc/83/07/16/1132830716.db2.gz DKGPWNTXQIPIIS-XLIONFOSSA-N 1 1 338.407 3.767 20 5 EHBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000767542573 1133016277 /nfs/dbraw/zinc/01/62/77/1133016277.db2.gz PCIGDJPOASZUAT-UHFFFAOYSA-N 1 1 345.380 3.562 20 5 EHBDMO COCC[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000767943607 1133074589 /nfs/dbraw/zinc/07/45/89/1133074589.db2.gz ZPZLAXRSWLCVHC-CYBMUJFWSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)ccc1Cl ZINC000773700953 1133090757 /nfs/dbraw/zinc/09/07/57/1133090757.db2.gz LGFDFAWLESGVEF-UKRRQHHQSA-N 1 1 338.835 3.887 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000773699591 1133091178 /nfs/dbraw/zinc/09/11/78/1133091178.db2.gz IAJNUQAHLUBJJK-KGLIPLIRSA-N 1 1 338.835 3.887 20 5 EHBDMO CSCC[C@@H](C)[N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769462249 1133295119 /nfs/dbraw/zinc/29/51/19/1133295119.db2.gz CZOAGSNYNAJPOK-SNVBAGLBSA-N 1 1 347.278 3.931 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC2(CCC2)C1 ZINC000769447982 1133293108 /nfs/dbraw/zinc/29/31/08/1133293108.db2.gz VSPDUNRPNAWOPK-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCC2(CCC2)C1 ZINC000769447982 1133293113 /nfs/dbraw/zinc/29/31/13/1133293113.db2.gz VSPDUNRPNAWOPK-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769462249 1133295121 /nfs/dbraw/zinc/29/51/21/1133295121.db2.gz CZOAGSNYNAJPOK-SNVBAGLBSA-N 1 1 347.278 3.931 20 5 EHBDMO CCCC[N@@H+](CCOC)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001180266759 1133353245 /nfs/dbraw/zinc/35/32/45/1133353245.db2.gz CTQAGYIBGNJFMR-UHFFFAOYSA-N 1 1 334.338 3.862 20 5 EHBDMO COc1c(O)ccc(C[NH+]2CC([C@H]3CCC[C@H](C)C3)C2)c1[N+](=O)[O-] ZINC001183446438 1133807568 /nfs/dbraw/zinc/80/75/68/1133807568.db2.gz ZSCLUKOEYBCVIR-STQMWFEESA-N 1 1 334.416 3.567 20 5 EHBDMO Cc1cc(N2CCC[N@@H+](Cc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC001184681112 1133981232 /nfs/dbraw/zinc/98/12/32/1133981232.db2.gz JYWJEDDFYOGVHI-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746707733 1134038740 /nfs/dbraw/zinc/03/87/40/1134038740.db2.gz NMUMDBXPINZIEH-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774909431 1134117114 /nfs/dbraw/zinc/11/71/14/1134117114.db2.gz PZNCGOMEIYOVGD-SFHVURJKSA-N 1 1 341.367 3.667 20 5 EHBDMO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788671865 1134159980 /nfs/dbraw/zinc/15/99/80/1134159980.db2.gz ZPGRCALWYYPVTI-LKFCYVNXSA-N 1 1 333.775 3.615 20 5 EHBDMO CC[C@@H]1C[N@@H+](CC)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186440828 1134213126 /nfs/dbraw/zinc/21/31/26/1134213126.db2.gz GKBXHFFZYMOGNK-GFCCVEGCSA-N 1 1 331.338 3.534 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604449 1134581733 /nfs/dbraw/zinc/58/17/33/1134581733.db2.gz JPRXSFICEPHISE-XLIONFOSSA-N 1 1 340.423 3.735 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170329833 1134749516 /nfs/dbraw/zinc/74/95/16/1134749516.db2.gz VLHBXYQHMYVCNF-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C2CCC2)C2CCOCC2)c([N+](=O)[O-])c1 ZINC001170355519 1134754018 /nfs/dbraw/zinc/75/40/18/1134754018.db2.gz IBVVXTUZBBSREM-CQSZACIVSA-N 1 1 348.443 3.568 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2Cc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170345001 1134758263 /nfs/dbraw/zinc/75/82/63/1134758263.db2.gz GDUBNJHWYYWTGM-LBPRGKRZSA-N 1 1 330.359 3.689 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2Cc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170345001 1134758271 /nfs/dbraw/zinc/75/82/71/1134758271.db2.gz GDUBNJHWYYWTGM-LBPRGKRZSA-N 1 1 330.359 3.689 20 5 EHBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204365 1134815217 /nfs/dbraw/zinc/81/52/17/1134815217.db2.gz SQTXHELUKBAAOM-HOCLYGCPSA-N 1 1 326.824 3.884 20 5 EHBDMO CCC[C@@]1(C)CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259244 1134826941 /nfs/dbraw/zinc/82/69/41/1134826941.db2.gz UKFCWSXVAIDMSB-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259244 1134826949 /nfs/dbraw/zinc/82/69/49/1134826949.db2.gz UKFCWSXVAIDMSB-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001192200419 1134978769 /nfs/dbraw/zinc/97/87/69/1134978769.db2.gz RKNIRCUMWPCLJL-HNNXBMFYSA-N 1 1 333.432 3.682 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC001193020976 1135090554 /nfs/dbraw/zinc/09/05/54/1135090554.db2.gz FULUQMABZCZIJX-CYBMUJFWSA-N 1 1 331.416 3.600 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC001193020976 1135090558 /nfs/dbraw/zinc/09/05/58/1135090558.db2.gz FULUQMABZCZIJX-CYBMUJFWSA-N 1 1 331.416 3.600 20 5 EHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC001193818817 1135188410 /nfs/dbraw/zinc/18/84/10/1135188410.db2.gz JNPWWOJEOTXKPR-UWVAXJGDSA-N 1 1 344.455 3.807 20 5 EHBDMO CSc1ccccc1C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001193977157 1135209474 /nfs/dbraw/zinc/20/94/74/1135209474.db2.gz OTHXZDJJTSFJIV-UHFFFAOYSA-N 1 1 332.425 3.828 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC001196450618 1135568147 /nfs/dbraw/zinc/56/81/47/1135568147.db2.gz FNKARSSWVUBFMT-AWEZNQCLSA-N 1 1 330.428 3.855 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCCC[C@H](C)C1 ZINC000775732797 1135587643 /nfs/dbraw/zinc/58/76/43/1135587643.db2.gz WEUDHKFDKQGLAR-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCCC[C@H](C)C1 ZINC000775732797 1135587647 /nfs/dbraw/zinc/58/76/47/1135587647.db2.gz WEUDHKFDKQGLAR-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613675 1135589256 /nfs/dbraw/zinc/58/92/56/1135589256.db2.gz KVZAUSKWLRDCPT-LRPXVYOUSA-N 1 1 331.416 3.600 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@@H+]1CCCC[C@H]1C ZINC000807926239 1135591464 /nfs/dbraw/zinc/59/14/64/1135591464.db2.gz FYNXIYYKJSFAIB-CQSZACIVSA-N 1 1 333.432 3.864 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@H](C4CC4)C3)c2)c1 ZINC000808230092 1135633275 /nfs/dbraw/zinc/63/32/75/1135633275.db2.gz GWRPIHXARIERKT-INIZCTEOSA-N 1 1 326.400 3.538 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CC[C@H](O)c2ccccc2)C2CC2)cc1 ZINC000808741825 1135734466 /nfs/dbraw/zinc/73/44/66/1135734466.db2.gz QGAHWVXDGVMNBI-IBGZPJMESA-N 1 1 326.396 3.683 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921397 1135751079 /nfs/dbraw/zinc/75/10/79/1135751079.db2.gz SGZUWGYNFUVWLU-CQSZACIVSA-N 1 1 331.441 3.814 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809689163 1135872044 /nfs/dbraw/zinc/87/20/44/1135872044.db2.gz WBORULAPNJYXGD-UHFFFAOYSA-N 1 1 349.774 3.831 20 5 EHBDMO CO[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(F)(F)F ZINC000811479769 1136097471 /nfs/dbraw/zinc/09/74/71/1136097471.db2.gz LFJMRHKNDNTSQI-VIFPVBQESA-N 1 1 347.120 3.569 20 5 EHBDMO C[C@H](C1CC1)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271953 1136124368 /nfs/dbraw/zinc/12/43/68/1136124368.db2.gz PIGGULWUPYBOBQ-FOIQADDNSA-N 1 1 340.423 3.929 20 5 EHBDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276667 1136130927 /nfs/dbraw/zinc/13/09/27/1136130927.db2.gz IRXVKSUNGNNAQF-VQTJNVASSA-N 1 1 340.423 3.884 20 5 EHBDMO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000850434318 1136258338 /nfs/dbraw/zinc/25/83/38/1136258338.db2.gz WXNNFDFUZXHGGU-AWEZNQCLSA-N 1 1 343.427 3.910 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847512 1136259903 /nfs/dbraw/zinc/25/99/03/1136259903.db2.gz DSJZYOMGWITDER-SCLBCKFNSA-N 1 1 332.375 3.678 20 5 EHBDMO CCCC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813172144 1136297631 /nfs/dbraw/zinc/29/76/31/1136297631.db2.gz GODJRTARICGGEN-KRWDZBQOSA-N 1 1 346.427 3.683 20 5 EHBDMO CCCC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813172144 1136297633 /nfs/dbraw/zinc/29/76/33/1136297633.db2.gz GODJRTARICGGEN-KRWDZBQOSA-N 1 1 346.427 3.683 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cn3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000813329308 1136322455 /nfs/dbraw/zinc/32/24/55/1136322455.db2.gz OJIBROYPDICBRN-UONOGXRCSA-N 1 1 328.416 3.848 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000776591061 1136450975 /nfs/dbraw/zinc/45/09/75/1136450975.db2.gz GIIUWOLGLOPWRV-ZNOIYHFQSA-N 1 1 344.386 3.850 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589716 1136453020 /nfs/dbraw/zinc/45/30/20/1136453020.db2.gz VUPNDISZUILLIL-XOKHGSTOSA-N 1 1 330.384 3.694 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589714 1136453094 /nfs/dbraw/zinc/45/30/94/1136453094.db2.gz VUPNDISZUILLIL-KBRIMQKVSA-N 1 1 330.384 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](Cc2ccccc2F)CC2CC2)cc1 ZINC000852564659 1136467074 /nfs/dbraw/zinc/46/70/74/1136467074.db2.gz QKYAILTVSXPKSQ-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO C[C@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000853644266 1136552392 /nfs/dbraw/zinc/55/23/92/1136552392.db2.gz IEOTXLLPMLHBEH-GFCCVEGCSA-N 1 1 339.386 3.843 20 5 EHBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815617762 1136619553 /nfs/dbraw/zinc/61/95/53/1136619553.db2.gz VAKIUSLJICFBDO-BLLLJJGKSA-N 1 1 343.431 3.683 20 5 EHBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000859529386 1137018404 /nfs/dbraw/zinc/01/84/04/1137018404.db2.gz RIAIKFQGGKTHGC-CYBMUJFWSA-N 1 1 337.420 3.502 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706722 1137239761 /nfs/dbraw/zinc/23/97/61/1137239761.db2.gz WABVWJFZHJLYHW-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567283 1137295622 /nfs/dbraw/zinc/29/56/22/1137295622.db2.gz HKFVZVIZGOGWSX-GFCCVEGCSA-N 1 1 327.375 3.701 20 5 EHBDMO Cc1c([C@H](C)[NH2+]Cc2nc3cc(F)ccc3n2C)cccc1[N+](=O)[O-] ZINC000772994494 1137434434 /nfs/dbraw/zinc/43/44/34/1137434434.db2.gz ALHXCXXBRHYGBZ-LBPRGKRZSA-N 1 1 342.374 3.780 20 5 EHBDMO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039954 1137567134 /nfs/dbraw/zinc/56/71/34/1137567134.db2.gz WVDWBVCZCYYJPO-CJNGLKHVSA-N 1 1 332.375 3.898 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000872076606 1137570096 /nfs/dbraw/zinc/57/00/96/1137570096.db2.gz OCKAUYOBVUEJJG-FUDCBSFHSA-N 1 1 335.473 3.593 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](OC4CCC4)CC3)nc2c1 ZINC000872281814 1137577766 /nfs/dbraw/zinc/57/77/66/1137577766.db2.gz WDVQLDAXZZJEJA-HNNXBMFYSA-N 1 1 345.399 3.660 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c(F)c1 ZINC000872282420 1137577791 /nfs/dbraw/zinc/57/77/91/1137577791.db2.gz KFZIHBLTXCYLPB-CQSZACIVSA-N 1 1 340.370 3.797 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c(F)c1 ZINC000872282420 1137577792 /nfs/dbraw/zinc/57/77/92/1137577792.db2.gz KFZIHBLTXCYLPB-CQSZACIVSA-N 1 1 340.370 3.797 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1nc2cc(F)ccc2n1C ZINC000873053486 1137589021 /nfs/dbraw/zinc/58/90/21/1137589021.db2.gz BZIWLJSCXIOHKR-UHFFFAOYSA-N 1 1 342.374 3.527 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccccc1[N+](=O)[O-] ZINC000873184221 1137593108 /nfs/dbraw/zinc/59/31/08/1137593108.db2.gz HCCFLEMDTGIVAL-CYBMUJFWSA-N 1 1 328.368 3.607 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000874048327 1137609847 /nfs/dbraw/zinc/60/98/47/1137609847.db2.gz PNEKLSQOVXHYKC-HNNXBMFYSA-N 1 1 347.459 3.596 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966241 1137697467 /nfs/dbraw/zinc/69/74/67/1137697467.db2.gz DXQYDBVYFMXNAO-STQMWFEESA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878406065 1137714546 /nfs/dbraw/zinc/71/45/46/1137714546.db2.gz YFSPLCRPBKMDNU-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)o1 ZINC000878850498 1137730048 /nfs/dbraw/zinc/73/00/48/1137730048.db2.gz XAYCTWNRRQBJFC-GWCFXTLKSA-N 1 1 348.790 3.673 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)o1 ZINC000878850498 1137730049 /nfs/dbraw/zinc/73/00/49/1137730049.db2.gz XAYCTWNRRQBJFC-GWCFXTLKSA-N 1 1 348.790 3.673 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(OC)c1OC ZINC000879464424 1137748423 /nfs/dbraw/zinc/74/84/23/1137748423.db2.gz KNPPBLKDUCHYPV-OAHLLOKOSA-N 1 1 348.374 3.992 20 5 EHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000106876528 1137884831 /nfs/dbraw/zinc/88/48/31/1137884831.db2.gz FYLJRFXMKUTUMQ-LBPRGKRZSA-N 1 1 335.429 3.740 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCC3CCCC3)CC2)c(F)c1 ZINC000332334363 1137940295 /nfs/dbraw/zinc/94/02/95/1137940295.db2.gz ZSHYSXLGSMSGPO-UHFFFAOYSA-N 1 1 336.407 3.905 20 5 EHBDMO CN(C)C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915560 1137952018 /nfs/dbraw/zinc/95/20/18/1137952018.db2.gz VKQITJVTLWLCER-KRWDZBQOSA-N 1 1 333.819 3.641 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777134 1137960791 /nfs/dbraw/zinc/96/07/91/1137960791.db2.gz BVODMWWGHIFQFK-MJGOQNOKSA-N 1 1 344.386 3.822 20 5 EHBDMO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886251938 1138062585 /nfs/dbraw/zinc/06/25/85/1138062585.db2.gz ORAATKDXOYIDML-UHFFFAOYSA-N 1 1 335.791 3.677 20 5 EHBDMO C[N@@H+](CCOCC1CC1)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000088600182 1138194862 /nfs/dbraw/zinc/19/48/62/1138194862.db2.gz GQENHKNIGFENPF-UHFFFAOYSA-N 1 1 337.419 3.805 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000131347781 1138511569 /nfs/dbraw/zinc/51/15/69/1138511569.db2.gz VLKHPJUEGYATHL-HNNXBMFYSA-N 1 1 346.383 3.550 20 5 EHBDMO CCCn1nccc1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000337367247 1138546738 /nfs/dbraw/zinc/54/67/38/1138546738.db2.gz MTCARVANFSYGPB-UHFFFAOYSA-N 1 1 346.406 3.720 20 5 EHBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102207 1139735103 /nfs/dbraw/zinc/73/51/03/1139735103.db2.gz VGSZZPLDRXVUBH-RHSMWYFYSA-N 1 1 337.419 3.682 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000191122125 1140436818 /nfs/dbraw/zinc/43/68/18/1140436818.db2.gz CXELRIJOBOSHAC-INIZCTEOSA-N 1 1 346.358 3.746 20 5 EHBDMO COc1cc(C[NH+]2CCC(c3ccncc3)CC2)c([N+](=O)[O-])cc1F ZINC000191664265 1140477472 /nfs/dbraw/zinc/47/74/72/1140477472.db2.gz XYLQQPRTIRZPJY-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO C[C@@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192460141 1140534617 /nfs/dbraw/zinc/53/46/17/1140534617.db2.gz BFEMBQSIUVIRLB-UKRRQHHQSA-N 1 1 346.456 3.541 20 5 EHBDMO COC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000192924875 1140555977 /nfs/dbraw/zinc/55/59/77/1140555977.db2.gz KRBLYZDJWUOPQL-DLBZAZTESA-N 1 1 330.384 3.851 20 5 EHBDMO Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000266460981 1140690498 /nfs/dbraw/zinc/69/04/98/1140690498.db2.gz MDFKWKYDMGROIL-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000271128440 1141312308 /nfs/dbraw/zinc/31/23/08/1141312308.db2.gz LAIZTEMBCWBCRL-GJZGRUSLSA-N 1 1 349.500 3.539 20 5 EHBDMO CCc1ncc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000271221439 1141328217 /nfs/dbraw/zinc/32/82/17/1141328217.db2.gz ZLZXJPZKKRPNTH-UHFFFAOYSA-N 1 1 347.440 3.657 20 5 EHBDMO C[C@@H](NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271577497 1141401340 /nfs/dbraw/zinc/40/13/40/1141401340.db2.gz BAZBIDPVUNPTMO-ILXRZTDVSA-N 1 1 341.411 3.511 20 5 EHBDMO CO[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339139377 1141507882 /nfs/dbraw/zinc/50/78/82/1141507882.db2.gz DKRXAXFAEAVDRC-CQSZACIVSA-N 1 1 332.322 3.615 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339139377 1141507887 /nfs/dbraw/zinc/50/78/87/1141507887.db2.gz DKRXAXFAEAVDRC-CQSZACIVSA-N 1 1 332.322 3.615 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575523 1141522126 /nfs/dbraw/zinc/52/21/26/1141522126.db2.gz VOGCUFNGAHPJMZ-ZYHUDNBSSA-N 1 1 344.358 3.825 20 5 EHBDMO COc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)ccc1O ZINC000283124111 1141556819 /nfs/dbraw/zinc/55/68/19/1141556819.db2.gz NCSFNXDCLRYMDS-UHFFFAOYSA-N 1 1 346.358 3.613 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)ccc1O ZINC000283124111 1141556823 /nfs/dbraw/zinc/55/68/23/1141556823.db2.gz NCSFNXDCLRYMDS-UHFFFAOYSA-N 1 1 346.358 3.613 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCC[C@H](C)C1 ZINC000052160047 214120507 /nfs/dbraw/zinc/12/05/07/214120507.db2.gz KYXJZOWUMBHMGD-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO CC1(C)CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000078516558 217066677 /nfs/dbraw/zinc/06/66/77/217066677.db2.gz AGMWKGHXXGGZPD-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ncccc1C)C(C)C ZINC000430209223 1014968523 /nfs/dbraw/zinc/96/85/23/1014968523.db2.gz QPPUOIYBRXIGAM-QGZVFWFLSA-N 1 1 329.400 3.794 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000536672114 1032107035 /nfs/dbraw/zinc/10/70/35/1032107035.db2.gz ABRRICAXJBPNFX-PBHICJAKSA-N 1 1 326.396 3.981 20 5 EHBDMO CC(=O)c1ccc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044419 1015178920 /nfs/dbraw/zinc/17/89/20/1015178920.db2.gz JUNXAXLRHUVHRM-XJKSGUPXSA-N 1 1 345.443 3.862 20 5 EHBDMO O=C(CC[N@@H+](CC1CCCCC1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC001167094441 1015731046 /nfs/dbraw/zinc/73/10/46/1015731046.db2.gz PXBCSGHJXRMJQI-UHFFFAOYSA-N 1 1 345.443 3.968 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1(c2ccccc2)CC1 ZINC000189321991 1016505650 /nfs/dbraw/zinc/50/56/50/1016505650.db2.gz VGDBBEGETBQFCF-UHFFFAOYSA-N 1 1 337.379 3.900 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700918 1016790174 /nfs/dbraw/zinc/79/01/74/1016790174.db2.gz RYZCYCWYQFVSDN-HOTGVXAUSA-N 1 1 349.475 3.909 20 5 EHBDMO CC(C)[C@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414537034 1016963416 /nfs/dbraw/zinc/96/34/16/1016963416.db2.gz KNQIXLGXFHHONB-MRXNPFEDSA-N 1 1 338.835 3.885 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4cccc(F)c4)C3)nc2c1 ZINC000083170874 1032405647 /nfs/dbraw/zinc/40/56/47/1032405647.db2.gz AVFYGWYVPCSIGW-CYBMUJFWSA-N 1 1 341.342 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CC(C)C)CC(C)(C)C ZINC001168163308 1032431288 /nfs/dbraw/zinc/43/12/88/1032431288.db2.gz KIORIIKUCUUSRM-UHFFFAOYSA-N 1 1 335.448 3.846 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000449452048 1032570187 /nfs/dbraw/zinc/57/01/87/1032570187.db2.gz JRIZISPRDFTQIU-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO C[C@@H]([NH3+])[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656698 1017107059 /nfs/dbraw/zinc/10/70/59/1017107059.db2.gz IZXJBBZCULKIES-ZIAGYGMSSA-N 1 1 345.468 3.883 20 5 EHBDMO CC[C@@H]1C[C@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503961 1032686134 /nfs/dbraw/zinc/68/61/34/1032686134.db2.gz VGLPYUHZRPUFTF-HHXXYDBFSA-N 1 1 332.444 3.979 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449507236 1032691555 /nfs/dbraw/zinc/69/15/55/1032691555.db2.gz STLDSXKLSMUSKY-SUMWQHHRSA-N 1 1 330.384 3.712 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000377255646 1017545640 /nfs/dbraw/zinc/54/56/40/1017545640.db2.gz YKOKVIHNXNUBBM-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO Cc1ncc2c(n1)CCC[C@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892948792 1017911634 /nfs/dbraw/zinc/91/16/34/1017911634.db2.gz AQDTYALISJGKIX-CQSZACIVSA-N 1 1 332.791 3.514 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC[C@@H](C)[NH+]1CCCCC1 ZINC000468606007 1018018662 /nfs/dbraw/zinc/01/86/62/1018018662.db2.gz DXHPZVAWVQMDLH-HJUDDPQBSA-N 1 1 331.460 3.852 20 5 EHBDMO CC(C)[C@@H]1[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CC=CC2 ZINC000592446792 1032833842 /nfs/dbraw/zinc/83/38/42/1032833842.db2.gz ZKGBVFXRNPFDMG-SFHVURJKSA-N 1 1 343.427 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+]2C2CC2)c2ccncc21 ZINC000433812022 1019638222 /nfs/dbraw/zinc/63/82/22/1019638222.db2.gz TXVFYFJMSZQQTE-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000580984596 1020334110 /nfs/dbraw/zinc/33/41/10/1020334110.db2.gz OFXFYGGHCMQXGU-FVXMCEBTSA-N 1 1 349.434 3.745 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000326000045 1020667863 /nfs/dbraw/zinc/66/78/63/1020667863.db2.gz FPJKKVDKPRFDTG-UHOSZYNNSA-N 1 1 332.444 3.809 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CC[N@H+](C4CCCC4)C3)c2c1 ZINC000413129973 1020729471 /nfs/dbraw/zinc/72/94/71/1020729471.db2.gz QCVDMNXULMWJCX-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO CCOCc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602510544 1032945090 /nfs/dbraw/zinc/94/50/90/1032945090.db2.gz YTVFJVSRFVFKGW-UHFFFAOYSA-N 1 1 341.367 3.562 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2oc(CC)nc2C)cc1[N+](=O)[O-] ZINC000426339985 1021311482 /nfs/dbraw/zinc/31/14/82/1021311482.db2.gz OKPABWNIKANUAI-NSHDSACASA-N 1 1 333.388 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCN2CCCCCC2)o1 ZINC000518767834 1021520542 /nfs/dbraw/zinc/52/05/42/1021520542.db2.gz UAUGWNHKNLPOBT-UHFFFAOYSA-N 1 1 343.427 3.820 20 5 EHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670757 1021638885 /nfs/dbraw/zinc/63/88/85/1021638885.db2.gz RHBUNVPQVBMEIP-UONOGXRCSA-N 1 1 334.416 3.623 20 5 EHBDMO CCn1cc([C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000449665074 1033002581 /nfs/dbraw/zinc/00/25/81/1033002581.db2.gz DIZRRVGRILOUCS-CYBMUJFWSA-N 1 1 340.383 3.922 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000506705388 1021782856 /nfs/dbraw/zinc/78/28/56/1021782856.db2.gz GHVBPMFZJAIISQ-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000141537095 1033032749 /nfs/dbraw/zinc/03/27/49/1033032749.db2.gz PMYXDJUCNFOHLA-QGZVFWFLSA-N 1 1 345.446 3.698 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000602651341 1033041114 /nfs/dbraw/zinc/04/11/14/1033041114.db2.gz HEHDOBKMWJQISD-OAHLLOKOSA-N 1 1 344.333 3.616 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@@H]1Cc2c[nH+]cn2C1 ZINC000894995865 1022369512 /nfs/dbraw/zinc/36/95/12/1022369512.db2.gz QYMBCCIYXFYKRA-SSDOTTSWSA-N 1 1 346.696 3.500 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@H]1Cc2c[nH+]cn2C1 ZINC000894995866 1022369838 /nfs/dbraw/zinc/36/98/38/1022369838.db2.gz QYMBCCIYXFYKRA-ZETCQYMHSA-N 1 1 346.696 3.500 20 5 EHBDMO CC(C)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000438489439 1022710216 /nfs/dbraw/zinc/71/02/16/1022710216.db2.gz JIQFGKRFHAJVPN-HNNXBMFYSA-N 1 1 329.400 3.770 20 5 EHBDMO Cc1cc(C)c(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602682931 1033082578 /nfs/dbraw/zinc/08/25/78/1033082578.db2.gz VEOAUYOCZDQKOF-UHFFFAOYSA-N 1 1 339.317 3.915 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1(O)CCCCCC1 ZINC000426201016 1023083766 /nfs/dbraw/zinc/08/37/66/1023083766.db2.gz LDDRLKWHVHDPIZ-UHFFFAOYSA-N 1 1 326.824 3.765 20 5 EHBDMO Cc1ccn2c(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cnc2c1 ZINC000507172256 1023174265 /nfs/dbraw/zinc/17/42/65/1023174265.db2.gz ABUGJJBMQIULMH-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729730 1033118246 /nfs/dbraw/zinc/11/82/46/1033118246.db2.gz CAHQMEWWSUYBLG-HKUYNNGSSA-N 1 1 326.396 3.601 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](O)C[C@H]1c1ccccc1 ZINC000602729763 1033118349 /nfs/dbraw/zinc/11/83/49/1033118349.db2.gz CLMOGNKHTAMATJ-MOPGFXCFSA-N 1 1 326.396 3.601 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)CC2(CO)CC2)c(F)c1 ZINC000341959539 1023721066 /nfs/dbraw/zinc/72/10/66/1023721066.db2.gz AGWHNEBCWWNAJM-UHFFFAOYSA-N 1 1 344.386 3.509 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)CC2(CO)CC2)c(F)c1 ZINC000341959539 1023721072 /nfs/dbraw/zinc/72/10/72/1023721072.db2.gz AGWHNEBCWWNAJM-UHFFFAOYSA-N 1 1 344.386 3.509 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000602767469 1033165525 /nfs/dbraw/zinc/16/55/25/1033165525.db2.gz QYESDBMQVRBSTR-HNNXBMFYSA-N 1 1 334.807 3.590 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(F)(c3cccnc3)CC2)c(F)c1 ZINC000342122693 1024175486 /nfs/dbraw/zinc/17/54/86/1024175486.db2.gz GVIJAJVHXMMUPP-UHFFFAOYSA-N 1 1 333.338 3.590 20 5 EHBDMO CCCn1ccnc1CCC[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247226 1024327257 /nfs/dbraw/zinc/32/72/57/1024327257.db2.gz PYUYPHVJQZWDDH-HNNXBMFYSA-N 1 1 330.432 3.827 20 5 EHBDMO COc1cc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000430096147 1024359326 /nfs/dbraw/zinc/35/93/26/1024359326.db2.gz FVEJGJUOHASEJX-KRWDZBQOSA-N 1 1 334.416 3.623 20 5 EHBDMO COc1cc(C[N@H+]2CC3(CCC3)[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000430096147 1024359343 /nfs/dbraw/zinc/35/93/43/1024359343.db2.gz FVEJGJUOHASEJX-KRWDZBQOSA-N 1 1 334.416 3.623 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434980407 1024535366 /nfs/dbraw/zinc/53/53/66/1024535366.db2.gz DPMBWIHZICMKBJ-LJQANCHMSA-N 1 1 348.406 3.942 20 5 EHBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)ccc2[nH+]1 ZINC000538936675 1024626703 /nfs/dbraw/zinc/62/67/03/1024626703.db2.gz IBHURFXSOHCXAT-UHFFFAOYSA-N 1 1 334.282 3.896 20 5 EHBDMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000346664914 1025001185 /nfs/dbraw/zinc/00/11/85/1025001185.db2.gz IALFIVWFFQNPMC-QGZVFWFLSA-N 1 1 341.411 3.667 20 5 EHBDMO CC(C)c1ccc(CNC[C@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948060 1025136064 /nfs/dbraw/zinc/13/60/64/1025136064.db2.gz QHTVJEGMJLQFPD-HOTGVXAUSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(CNC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948060 1025136071 /nfs/dbraw/zinc/13/60/71/1025136071.db2.gz QHTVJEGMJLQFPD-HOTGVXAUSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)cc1[N+](=O)[O-] ZINC000521083816 1025193267 /nfs/dbraw/zinc/19/32/67/1025193267.db2.gz XCKFYDNRMLBWTC-LJQANCHMSA-N 1 1 334.460 3.949 20 5 EHBDMO C[C@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000521402550 1025370898 /nfs/dbraw/zinc/37/08/98/1025370898.db2.gz POBDRATUUDVHJT-CYBMUJFWSA-N 1 1 329.375 3.593 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000521476560 1025413282 /nfs/dbraw/zinc/41/32/82/1025413282.db2.gz GYCYLPMZGMCNNF-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000521476560 1025413295 /nfs/dbraw/zinc/41/32/95/1025413295.db2.gz GYCYLPMZGMCNNF-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(Cl)cc1O ZINC000896509395 1025492310 /nfs/dbraw/zinc/49/23/10/1025492310.db2.gz DNBPMNGKHRLBOF-SNVBAGLBSA-N 1 1 336.775 3.813 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@@H+](C)CCCO)cc2[N+](=O)[O-])cc1 ZINC000442963338 1025624642 /nfs/dbraw/zinc/62/46/42/1025624642.db2.gz GGCSNNKPHPEGKR-UHFFFAOYSA-N 1 1 346.452 3.869 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425557014 1025725504 /nfs/dbraw/zinc/72/55/04/1025725504.db2.gz VNOWHFQQZBIYKM-RDTXWAMCSA-N 1 1 330.428 3.937 20 5 EHBDMO CC(C)(C)c1ccc([C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478429964 1026116938 /nfs/dbraw/zinc/11/69/38/1026116938.db2.gz QJGDQKWPQAIORI-QGZVFWFLSA-N 1 1 342.443 3.926 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@]3(CCOC3)C2)c1 ZINC000451907998 1026374093 /nfs/dbraw/zinc/37/40/93/1026374093.db2.gz IOSRDSZRULONMO-HNNXBMFYSA-N 1 1 344.333 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@]3(CCOC3)C2)c1 ZINC000451907998 1026374109 /nfs/dbraw/zinc/37/41/09/1026374109.db2.gz IOSRDSZRULONMO-HNNXBMFYSA-N 1 1 344.333 3.616 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000475289816 1026446555 /nfs/dbraw/zinc/44/65/55/1026446555.db2.gz DRFHGDJKNPVPDK-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000452124256 1026492795 /nfs/dbraw/zinc/49/27/95/1026492795.db2.gz WFOCLNLHSFQEQU-CQSZACIVSA-N 1 1 345.365 3.528 20 5 EHBDMO COc1cccc(N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000475394559 1026557929 /nfs/dbraw/zinc/55/79/29/1026557929.db2.gz WLWZULMALJSBFH-CVEARBPZSA-N 1 1 347.459 3.694 20 5 EHBDMO COc1cccc(N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000475394561 1026558516 /nfs/dbraw/zinc/55/85/16/1026558516.db2.gz WLWZULMALJSBFH-HOTGVXAUSA-N 1 1 347.459 3.694 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(c2ccccc2)C1 ZINC000531378679 1026849003 /nfs/dbraw/zinc/84/90/03/1026849003.db2.gz WWKMICAQNCWYCF-GOSISDBHSA-N 1 1 325.412 3.696 20 5 EHBDMO Cc1cc(F)ccc1[C@@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135220220 1027042718 /nfs/dbraw/zinc/04/27/18/1027042718.db2.gz XOJBCGYXCVBRGI-IBGZPJMESA-N 1 1 344.386 3.740 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000501809715 1027540453 /nfs/dbraw/zinc/54/04/53/1027540453.db2.gz LORZGUITBMJYNN-QGZVFWFLSA-N 1 1 326.396 3.681 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@H]1C ZINC000444676937 1028145408 /nfs/dbraw/zinc/14/54/08/1028145408.db2.gz OUDUGSSSDXMYDO-DYVFJYSZSA-N 1 1 334.416 3.862 20 5 EHBDMO CCc1ccc([C@@H](NC2CCC([NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423229143 1028294539 /nfs/dbraw/zinc/29/45/39/1028294539.db2.gz GMJHLLOOEWITMS-ZOJXTTQQSA-N 1 1 343.427 3.699 20 5 EHBDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358469 1028308799 /nfs/dbraw/zinc/30/87/99/1028308799.db2.gz BZTHAJCRWQMSRS-KBPBESRZSA-N 1 1 346.452 3.774 20 5 EHBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358475 1028309537 /nfs/dbraw/zinc/30/95/37/1028309537.db2.gz BZTHAJCRWQMSRS-ZIAGYGMSSA-N 1 1 346.452 3.774 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](CCO)CC2)o1 ZINC000421391203 1028367359 /nfs/dbraw/zinc/36/73/59/1028367359.db2.gz AANQSGQXYLPFKY-OAHLLOKOSA-N 1 1 344.411 3.839 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC000523701852 1028555844 /nfs/dbraw/zinc/55/58/44/1028555844.db2.gz NCVLGUZIKZMKKG-LJQANCHMSA-N 1 1 328.387 3.984 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000179171917 1029065071 /nfs/dbraw/zinc/06/50/71/1029065071.db2.gz AYOKBNABWFIYSE-ACJLOTCBSA-N 1 1 349.862 3.697 20 5 EHBDMO CC[C@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000532976401 1029133944 /nfs/dbraw/zinc/13/39/44/1029133944.db2.gz IAZIZMINETVYKS-HNNXBMFYSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC1CCC([N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533310033 1029592172 /nfs/dbraw/zinc/59/21/72/1029592172.db2.gz GJYFQBLBUSDKRC-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(F)c(Cl)c3)nc2c1 ZINC000446835369 1029816011 /nfs/dbraw/zinc/81/60/11/1029816011.db2.gz OFLUMOMVGWSGMU-UHFFFAOYSA-N 1 1 334.738 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000555965741 1029994234 /nfs/dbraw/zinc/99/42/34/1029994234.db2.gz VISXFELVKXLLGY-UHFFFAOYSA-N 1 1 348.447 3.550 20 5 EHBDMO CC(C)Cn1ccnc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898476 1030010100 /nfs/dbraw/zinc/01/01/00/1030010100.db2.gz YFZLYMITNQCCMA-KRWDZBQOSA-N 1 1 328.416 3.615 20 5 EHBDMO Cc1ccc2[nH]c(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000447560894 1030304253 /nfs/dbraw/zinc/30/42/53/1030304253.db2.gz GBYGCPGPOJUDHR-MRXNPFEDSA-N 1 1 336.395 3.947 20 5 EHBDMO Cc1ccc2nc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000447560894 1030304270 /nfs/dbraw/zinc/30/42/70/1030304270.db2.gz GBYGCPGPOJUDHR-MRXNPFEDSA-N 1 1 336.395 3.947 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691254 1030587713 /nfs/dbraw/zinc/58/77/13/1030587713.db2.gz GHNMILYFGPUNRQ-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623393 1030793561 /nfs/dbraw/zinc/79/35/61/1030793561.db2.gz AFUFJFGCNGIEKP-ABAIWWIYSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000533928272 1031284549 /nfs/dbraw/zinc/28/45/49/1031284549.db2.gz OQJXQIZTHKQKBU-CQSZACIVSA-N 1 1 345.443 3.908 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000533928272 1031284557 /nfs/dbraw/zinc/28/45/57/1031284557.db2.gz OQJXQIZTHKQKBU-CQSZACIVSA-N 1 1 345.443 3.908 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026224421 1031389218 /nfs/dbraw/zinc/38/92/18/1031389218.db2.gz RYOWZQYWNKUWNM-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000475741017 1031736506 /nfs/dbraw/zinc/73/65/06/1031736506.db2.gz WHJUIDMUBJQCLR-NFAWXSAZSA-N 1 1 333.432 3.598 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543852931 1031797958 /nfs/dbraw/zinc/79/79/58/1031797958.db2.gz PRYCWEAWKJGSRW-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000052907659 1032000564 /nfs/dbraw/zinc/00/05/64/1032000564.db2.gz APTCORVEGMEDKO-HNNXBMFYSA-N 1 1 341.411 3.559 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603054321 1033328953 /nfs/dbraw/zinc/32/89/53/1033328953.db2.gz IJXHOYSNPPILOL-GFCCVEGCSA-N 1 1 332.404 3.759 20 5 EHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485937 1033367150 /nfs/dbraw/zinc/36/71/50/1033367150.db2.gz TZRWEYUWGDVNRN-UKRRQHHQSA-N 1 1 334.445 3.508 20 5 EHBDMO CCOc1cccc(N(C)CCC[N@@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000343806232 1033450925 /nfs/dbraw/zinc/45/09/25/1033450925.db2.gz KIZCGKUKOJAAQF-UHFFFAOYSA-N 1 1 347.415 3.545 20 5 EHBDMO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011624 1033606101 /nfs/dbraw/zinc/60/61/01/1033606101.db2.gz CKLHOEWQXWUBDC-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595018518 1033612237 /nfs/dbraw/zinc/61/22/37/1033612237.db2.gz QWSHESBIGADCRJ-ZDUSSCGKSA-N 1 1 330.384 3.853 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057269 1033635168 /nfs/dbraw/zinc/63/51/68/1033635168.db2.gz VYNJIYOEZZSXNR-ZFWWWQNUSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057269 1033635181 /nfs/dbraw/zinc/63/51/81/1033635181.db2.gz VYNJIYOEZZSXNR-ZFWWWQNUSA-N 1 1 335.448 3.517 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599058118 1033698882 /nfs/dbraw/zinc/69/88/82/1033698882.db2.gz REFXUFPBAQFOMR-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO Cc1noc(C[N@H+](CCc2ccc(F)cc2)CC(C)C)c1[N+](=O)[O-] ZINC000595297573 1033719921 /nfs/dbraw/zinc/71/99/21/1033719921.db2.gz WQLOKAOQTBZLEX-UHFFFAOYSA-N 1 1 335.379 3.731 20 5 EHBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000595285352 1033725270 /nfs/dbraw/zinc/72/52/70/1033725270.db2.gz WOUJCYDMTUWDBB-UHFFFAOYSA-N 1 1 343.402 3.966 20 5 EHBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000595285352 1033725287 /nfs/dbraw/zinc/72/52/87/1033725287.db2.gz WOUJCYDMTUWDBB-UHFFFAOYSA-N 1 1 343.402 3.966 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593714845 1033821630 /nfs/dbraw/zinc/82/16/30/1033821630.db2.gz CISZPBQBTKJFCB-VXIBKDFQSA-N 1 1 342.395 3.749 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](CCCc3ccccc3)CC2)s1 ZINC000608779505 1033885509 /nfs/dbraw/zinc/88/55/09/1033885509.db2.gz XAAIRYGYDCBDBR-UHFFFAOYSA-N 1 1 345.468 3.801 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)ccc1[N+](=O)[O-] ZINC000537606441 1033950030 /nfs/dbraw/zinc/95/00/30/1033950030.db2.gz UBGKZCJWILNCEG-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)ccc1[N+](=O)[O-] ZINC000537606441 1033950046 /nfs/dbraw/zinc/95/00/46/1033950046.db2.gz UBGKZCJWILNCEG-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841252 1033964679 /nfs/dbraw/zinc/96/46/79/1033964679.db2.gz ZRQVWDSMAGYQGP-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO CCOc1ccccc1C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603856623 1033980699 /nfs/dbraw/zinc/98/06/99/1033980699.db2.gz MUXDKOKLPJRKGM-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040696 1033991238 /nfs/dbraw/zinc/99/12/38/1033991238.db2.gz KHHBTPGEDQCPMW-GOSISDBHSA-N 1 1 342.395 3.819 20 5 EHBDMO CCC(O)(CC)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599673656 1034081102 /nfs/dbraw/zinc/08/11/02/1034081102.db2.gz SOJZJAPTJYMONA-UHFFFAOYSA-N 1 1 334.338 3.597 20 5 EHBDMO COCCCOc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179316834 1034108336 /nfs/dbraw/zinc/10/83/36/1034108336.db2.gz CAKLEXXTAQVLDI-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO COCCCOc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179316834 1034108343 /nfs/dbraw/zinc/10/83/43/1034108343.db2.gz CAKLEXXTAQVLDI-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075837934 1034576045 /nfs/dbraw/zinc/57/60/45/1034576045.db2.gz OBWKOBGVEFIYNQ-XPKDYRNWSA-N 1 1 342.399 3.798 20 5 EHBDMO CCc1ccc([C@H](NCCC2(C[NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593321497 1034646711 /nfs/dbraw/zinc/64/67/11/1034646711.db2.gz XVNBZDBEHFIFPO-GOSISDBHSA-N 1 1 343.427 3.558 20 5 EHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411147586 1034791486 /nfs/dbraw/zinc/79/14/86/1034791486.db2.gz PLAMBMCJPROTFC-GFCCVEGCSA-N 1 1 345.424 3.604 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000612404325 1034894838 /nfs/dbraw/zinc/89/48/38/1034894838.db2.gz DOKKAPMHWBHEAB-CQSZACIVSA-N 1 1 342.443 3.863 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CCc3[nH+]c[nH]c3C2)c(Cl)c1 ZINC000580017511 1035385031 /nfs/dbraw/zinc/38/50/31/1035385031.db2.gz NIEFYKFFHGGLJD-ZETCQYMHSA-N 1 1 327.171 3.594 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CCc3[nH]c[nH+]c3C2)c(Cl)c1 ZINC000580017511 1035385037 /nfs/dbraw/zinc/38/50/37/1035385037.db2.gz NIEFYKFFHGGLJD-ZETCQYMHSA-N 1 1 327.171 3.594 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000613383390 1035722776 /nfs/dbraw/zinc/72/27/76/1035722776.db2.gz KRTLJPVIDFXXCS-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000535068413 1035986739 /nfs/dbraw/zinc/98/67/39/1035986739.db2.gz MSYYFJOYLZZKQJ-XQRVVYSFSA-N 1 1 340.379 3.511 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000463951745 1035994253 /nfs/dbraw/zinc/99/42/53/1035994253.db2.gz BVQRSDNXQODSDR-LSDHHAIUSA-N 1 1 348.447 3.596 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1OC ZINC000892560928 1036097292 /nfs/dbraw/zinc/09/72/92/1036097292.db2.gz JRUVNUZMZAWKPN-CQSZACIVSA-N 1 1 346.383 3.559 20 5 EHBDMO CCC(CC)[N@@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588977253 1036207064 /nfs/dbraw/zinc/20/70/64/1036207064.db2.gz FKYKSFNBPQIAMK-UHFFFAOYSA-N 1 1 327.812 3.697 20 5 EHBDMO CCOc1cc(C[N@@H+](C[C@H](C)O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492787754 1036294442 /nfs/dbraw/zinc/29/44/42/1036294442.db2.gz GMOSIMRNLDNMLK-AWEZNQCLSA-N 1 1 336.432 3.509 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000165264700 1036351301 /nfs/dbraw/zinc/35/13/01/1036351301.db2.gz YMWYAQLXUIJUPY-MRXNPFEDSA-N 1 1 345.443 3.886 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000026223567 1036395105 /nfs/dbraw/zinc/39/51/05/1036395105.db2.gz ZMZOEBVGZYVCTQ-UHFFFAOYSA-N 1 1 341.411 3.618 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC000589495339 1036436368 /nfs/dbraw/zinc/43/63/68/1036436368.db2.gz QBKWEDKSHSCMRY-HNNXBMFYSA-N 1 1 346.408 3.780 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000589495339 1036436373 /nfs/dbraw/zinc/43/63/73/1036436373.db2.gz QBKWEDKSHSCMRY-HNNXBMFYSA-N 1 1 346.408 3.780 20 5 EHBDMO Cc1ccc(CNc2cc(C)c([N+](=O)[O-])cc2F)c(N2CCCC2)[nH+]1 ZINC000589690303 1036592573 /nfs/dbraw/zinc/59/25/73/1036592573.db2.gz INJNZRPKHMLHER-UHFFFAOYSA-N 1 1 344.390 3.958 20 5 EHBDMO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537290 1037023132 /nfs/dbraw/zinc/02/31/32/1037023132.db2.gz IDKLLCCPWLDPFB-CZUORRHYSA-N 1 1 328.416 3.552 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC(C)(C)O ZINC000539824498 1037227578 /nfs/dbraw/zinc/22/75/78/1037227578.db2.gz AFQADAHRPZHUSQ-UHFFFAOYSA-N 1 1 334.441 3.916 20 5 EHBDMO CCC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824620 1037227698 /nfs/dbraw/zinc/22/76/98/1037227698.db2.gz JBFXZQMYXOGVGJ-CQSZACIVSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824620 1037227702 /nfs/dbraw/zinc/22/77/02/1037227702.db2.gz JBFXZQMYXOGVGJ-CQSZACIVSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@H](O)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850728 1037280311 /nfs/dbraw/zinc/28/03/11/1037280311.db2.gz OVBWTWHPUMFJCJ-KEEQEYLASA-N 1 1 340.423 3.881 20 5 EHBDMO C[N@@H+](CCOCC1CC1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000539863382 1037292245 /nfs/dbraw/zinc/29/22/45/1037292245.db2.gz ZHBYNFRIAWPSBD-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c1 ZINC000462701931 1037302528 /nfs/dbraw/zinc/30/25/28/1037302528.db2.gz PBXMVOLFWPTPRM-CQSZACIVSA-N 1 1 331.441 3.848 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1cccs1)C(C)C ZINC000532483764 1037521297 /nfs/dbraw/zinc/52/12/97/1037521297.db2.gz YCCSVLQMEKXWFL-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1cccs1)C(C)C ZINC000532483764 1037521312 /nfs/dbraw/zinc/52/13/12/1037521312.db2.gz YCCSVLQMEKXWFL-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786891 1037532460 /nfs/dbraw/zinc/53/24/60/1037532460.db2.gz GTABYMUDLFIOSS-GLJUWKHASA-N 1 1 344.411 3.836 20 5 EHBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000491595645 1037576249 /nfs/dbraw/zinc/57/62/49/1037576249.db2.gz CDVYCOQPSXPJTF-ZDUSSCGKSA-N 1 1 333.457 3.611 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000045951464 1037582498 /nfs/dbraw/zinc/58/24/98/1037582498.db2.gz HVHXCBFHPXNIBE-HNNXBMFYSA-N 1 1 348.447 3.679 20 5 EHBDMO O=[N+]([O-])c1ncccc1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000591827501 1037639575 /nfs/dbraw/zinc/63/95/75/1037639575.db2.gz QHVBNVTWFAGDFM-HNNXBMFYSA-N 1 1 329.425 3.747 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000463198571 1037864635 /nfs/dbraw/zinc/86/46/35/1037864635.db2.gz NKMMWJVLBOQQFG-LZLYRXPVSA-N 1 1 348.443 3.509 20 5 EHBDMO CC1(C)C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1 ZINC000378345055 1038485081 /nfs/dbraw/zinc/48/50/81/1038485081.db2.gz GSYWNQAWAYAOQY-UHFFFAOYSA-N 1 1 347.440 3.719 20 5 EHBDMO CC1(C)C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1 ZINC000378345055 1038485090 /nfs/dbraw/zinc/48/50/90/1038485090.db2.gz GSYWNQAWAYAOQY-UHFFFAOYSA-N 1 1 347.440 3.719 20 5 EHBDMO Cc1cccc(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000569216876 1039699032 /nfs/dbraw/zinc/69/90/32/1039699032.db2.gz CBEWNHOFBSBZRW-KRWDZBQOSA-N 1 1 325.412 3.720 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000417347370 1039711062 /nfs/dbraw/zinc/71/10/62/1039711062.db2.gz HAQHCGVBQVHKQZ-JLZZUVOBSA-N 1 1 326.400 3.854 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2oc(=O)oc2c1 ZINC000893945965 1039868447 /nfs/dbraw/zinc/86/84/47/1039868447.db2.gz QYXBFXYDMRTZLA-UHFFFAOYSA-N 1 1 342.351 3.705 20 5 EHBDMO CC(C)CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC1 ZINC000128285111 1040287572 /nfs/dbraw/zinc/28/75/72/1040287572.db2.gz QSKNMUKVOMYTHA-UHFFFAOYSA-N 1 1 337.395 3.573 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000490038759 1040306003 /nfs/dbraw/zinc/30/60/03/1040306003.db2.gz AEFIMTHKCRHYSB-QGZVFWFLSA-N 1 1 341.411 3.550 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)c(F)c1 ZINC000491091653 1040916062 /nfs/dbraw/zinc/91/60/62/1040916062.db2.gz QBRCUFAPSRNISS-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c(F)c1 ZINC000491091653 1040916079 /nfs/dbraw/zinc/91/60/79/1040916079.db2.gz QBRCUFAPSRNISS-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC000570894473 1040968526 /nfs/dbraw/zinc/96/85/26/1040968526.db2.gz XFFCQUIRPAOKGV-SUYBPPKGSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCC[C@H]12 ZINC000570894473 1040968548 /nfs/dbraw/zinc/96/85/48/1040968548.db2.gz XFFCQUIRPAOKGV-SUYBPPKGSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000054981070 1041091731 /nfs/dbraw/zinc/09/17/31/1041091731.db2.gz KEYUIKSVPRIXEO-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC[C@H](C)C1 ZINC000481604703 1041146292 /nfs/dbraw/zinc/14/62/92/1041146292.db2.gz ZYHVPOVZUUZLIJ-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@H](C)C1 ZINC000481604703 1041146297 /nfs/dbraw/zinc/14/62/97/1041146297.db2.gz ZYHVPOVZUUZLIJ-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000108931330 1042111615 /nfs/dbraw/zinc/11/16/15/1042111615.db2.gz SUDWGEYMFBSNFY-QLFBSQMISA-N 1 1 342.443 3.921 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCC(F)(F)F ZINC000104676693 1042280450 /nfs/dbraw/zinc/28/04/50/1042280450.db2.gz NNMMFWPLLFFKHY-UHFFFAOYSA-N 1 1 343.305 3.677 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593192 1042376711 /nfs/dbraw/zinc/37/67/11/1042376711.db2.gz PTUAHWYBLSWISY-INIZCTEOSA-N 1 1 326.396 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1F ZINC000291235462 1042789846 /nfs/dbraw/zinc/78/98/46/1042789846.db2.gz UMBLVXLIQURAOC-LESCRADOSA-N 1 1 336.407 3.640 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979135 1042829631 /nfs/dbraw/zinc/82/96/31/1042829631.db2.gz RTSDFQUPLIEAJK-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979135 1042829635 /nfs/dbraw/zinc/82/96/35/1042829635.db2.gz RTSDFQUPLIEAJK-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898517 1043598448 /nfs/dbraw/zinc/59/84/48/1043598448.db2.gz YMKUBPLKMLTKQD-KBXCAEBGSA-N 1 1 328.416 3.926 20 5 EHBDMO Cc1ccc(CN2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610291 /nfs/dbraw/zinc/61/02/91/1043610291.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 1 1 345.487 3.990 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3Cc3ccccc3)nc2c1 ZINC000344698890 1044302224 /nfs/dbraw/zinc/30/22/24/1044302224.db2.gz IWGBGDOFWMHQHL-OAHLLOKOSA-N 1 1 336.395 3.678 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039956 1127568706 /nfs/dbraw/zinc/56/87/06/1127568706.db2.gz USRGYCZPIAHOLJ-HIFRSBDPSA-N 1 1 348.472 3.816 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301286493 1127733483 /nfs/dbraw/zinc/73/34/83/1127733483.db2.gz ROJDZOQVEJPZPH-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO COc1cc2c(cc1OC)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000075618114 1128352800 /nfs/dbraw/zinc/35/28/00/1128352800.db2.gz VWNUAINYFKPBBL-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000075618114 1128352803 /nfs/dbraw/zinc/35/28/03/1128352803.db2.gz VWNUAINYFKPBBL-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000301479812 1128468218 /nfs/dbraw/zinc/46/82/18/1128468218.db2.gz NQIWRUHVONMVPK-MRXNPFEDSA-N 1 1 341.411 3.680 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000301581783 1128500489 /nfs/dbraw/zinc/50/04/89/1128500489.db2.gz PRELDAMHWFKVFH-DOMZBBRYSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000301581783 1128500493 /nfs/dbraw/zinc/50/04/93/1128500493.db2.gz PRELDAMHWFKVFH-DOMZBBRYSA-N 1 1 345.424 3.820 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301590276 1128505898 /nfs/dbraw/zinc/50/58/98/1128505898.db2.gz CSRFPFDYMLKVSO-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2COC)c1 ZINC000091457241 1128668008 /nfs/dbraw/zinc/66/80/08/1128668008.db2.gz CAHKXBLBLXVXGD-UHFFFAOYSA-N 1 1 343.427 3.805 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c2ncccc12 ZINC000715715949 1128810615 /nfs/dbraw/zinc/81/06/15/1128810615.db2.gz VESHJPTWEKZESQ-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO COCC[C@H]1CCCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000494634817 1120708417 /nfs/dbraw/zinc/70/84/17/1120708417.db2.gz DWNOQROPNMWIIZ-CYBMUJFWSA-N 1 1 326.824 3.887 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@H]21 ZINC000301716086 1128980449 /nfs/dbraw/zinc/98/04/49/1128980449.db2.gz NDFLOTNZLVAZKD-BXUZGUMPSA-N 1 1 343.349 3.534 20 5 EHBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000489839683 1122085778 /nfs/dbraw/zinc/08/57/78/1122085778.db2.gz SMZUSXZPIHGWPA-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000489839683 1122085784 /nfs/dbraw/zinc/08/57/84/1122085784.db2.gz SMZUSXZPIHGWPA-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@H]2CCc3ccccc32)ccc1Cl ZINC000153913635 1122107014 /nfs/dbraw/zinc/10/70/14/1122107014.db2.gz XBJZYSKZGRRNQX-KRWDZBQOSA-N 1 1 346.814 3.730 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2Cc2ccccc2Cl)c(C)c1[N+](=O)[O-] ZINC000919954378 1123245292 /nfs/dbraw/zinc/24/52/92/1123245292.db2.gz OXBCEEFXTWISLK-OAHLLOKOSA-N 1 1 348.834 3.726 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)c(C)c1[N+](=O)[O-] ZINC000919954378 1123245293 /nfs/dbraw/zinc/24/52/93/1123245293.db2.gz OXBCEEFXTWISLK-OAHLLOKOSA-N 1 1 348.834 3.726 20 5 EHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315893 1123374521 /nfs/dbraw/zinc/37/45/21/1123374521.db2.gz IQSGGOIHQPGAQQ-HNNXBMFYSA-N 1 1 326.396 3.983 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)cs1 ZINC000114193014 1129123849 /nfs/dbraw/zinc/12/38/49/1129123849.db2.gz NJSRJWHSLFRISS-INIZCTEOSA-N 1 1 332.425 3.528 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@H]2CCCc3ccccc32)cs1 ZINC000114193014 1129123853 /nfs/dbraw/zinc/12/38/53/1129123853.db2.gz NJSRJWHSLFRISS-INIZCTEOSA-N 1 1 332.425 3.528 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631909 1123635123 /nfs/dbraw/zinc/63/51/23/1123635123.db2.gz MUMZMQFNIXYZOR-AWEZNQCLSA-N 1 1 334.416 3.719 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000114469302 1129149224 /nfs/dbraw/zinc/14/92/24/1129149224.db2.gz QJMSPUQSZUHKNO-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000114469302 1129149227 /nfs/dbraw/zinc/14/92/27/1129149227.db2.gz QJMSPUQSZUHKNO-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615806902 1123878940 /nfs/dbraw/zinc/87/89/40/1123878940.db2.gz APGHHRGIWBHKOX-LBPRGKRZSA-N 1 1 343.305 3.899 20 5 EHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615806902 1123878945 /nfs/dbraw/zinc/87/89/45/1123878945.db2.gz APGHHRGIWBHKOX-LBPRGKRZSA-N 1 1 343.305 3.899 20 5 EHBDMO CCc1ccc([C@H](COC)[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])o1 ZINC000255658825 1129171643 /nfs/dbraw/zinc/17/16/43/1129171643.db2.gz UEBTUXYUXFFQNN-IOBAAEILSA-N 1 1 330.384 3.741 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1CCCC1 ZINC000069227757 1124538496 /nfs/dbraw/zinc/53/84/96/1124538496.db2.gz LYOBQJFISICCKL-NSHDSACASA-N 1 1 339.823 3.697 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000619531308 1125358537 /nfs/dbraw/zinc/35/85/37/1125358537.db2.gz CYRNENWZWXSUIP-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000619531307 1125358599 /nfs/dbraw/zinc/35/85/99/1125358599.db2.gz CYRNENWZWXSUIP-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000619531968 1125358614 /nfs/dbraw/zinc/35/86/14/1125358614.db2.gz KFFPWHWIKBQUAP-ZYHUDNBSSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000619531968 1125358616 /nfs/dbraw/zinc/35/86/16/1125358616.db2.gz KFFPWHWIKBQUAP-ZYHUDNBSSA-N 1 1 332.322 3.766 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493205 1131353754 /nfs/dbraw/zinc/35/37/54/1131353754.db2.gz YGTATWMVBNCDRH-JKIFEVAISA-N 1 1 335.423 3.571 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000067472095 1129277059 /nfs/dbraw/zinc/27/70/59/1129277059.db2.gz UNIDWUMMLPSRED-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO Cc1cc(N[C@H]2CCC[C@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302087604 1129766893 /nfs/dbraw/zinc/76/68/93/1129766893.db2.gz OAHDQMBRHPHEQD-KBPBESRZSA-N 1 1 328.416 3.736 20 5 EHBDMO Cc1cc(NC2CC[NH+](CC(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302186757 1129772322 /nfs/dbraw/zinc/77/23/22/1129772322.db2.gz PQWYCLWHYGTJMI-UHFFFAOYSA-N 1 1 342.443 3.984 20 5 EHBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1Cl ZINC000303283604 1129835349 /nfs/dbraw/zinc/83/53/49/1129835349.db2.gz JFNAPDWNLYPOLI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1Cl ZINC000303283604 1129835354 /nfs/dbraw/zinc/83/53/54/1129835354.db2.gz JFNAPDWNLYPOLI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCCNc1ncc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000303398778 1129842734 /nfs/dbraw/zinc/84/27/34/1129842734.db2.gz MJXKTBQCLDXRNA-UHFFFAOYSA-N 1 1 334.807 3.577 20 5 EHBDMO CCC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000171680801 1130078346 /nfs/dbraw/zinc/07/83/46/1130078346.db2.gz KIQHMDLFBMVTEP-UHFFFAOYSA-N 1 1 330.331 3.579 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)c1 ZINC000174878133 1130389832 /nfs/dbraw/zinc/38/98/32/1130389832.db2.gz KVFZCBRWCCSRSM-FQEVSTJZSA-N 1 1 348.406 3.591 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+](CC2CC2)C2CCCCC2)c1 ZINC000727825198 1130601153 /nfs/dbraw/zinc/60/11/53/1130601153.db2.gz MKNHGNBTBLJMBC-UHFFFAOYSA-N 1 1 328.416 3.947 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000732568407 1130935480 /nfs/dbraw/zinc/93/54/80/1130935480.db2.gz RDZJXZWQVFYRMM-UHFFFAOYSA-N 1 1 345.365 3.924 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000733196382 1131003776 /nfs/dbraw/zinc/00/37/76/1131003776.db2.gz CROPIKLWIXIISA-AWEZNQCLSA-N 1 1 349.431 3.599 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000733196382 1131003780 /nfs/dbraw/zinc/00/37/80/1131003780.db2.gz CROPIKLWIXIISA-AWEZNQCLSA-N 1 1 349.431 3.599 20 5 EHBDMO Cc1cn2cc(Nc3nc4ccc([N+](=O)[O-])cc4s3)ccc2[nH+]1 ZINC000740759612 1131540860 /nfs/dbraw/zinc/54/08/60/1131540860.db2.gz XFAYEQDRVJXQKT-UHFFFAOYSA-N 1 1 325.353 3.904 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCN(c3cc[nH+]c4ccsc43)CC2)cc1 ZINC000742390325 1131714423 /nfs/dbraw/zinc/71/44/23/1131714423.db2.gz XXJIKWHUHCXKCM-UHFFFAOYSA-N 1 1 340.408 3.531 20 5 EHBDMO Cc1ccc(NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[nH+]c1 ZINC000742390505 1131714585 /nfs/dbraw/zinc/71/45/85/1131714585.db2.gz PWIVNIWKDALNMV-UHFFFAOYSA-N 1 1 340.305 3.841 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000742412974 1131720604 /nfs/dbraw/zinc/72/06/04/1131720604.db2.gz QQDCWIRKPZHWPL-UHFFFAOYSA-N 1 1 331.401 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H]3[C@H](CCC3(F)F)C1)CC2 ZINC001172903964 1131885907 /nfs/dbraw/zinc/88/59/07/1131885907.db2.gz KIIAWMAOPPVHMG-INMHGKMJSA-N 1 1 336.382 3.819 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381063 1131915159 /nfs/dbraw/zinc/91/51/59/1131915159.db2.gz TUJABFOPVRSLDP-ZBFHGGJFSA-N 1 1 343.431 3.711 20 5 EHBDMO CC(C)[N@@H+](C1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911605 1131917994 /nfs/dbraw/zinc/91/79/94/1131917994.db2.gz CWEGGNKRCDUKDB-KRWDZBQOSA-N 1 1 332.444 3.732 20 5 EHBDMO Cc1cnc2c(c1)C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172913259 1131918740 /nfs/dbraw/zinc/91/87/40/1131918740.db2.gz QHTJSGKIEDICEF-SFHVURJKSA-N 1 1 337.423 3.604 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H](O)c1ccc(C)cc1 ZINC000743867024 1131993079 /nfs/dbraw/zinc/99/30/79/1131993079.db2.gz QVSYJEHJZOBRHH-IBGZPJMESA-N 1 1 328.412 3.767 20 5 EHBDMO Cc1ccccc1O[C@@H]1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226695 1132006798 /nfs/dbraw/zinc/00/67/98/1132006798.db2.gz KWGPDJQXFPUFSZ-VQIMIIECSA-N 1 1 340.423 3.988 20 5 EHBDMO C[C@@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000746076276 1132361139 /nfs/dbraw/zinc/36/11/39/1132361139.db2.gz MKVUNIBKTVSVSL-LBPRGKRZSA-N 1 1 340.807 3.556 20 5 EHBDMO CC[N@@H+](Cc1cccc(Br)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035068 1132636629 /nfs/dbraw/zinc/63/66/29/1132636629.db2.gz ADLOSRCAFXEMDG-DZGCQCFKSA-N 1 1 341.249 3.716 20 5 EHBDMO C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057844 1132646228 /nfs/dbraw/zinc/64/62/28/1132646228.db2.gz XZYGCMJLHFNDNO-XUJVJEKNSA-N 1 1 341.249 3.887 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086168 1132830819 /nfs/dbraw/zinc/83/08/19/1132830819.db2.gz DKGPWNTXQIPIIS-FXAWDEMLSA-N 1 1 338.407 3.767 20 5 EHBDMO Cc1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000767453205 1133005378 /nfs/dbraw/zinc/00/53/78/1133005378.db2.gz FXLIDKSQWZMESS-GFCCVEGCSA-N 1 1 334.807 3.674 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765167 1133049810 /nfs/dbraw/zinc/04/98/10/1133049810.db2.gz KHOHLPBIUORPEB-GDBMZVCRSA-N 1 1 343.431 3.711 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765169 1133050438 /nfs/dbraw/zinc/05/04/38/1133050438.db2.gz KHOHLPBIUORPEB-GOEBONIOSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000767831772 1133059206 /nfs/dbraw/zinc/05/92/06/1133059206.db2.gz VCBMMWFIDGPSFN-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000767831772 1133059210 /nfs/dbraw/zinc/05/92/10/1133059210.db2.gz VCBMMWFIDGPSFN-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768542852 1133153632 /nfs/dbraw/zinc/15/36/32/1133153632.db2.gz ZXJDBPLCTGWFMO-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155459 /nfs/dbraw/zinc/15/54/59/1133155459.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 1 1 325.840 3.553 20 5 EHBDMO O[C@@H]1C[C@H](O)C[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000769563239 1133315480 /nfs/dbraw/zinc/31/54/80/1133315480.db2.gz HGROTBHDQKHLRU-OKILXGFUSA-N 1 1 341.838 3.574 20 5 EHBDMO C[N@@H+](CCCc1ccc(F)c(F)c1)CCc1cccc([N+](=O)[O-])c1 ZINC001181155232 1133460908 /nfs/dbraw/zinc/46/09/08/1133460908.db2.gz ZLDRCUJCGLJZIQ-UHFFFAOYSA-N 1 1 334.366 3.980 20 5 EHBDMO COC(=O)CC[C@@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC001183631247 1133839359 /nfs/dbraw/zinc/83/93/59/1133839359.db2.gz QIQOAOGRRADIJI-SFKKXYGYSA-N 1 1 346.427 3.663 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC001184252506 1133916174 /nfs/dbraw/zinc/91/61/74/1133916174.db2.gz QEIBLZXQABJSQE-IAGOWNOFSA-N 1 1 332.444 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000774886698 1134102266 /nfs/dbraw/zinc/10/22/66/1134102266.db2.gz WQZYZXGKELZWTA-QGZVFWFLSA-N 1 1 331.372 3.825 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479726 1134130469 /nfs/dbraw/zinc/13/04/69/1134130469.db2.gz AAOQNCBNVAVBAF-DOTOQJQBSA-N 1 1 349.450 3.820 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001186368657 1134202789 /nfs/dbraw/zinc/20/27/89/1134202789.db2.gz VEIKZOBUQKEOOT-KRWDZBQOSA-N 1 1 333.432 3.720 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584986 1134298778 /nfs/dbraw/zinc/29/87/78/1134298778.db2.gz UKPYNFTYIXXTTK-INIZCTEOSA-N 1 1 348.830 3.938 20 5 EHBDMO C[N@H+]1C[C@@H]2CC[C@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001187913801 1134396339 /nfs/dbraw/zinc/39/63/39/1134396339.db2.gz QCYXKPKVKRNJLG-QXEWZRGKSA-N 1 1 330.215 3.654 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329027 1134749410 /nfs/dbraw/zinc/74/94/10/1134749410.db2.gz NGJAINQNLUDCDD-IAQYHMDHSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCCC(F)(F)[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335137 1134752674 /nfs/dbraw/zinc/75/26/74/1134752674.db2.gz LQJLLCNQEZMEKT-IAQYHMDHSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC(F)(F)[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335137 1134752679 /nfs/dbraw/zinc/75/26/79/1134752679.db2.gz LQJLLCNQEZMEKT-IAQYHMDHSA-N 1 1 346.349 3.604 20 5 EHBDMO CCOC(=O)CCCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170410229 1134771771 /nfs/dbraw/zinc/77/17/71/1134771771.db2.gz FKILUQJUEVINDS-QGZVFWFLSA-N 1 1 348.443 3.898 20 5 EHBDMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001191531665 1134880678 /nfs/dbraw/zinc/88/06/78/1134880678.db2.gz VHJLYVCDAZBWJI-KRWDZBQOSA-N 1 1 325.412 3.825 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789195 1134923024 /nfs/dbraw/zinc/92/30/24/1134923024.db2.gz GKABKYFLPKOGBC-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC001193954717 1135205955 /nfs/dbraw/zinc/20/59/55/1135205955.db2.gz LDUBLLPGWHSNBP-LMMKCTJWSA-N 1 1 332.444 3.809 20 5 EHBDMO CCCC[C@H](C)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194874975 1135333757 /nfs/dbraw/zinc/33/37/57/1135333757.db2.gz WBSBRWUURADYBK-NSHDSACASA-N 1 1 327.812 3.697 20 5 EHBDMO Cc1cccc2c1CC(C)(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC001170502255 1135416612 /nfs/dbraw/zinc/41/66/12/1135416612.db2.gz YWSJCSDMZMZRKM-LJQANCHMSA-N 1 1 340.423 3.774 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1ccsc1)[NH+](C)C ZINC000807923241 1135590781 /nfs/dbraw/zinc/59/07/81/1135590781.db2.gz OPJJMUQSVLZDCR-MRXNPFEDSA-N 1 1 333.413 3.574 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3CCN(C4CC4)CC3)o2)c1 ZINC001199078893 1135879944 /nfs/dbraw/zinc/87/99/44/1135879944.db2.gz VRHYFPSMMBGMBT-UHFFFAOYSA-N 1 1 341.411 3.571 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000809954151 1135905833 /nfs/dbraw/zinc/90/58/33/1135905833.db2.gz QHUDKABSEGTORW-QMTHXVAHSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000809954151 1135905836 /nfs/dbraw/zinc/90/58/36/1135905836.db2.gz QHUDKABSEGTORW-QMTHXVAHSA-N 1 1 345.226 3.903 20 5 EHBDMO C[N@@H+](CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCCC1 ZINC000811479083 1136096987 /nfs/dbraw/zinc/09/69/87/1136096987.db2.gz WMHUAHCVZWUWRF-UHFFFAOYSA-N 1 1 346.258 3.866 20 5 EHBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000776278074 1136131188 /nfs/dbraw/zinc/13/11/88/1136131188.db2.gz RPDXKWXPEPXDDR-CDHQVMDDSA-N 1 1 340.423 3.754 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812853796 1136262383 /nfs/dbraw/zinc/26/23/83/1136262383.db2.gz KGVWDAXGXDUWDJ-IFXJQAMLSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583167 1136441687 /nfs/dbraw/zinc/44/16/87/1136441687.db2.gz YPNOSGWVYQUSKZ-ZWKOTPCHSA-N 1 1 348.349 3.744 20 5 EHBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585346 1136442242 /nfs/dbraw/zinc/44/22/42/1136442242.db2.gz WASMTHCBEOFIGG-UGSOOPFHSA-N 1 1 348.830 3.845 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC000776582419 1136442383 /nfs/dbraw/zinc/44/23/83/1136442383.db2.gz QAGBUAICFGHAOT-FXAWDEMLSA-N 1 1 340.423 3.583 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585079 1136442452 /nfs/dbraw/zinc/44/24/52/1136442452.db2.gz SOJQKJJBLLGUMZ-BJZITVGISA-N 1 1 326.396 3.506 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591251 1136450983 /nfs/dbraw/zinc/45/09/83/1136450983.db2.gz IETFKUXXOIPIBY-RBUKOAKNSA-N 1 1 344.386 3.995 20 5 EHBDMO CC(C)Oc1cccc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776592919 1136453731 /nfs/dbraw/zinc/45/37/31/1136453731.db2.gz CTCZAAZTWCOHGM-IBGZPJMESA-N 1 1 344.411 3.547 20 5 EHBDMO Cc1cccc(C2=CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000776596973 1136457962 /nfs/dbraw/zinc/45/79/62/1136457962.db2.gz BJICVOZIMAOMEV-FQEVSTJZSA-N 1 1 338.407 3.726 20 5 EHBDMO Cc1cc(NC(=O)[C@H](c2ccc(Cl)cc2)[NH+](C)C)cc([N+](=O)[O-])c1 ZINC001134962835 1136580285 /nfs/dbraw/zinc/58/02/85/1136580285.db2.gz JHRZJGYQZYWFHM-INIZCTEOSA-N 1 1 347.802 3.798 20 5 EHBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774784 1136661237 /nfs/dbraw/zinc/66/12/37/1136661237.db2.gz OKJBUSBDADPSKT-RCCFBDPRSA-N 1 1 340.427 3.715 20 5 EHBDMO Cc1c(F)nccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386280 1137141950 /nfs/dbraw/zinc/14/19/50/1137141950.db2.gz NWOGDGWHAHFELY-MRXNPFEDSA-N 1 1 329.375 3.817 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)c2)cc1 ZINC000844746471 1137249427 /nfs/dbraw/zinc/24/94/27/1137249427.db2.gz BNGHAWPICUXWMJ-MRXNPFEDSA-N 1 1 348.353 3.537 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)c2)cc1 ZINC000844746471 1137249429 /nfs/dbraw/zinc/24/94/29/1137249429.db2.gz BNGHAWPICUXWMJ-MRXNPFEDSA-N 1 1 348.353 3.537 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1cc(C)[nH]n1 ZINC000872049628 1137567753 /nfs/dbraw/zinc/56/77/53/1137567753.db2.gz UHWNETMYKFWAGM-ZYHUDNBSSA-N 1 1 334.445 3.630 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CO)c1ccsc1 ZINC000872064031 1137569224 /nfs/dbraw/zinc/56/92/24/1137569224.db2.gz VKWXWMRIEWGDGM-YGRLFVJLSA-N 1 1 338.454 3.762 20 5 EHBDMO CC(=O)N(C)c1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872087131 1137570640 /nfs/dbraw/zinc/57/06/40/1137570640.db2.gz GFPQVBZIZADRPX-GFCCVEGCSA-N 1 1 345.374 3.567 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC[C@@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000872108085 1137571501 /nfs/dbraw/zinc/57/15/01/1137571501.db2.gz WEDFCUAVOLSBKP-QAPCUYQASA-N 1 1 340.427 3.754 20 5 EHBDMO CCn1nc(C)c(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)c1C ZINC000877663613 1137684893 /nfs/dbraw/zinc/68/48/93/1137684893.db2.gz DIHAPELJMZKAQG-UHFFFAOYSA-N 1 1 330.432 3.677 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)c1C ZINC000877663613 1137684894 /nfs/dbraw/zinc/68/48/94/1137684894.db2.gz DIHAPELJMZKAQG-UHFFFAOYSA-N 1 1 330.432 3.677 20 5 EHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928034 1137695960 /nfs/dbraw/zinc/69/59/60/1137695960.db2.gz KVYOFSRPLBIKSI-SNVBAGLBSA-N 1 1 338.795 3.775 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCCC[C@H]2C2CCC2)o1 ZINC000878771857 1137727776 /nfs/dbraw/zinc/72/77/76/1137727776.db2.gz XXADHGIQHSROFB-HNNXBMFYSA-N 1 1 342.399 3.799 20 5 EHBDMO Cc1cncc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000879747626 1137757599 /nfs/dbraw/zinc/75/75/99/1137757599.db2.gz OIJNAAZFNUTKSR-INIZCTEOSA-N 1 1 327.384 3.514 20 5 EHBDMO Cc1nccnc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000880108937 1137768432 /nfs/dbraw/zinc/76/84/32/1137768432.db2.gz MKUIVGZRVMWYHV-SNVBAGLBSA-N 1 1 340.305 3.563 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2c(F)cccc2F)C2CC2)cc1 ZINC000130709162 1137841285 /nfs/dbraw/zinc/84/12/85/1137841285.db2.gz FLZKMFJTCYMOJQ-QGZVFWFLSA-N 1 1 348.349 3.571 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000885964925 1138029054 /nfs/dbraw/zinc/02/90/54/1138029054.db2.gz GVCHCHBAVVKSOQ-AWEZNQCLSA-N 1 1 341.411 3.799 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000886021106 1138032916 /nfs/dbraw/zinc/03/29/16/1138032916.db2.gz PARRQKSJKAZZBA-UHFFFAOYSA-N 1 1 333.432 3.551 20 5 EHBDMO CC(=O)Nc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000060574711 1138067054 /nfs/dbraw/zinc/06/70/54/1138067054.db2.gz PIGVLCKTGJKVEY-UHFFFAOYSA-N 1 1 341.411 3.964 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000886818580 1138149029 /nfs/dbraw/zinc/14/90/29/1138149029.db2.gz HEXBYZWSLIVAKH-QMTHXVAHSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000886818580 1138149031 /nfs/dbraw/zinc/14/90/31/1138149031.db2.gz HEXBYZWSLIVAKH-QMTHXVAHSA-N 1 1 345.226 3.903 20 5 EHBDMO C[C@H]([N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000091900253 1138222694 /nfs/dbraw/zinc/22/26/94/1138222694.db2.gz IFXDVSHYRFGGML-ZDUSSCGKSA-N 1 1 328.416 3.616 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338011828 1138723207 /nfs/dbraw/zinc/72/32/07/1138723207.db2.gz QEOCSBDLMILIHX-NWDGAFQWSA-N 1 1 333.363 3.939 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000265474063 1138915250 /nfs/dbraw/zinc/91/52/50/1138915250.db2.gz MBDLXIBKIZNUHI-NSHDSACASA-N 1 1 347.440 3.790 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500579 1139760527 /nfs/dbraw/zinc/76/05/27/1139760527.db2.gz FGHSMVRJFPVCSV-DOMZBBRYSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000179500579 1139760531 /nfs/dbraw/zinc/76/05/31/1139760531.db2.gz FGHSMVRJFPVCSV-DOMZBBRYSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000179500579 1139760535 /nfs/dbraw/zinc/76/05/35/1139760535.db2.gz FGHSMVRJFPVCSV-DOMZBBRYSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@H]12 ZINC000182489622 1139975897 /nfs/dbraw/zinc/97/58/97/1139975897.db2.gz NZSRKSJTHQZOJM-WQVCFCJDSA-N 1 1 342.399 3.655 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](COCC(C)C)c1ccco1 ZINC000183456487 1140039800 /nfs/dbraw/zinc/03/98/00/1140039800.db2.gz HBDCVNIRMWRXAY-KRWDZBQOSA-N 1 1 332.400 4.000 20 5 EHBDMO C[C@H]1C[C@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000193466556 1140577274 /nfs/dbraw/zinc/57/72/74/1140577274.db2.gz QSFUNHPZOXRQHC-WMLDXEAASA-N 1 1 340.427 3.642 20 5 EHBDMO CCC[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000536669014 1032098590 /nfs/dbraw/zinc/09/85/90/1032098590.db2.gz WUJKZRFUUFGGBR-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000536669014 1032098604 /nfs/dbraw/zinc/09/86/04/1032098604.db2.gz WUJKZRFUUFGGBR-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CCCCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)C ZINC000753914429 1014683633 /nfs/dbraw/zinc/68/36/33/1014683633.db2.gz GAYVVTQWDCCGQW-UHFFFAOYSA-N 1 1 339.411 3.963 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000430194234 1014773800 /nfs/dbraw/zinc/77/38/00/1014773800.db2.gz HSWBJXVMFGDHMI-UHFFFAOYSA-N 1 1 340.379 3.598 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000430194234 1014773810 /nfs/dbraw/zinc/77/38/10/1014773810.db2.gz HSWBJXVMFGDHMI-UHFFFAOYSA-N 1 1 340.379 3.598 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000577914329 1014922398 /nfs/dbraw/zinc/92/23/98/1014922398.db2.gz PUTWVYRSAFMHAJ-MRXNPFEDSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430216171 1015041810 /nfs/dbraw/zinc/04/18/10/1015041810.db2.gz IAXJCFOPSBMLJN-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CCc1nn(C)c(CC)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000154467930 1016035813 /nfs/dbraw/zinc/03/58/13/1016035813.db2.gz XKLRPHIYHDJHDC-UHFFFAOYSA-N 1 1 344.459 3.864 20 5 EHBDMO Cc1cc(NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000311211009 1016398027 /nfs/dbraw/zinc/39/80/27/1016398027.db2.gz PCTBCYAEXHAYHY-LJQANCHMSA-N 1 1 340.427 3.622 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000066696076 1016414019 /nfs/dbraw/zinc/41/40/19/1016414019.db2.gz ZDNHTVMKKVLPJN-MRXNPFEDSA-N 1 1 332.425 3.838 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@@H]1c1ccc(Cl)cc1 ZINC000192515063 1032175626 /nfs/dbraw/zinc/17/56/26/1032175626.db2.gz LLIBOTIGPVRNIG-YPMHNXCESA-N 1 1 338.820 3.562 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@@H]1c1ccc(Cl)cc1 ZINC000192515063 1032175632 /nfs/dbraw/zinc/17/56/32/1032175632.db2.gz LLIBOTIGPVRNIG-YPMHNXCESA-N 1 1 338.820 3.562 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000086187685 1032481666 /nfs/dbraw/zinc/48/16/66/1032481666.db2.gz DHYNRJZGWAQBTF-ZDUSSCGKSA-N 1 1 337.383 3.965 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000892859362 1017608624 /nfs/dbraw/zinc/60/86/24/1017608624.db2.gz FCFIMXYFPOQJNM-UHFFFAOYSA-N 1 1 348.786 3.699 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570483 /nfs/dbraw/zinc/57/04/83/1018570483.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 1 1 325.840 3.554 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000419374437 1018971897 /nfs/dbraw/zinc/97/18/97/1018971897.db2.gz PVIFARGSWNYDJN-WISYIIOYSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000419374437 1018971905 /nfs/dbraw/zinc/97/19/05/1018971905.db2.gz PVIFARGSWNYDJN-WISYIIOYSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433433 1019090811 /nfs/dbraw/zinc/09/08/11/1019090811.db2.gz JJJRSIYDRNRWIZ-WMZOPIPTSA-N 1 1 339.439 3.862 20 5 EHBDMO CC[N@H+](CC(=O)N1CCCCCC1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000513217930 1019431373 /nfs/dbraw/zinc/43/13/73/1019431373.db2.gz KGXRBIBGWSUTGM-MRXNPFEDSA-N 1 1 347.459 3.689 20 5 EHBDMO CC[N@@H+](CC(=O)N1CCCCCC1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000513217930 1019431385 /nfs/dbraw/zinc/43/13/85/1019431385.db2.gz KGXRBIBGWSUTGM-MRXNPFEDSA-N 1 1 347.459 3.689 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](C)O ZINC000513703172 1020635216 /nfs/dbraw/zinc/63/52/16/1020635216.db2.gz RIARMZNYAZXZTC-ZDUSSCGKSA-N 1 1 334.441 3.915 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1cccnc1 ZINC000602503850 1032938227 /nfs/dbraw/zinc/93/82/27/1032938227.db2.gz SQAMHMVULBXRRV-QMMMGPOBSA-N 1 1 342.218 3.665 20 5 EHBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450808 1021190774 /nfs/dbraw/zinc/19/07/74/1021190774.db2.gz WMUILWHLUICTOJ-QGZVFWFLSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450808 1021190783 /nfs/dbraw/zinc/19/07/83/1021190783.db2.gz WMUILWHLUICTOJ-QGZVFWFLSA-N 1 1 343.427 3.819 20 5 EHBDMO COc1c(C)cc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507618634 1021404398 /nfs/dbraw/zinc/40/43/98/1021404398.db2.gz WIIAVULMCVHFBO-UHFFFAOYSA-N 1 1 328.412 3.895 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506564519 1021405744 /nfs/dbraw/zinc/40/57/44/1021405744.db2.gz UXGNKLLOVYMERQ-HNNXBMFYSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cnn(C2CCCC2)c1 ZINC000337384436 1021473367 /nfs/dbraw/zinc/47/33/67/1021473367.db2.gz FFAJXLKAUQSRPM-ZDUSSCGKSA-N 1 1 344.415 3.766 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H]4CCC[C@@H]43)o2)c1 ZINC000426485341 1021688708 /nfs/dbraw/zinc/68/87/08/1021688708.db2.gz JDJHGYABTPFXGD-CJNGLKHVSA-N 1 1 327.384 3.667 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NCCC[N@H+]1CCc2ccccc2C1 ZINC000506037651 1021752667 /nfs/dbraw/zinc/75/26/67/1021752667.db2.gz UQPYCOGUEHPFLJ-UHFFFAOYSA-N 1 1 329.375 3.594 20 5 EHBDMO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000178206091 1022148738 /nfs/dbraw/zinc/14/87/38/1022148738.db2.gz FEJMSCZAEZJKDM-CQSZACIVSA-N 1 1 349.337 3.552 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000178236919 1022249580 /nfs/dbraw/zinc/24/95/80/1022249580.db2.gz VPEOTBVGWDMZPF-BBRMVZONSA-N 1 1 346.456 3.855 20 5 EHBDMO C[NH+](C)[C@@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000237160491 1022424572 /nfs/dbraw/zinc/42/45/72/1022424572.db2.gz AEIJURWKNADNGA-KRWDZBQOSA-N 1 1 333.819 3.641 20 5 EHBDMO Cc1ccc([C@@H](C)NC(=O)CC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000548389665 1022774898 /nfs/dbraw/zinc/77/48/98/1022774898.db2.gz PRGQDBVPHZLDTL-OAHLLOKOSA-N 1 1 347.459 3.735 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](CCCO)[C@H]2CCc3ccccc32)cc1 ZINC000510652596 1022839513 /nfs/dbraw/zinc/83/95/13/1022839513.db2.gz SWJKBALHRQCPCF-FQEVSTJZSA-N 1 1 340.423 3.509 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@H]43)o2)c1 ZINC000510694443 1022906485 /nfs/dbraw/zinc/90/64/85/1022906485.db2.gz XYVISZPRJMVFIA-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@H]43)o2)c1 ZINC000510694443 1022906494 /nfs/dbraw/zinc/90/64/94/1022906494.db2.gz XYVISZPRJMVFIA-SJLPKXTDSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1nn(C[N@H+]2CCCC[C@H]2Cc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC000729471718 1023115637 /nfs/dbraw/zinc/11/56/37/1023115637.db2.gz GCOSQKRKWUVCIQ-KRWDZBQOSA-N 1 1 346.406 3.602 20 5 EHBDMO CC(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000536389829 1023183600 /nfs/dbraw/zinc/18/36/00/1023183600.db2.gz HWJGUCPWWKYEBJ-UHFFFAOYSA-N 1 1 340.427 3.577 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCCO1 ZINC000506476600 1023249789 /nfs/dbraw/zinc/24/97/89/1023249789.db2.gz IOBIMOFEFKUBAZ-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO CC(C)Sc1ccc([C@@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000341794678 1023328424 /nfs/dbraw/zinc/32/84/24/1023328424.db2.gz COHZTHCCHMSEAS-GFCCVEGCSA-N 1 1 334.445 3.680 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2c(F)cccc2[N+](=O)[O-])cc1F ZINC000341849995 1023454304 /nfs/dbraw/zinc/45/43/04/1023454304.db2.gz WEXWSBKSDOPREI-UHFFFAOYSA-N 1 1 344.321 3.979 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@H]43)o2)c1 ZINC000535801268 1023647435 /nfs/dbraw/zinc/64/74/35/1023647435.db2.gz GFPMOJHYYBTBHI-CRAIPNDOSA-N 1 1 342.395 3.856 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000342051338 1023804286 /nfs/dbraw/zinc/80/42/86/1023804286.db2.gz SIZFQDAPMZQEKY-FUHWJXTLSA-N 1 1 334.416 3.525 20 5 EHBDMO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000602801235 1033174948 /nfs/dbraw/zinc/17/49/48/1033174948.db2.gz MGWGBUCKSLQZDK-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)c([N+](=O)[O-])c1 ZINC000060892867 1033176458 /nfs/dbraw/zinc/17/64/58/1033176458.db2.gz JCKAOHHSQNBFOO-QGZVFWFLSA-N 1 1 345.443 3.629 20 5 EHBDMO CC(C)[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(Cl)cc1F ZINC000602805800 1033178175 /nfs/dbraw/zinc/17/81/75/1033178175.db2.gz QFOOVUVGPVQZAK-AWEZNQCLSA-N 1 1 340.786 3.608 20 5 EHBDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895227698 1024011869 /nfs/dbraw/zinc/01/18/69/1024011869.db2.gz QDLSIPHFEBAKQU-AWEZNQCLSA-N 1 1 348.786 3.870 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cccnc1N1CCCC1 ZINC000895320835 1024285232 /nfs/dbraw/zinc/28/52/32/1024285232.db2.gz PJHZVVMODBDLSW-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1C ZINC000538726460 1024482144 /nfs/dbraw/zinc/48/21/44/1024482144.db2.gz SVZFNYZBJSJCBU-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1C ZINC000538726460 1024482153 /nfs/dbraw/zinc/48/21/53/1024482153.db2.gz SVZFNYZBJSJCBU-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO CCn1nc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000472050432 1024486368 /nfs/dbraw/zinc/48/63/68/1024486368.db2.gz YOUQTXRQSACQCR-UHFFFAOYSA-N 1 1 338.411 3.989 20 5 EHBDMO Cc1cc(CNc2ccc([N+](=O)[O-])cc2F)cc(N2CCCC2)[nH+]1 ZINC000357627856 1024602565 /nfs/dbraw/zinc/60/25/65/1024602565.db2.gz MWQXNVQOTVYLSZ-UHFFFAOYSA-N 1 1 330.363 3.650 20 5 EHBDMO CCC[C@H]([NH2+][C@@H](CO)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000539086556 1024749391 /nfs/dbraw/zinc/74/93/91/1024749391.db2.gz BICDDVHJAGEMJL-ROUUACIJSA-N 1 1 344.411 3.768 20 5 EHBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1cc(C2CC2)cc[nH+]1 ZINC000515149877 1025045556 /nfs/dbraw/zinc/04/55/56/1025045556.db2.gz OARXCOZNPJXFPF-LBPRGKRZSA-N 1 1 340.383 3.696 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520846004 1025080986 /nfs/dbraw/zinc/08/09/86/1025080986.db2.gz NMSCTZIXBZZLBQ-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520846004 1025080992 /nfs/dbraw/zinc/08/09/92/1025080992.db2.gz NMSCTZIXBZZLBQ-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO Cc1ccccc1C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000521198903 1025271707 /nfs/dbraw/zinc/27/17/07/1025271707.db2.gz UBERJWOULNUUOT-UHFFFAOYSA-N 1 1 326.396 3.947 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(OC)cc1 ZINC000505778374 1025492655 /nfs/dbraw/zinc/49/26/55/1025492655.db2.gz URXGWXUUNGBUGU-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(OC)cc1 ZINC000505778374 1025492663 /nfs/dbraw/zinc/49/26/63/1025492663.db2.gz URXGWXUUNGBUGU-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334243 1025507080 /nfs/dbraw/zinc/50/70/80/1025507080.db2.gz UIYFFZSXAPYMGB-KBPBESRZSA-N 1 1 331.441 3.985 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c(F)c1 ZINC000282031505 1026047039 /nfs/dbraw/zinc/04/70/39/1026047039.db2.gz WPHOOZSKLPCXRU-ZDUSSCGKSA-N 1 1 344.390 3.651 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478422742 1026099647 /nfs/dbraw/zinc/09/96/47/1026099647.db2.gz UACVKQVNEPJMDB-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478422742 1026099659 /nfs/dbraw/zinc/09/96/59/1026099659.db2.gz UACVKQVNEPJMDB-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO CN1CCC([N@H+](Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000342528731 1026109440 /nfs/dbraw/zinc/10/94/40/1026109440.db2.gz VTNHEMDPLVGUJL-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO CN1CCC([N@@H+](Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000342528731 1026109452 /nfs/dbraw/zinc/10/94/52/1026109452.db2.gz VTNHEMDPLVGUJL-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141481 1026233762 /nfs/dbraw/zinc/23/37/62/1026233762.db2.gz WCQGTNDXSBZOFG-BEBFYNPSSA-N 1 1 340.423 3.798 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C2CC2)O1 ZINC000475296343 1026448153 /nfs/dbraw/zinc/44/81/53/1026448153.db2.gz UJFKVNNUMBAHNJ-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C2CC2)O1 ZINC000475296343 1026448160 /nfs/dbraw/zinc/44/81/60/1026448160.db2.gz UJFKVNNUMBAHNJ-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](c4ccccc4F)C3)nc2c1 ZINC000339378380 1026545766 /nfs/dbraw/zinc/54/57/66/1026545766.db2.gz KPSCWZIWTNVZOS-LBPRGKRZSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4ccccc4F)C3)nc2c1 ZINC000339378380 1026545771 /nfs/dbraw/zinc/54/57/71/1026545771.db2.gz KPSCWZIWTNVZOS-LBPRGKRZSA-N 1 1 340.358 3.600 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000023991490 1026773160 /nfs/dbraw/zinc/77/31/60/1026773160.db2.gz WJPWEVOCOHKVPV-TUAOUCFPSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000023991490 1026773172 /nfs/dbraw/zinc/77/31/72/1026773172.db2.gz WJPWEVOCOHKVPV-TUAOUCFPSA-N 1 1 339.823 3.553 20 5 EHBDMO CC(C)c1ccc(CN[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200572 1027078305 /nfs/dbraw/zinc/07/83/05/1027078305.db2.gz CPVROQRQISIXSF-HZPDHXFCSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(C[NH2+][C@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200572 1027078314 /nfs/dbraw/zinc/07/83/14/1027078314.db2.gz CPVROQRQISIXSF-HZPDHXFCSA-N 1 1 333.476 3.928 20 5 EHBDMO Cn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(C(C)(C)C)n1 ZINC000183807280 1027105554 /nfs/dbraw/zinc/10/55/54/1027105554.db2.gz TXXSVZCSQDZJIP-UHFFFAOYSA-N 1 1 336.823 3.569 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000473537107 1027112589 /nfs/dbraw/zinc/11/25/89/1027112589.db2.gz ZMDRRIXSYUYVKJ-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000548761146 1027408158 /nfs/dbraw/zinc/40/81/58/1027408158.db2.gz GJBLRZRYKSEPTP-INMHGKMJSA-N 1 1 345.443 3.824 20 5 EHBDMO CC(C)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533434159 1027873016 /nfs/dbraw/zinc/87/30/16/1027873016.db2.gz UYRYSGWWONQEQJ-OAHLLOKOSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533434159 1027873035 /nfs/dbraw/zinc/87/30/35/1027873035.db2.gz UYRYSGWWONQEQJ-OAHLLOKOSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](C4CCCC4)C3)o2)cc1 ZINC000420963898 1027933500 /nfs/dbraw/zinc/93/35/00/1027933500.db2.gz OPERNAAHVNPTSL-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(C)(C)Oc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-] ZINC000091480154 1028047451 /nfs/dbraw/zinc/04/74/51/1028047451.db2.gz NUICALWUCNXIRI-ZDUSSCGKSA-N 1 1 344.415 3.879 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495058 1028089100 /nfs/dbraw/zinc/08/91/00/1028089100.db2.gz NZIJVPZOMSCUAQ-OLZOCXBDSA-N 1 1 346.818 3.891 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495060 1028089201 /nfs/dbraw/zinc/08/92/01/1028089201.db2.gz NZIJVPZOMSCUAQ-STQMWFEESA-N 1 1 346.818 3.891 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCC[C@H]1C ZINC000444667681 1028139578 /nfs/dbraw/zinc/13/95/78/1028139578.db2.gz YYNKLRLIPJNARU-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCC[C@H]1C ZINC000444679068 1028147768 /nfs/dbraw/zinc/14/77/68/1028147768.db2.gz SYBJJNCKUPWGIM-DYVFJYSZSA-N 1 1 333.432 3.742 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375317 1028197034 /nfs/dbraw/zinc/19/70/34/1028197034.db2.gz GVHMPKIVRJBYOK-GHMZBOCLSA-N 1 1 332.356 3.695 20 5 EHBDMO CCc1ccccc1[C@@H]([NH3+])CN[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505222 1028470401 /nfs/dbraw/zinc/47/04/01/1028470401.db2.gz OCHUTDGQJMZGDA-KSSFIOAISA-N 1 1 327.428 3.816 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCOCC2)[C@H]1C(C)C ZINC000414526632 1028500282 /nfs/dbraw/zinc/50/02/82/1028500282.db2.gz LLHGRXDTXZQQQL-GOSISDBHSA-N 1 1 348.443 3.631 20 5 EHBDMO COc1ccc(C[N@@H+](CCc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000523670126 1028512800 /nfs/dbraw/zinc/51/28/00/1028512800.db2.gz MISYREMNUSLWIF-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000421752133 1028752695 /nfs/dbraw/zinc/75/26/95/1028752695.db2.gz QCHPECXNPZBCAC-MRXNPFEDSA-N 1 1 347.459 3.596 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]CCN2CCCCCC2)cc1[N+](=O)[O-] ZINC000504899138 1029027986 /nfs/dbraw/zinc/02/79/86/1029027986.db2.gz BFDDQOUVEYHAOL-HNNXBMFYSA-N 1 1 335.448 3.520 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000504911323 1029052257 /nfs/dbraw/zinc/05/22/57/1029052257.db2.gz DTPOKLWSMGJLFH-OAHLLOKOSA-N 1 1 349.475 3.909 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000126523506 1029741043 /nfs/dbraw/zinc/74/10/43/1029741043.db2.gz VWYXLPHKLIKWFS-CYBMUJFWSA-N 1 1 349.456 3.866 20 5 EHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453349656 1030138790 /nfs/dbraw/zinc/13/87/90/1030138790.db2.gz LTFLPXGZUFUELY-WBMJQRKESA-N 1 1 328.416 3.884 20 5 EHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159432466 1030188958 /nfs/dbraw/zinc/18/89/58/1030188958.db2.gz SQJGNNQAJJMTIN-ZDUSSCGKSA-N 1 1 327.222 3.978 20 5 EHBDMO CC(C)[N@@H+](CCc1nccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000159830346 1030385072 /nfs/dbraw/zinc/38/50/72/1030385072.db2.gz ASHYSRMAOAWSRC-UHFFFAOYSA-N 1 1 346.412 3.646 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607401 1030749815 /nfs/dbraw/zinc/74/98/15/1030749815.db2.gz OSCIMSKGPUCKGO-IUODEOHRSA-N 1 1 330.388 3.655 20 5 EHBDMO CC1(C)CC(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC(C)(C)[NH2+]1 ZINC000192613525 1030767230 /nfs/dbraw/zinc/76/72/30/1030767230.db2.gz CWPLJUAUSIJMLX-KRWDZBQOSA-N 1 1 331.460 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000729852626 1030939233 /nfs/dbraw/zinc/93/92/33/1030939233.db2.gz PKKWCPPUNVHIRZ-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000729852626 1030939243 /nfs/dbraw/zinc/93/92/43/1030939243.db2.gz PKKWCPPUNVHIRZ-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026207668 1031001216 /nfs/dbraw/zinc/00/12/16/1031001216.db2.gz MPETWIJSCVZCBP-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000483340553 1031128187 /nfs/dbraw/zinc/12/81/87/1031128187.db2.gz KVHQGZVPPYLDNM-HNAYVOBHSA-N 1 1 348.443 3.624 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737339 1031719542 /nfs/dbraw/zinc/71/95/42/1031719542.db2.gz CLQCLWLIKHFSAP-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737339 1031719545 /nfs/dbraw/zinc/71/95/45/1031719545.db2.gz CLQCLWLIKHFSAP-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)c1ccccc1 ZINC000063482859 1033391315 /nfs/dbraw/zinc/39/13/15/1033391315.db2.gz GKMMZXRECCOHMF-OAHLLOKOSA-N 1 1 341.411 3.925 20 5 EHBDMO Cc1ccc(CNC2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000061003351 1033418415 /nfs/dbraw/zinc/41/84/15/1033418415.db2.gz YBSWUNJPIMSHBX-UHFFFAOYSA-N 1 1 339.439 3.657 20 5 EHBDMO Cn1cc(C[N@H+]2CCC23CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000593645366 1033573957 /nfs/dbraw/zinc/57/39/57/1033573957.db2.gz KWFQUJFAXQMRAW-UHFFFAOYSA-N 1 1 326.400 3.514 20 5 EHBDMO O=[N+]([O-])c1ccccc1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000059424679 1033660313 /nfs/dbraw/zinc/66/03/13/1033660313.db2.gz SNVVRMVUWRDVGP-UHFFFAOYSA-N 1 1 331.460 3.683 20 5 EHBDMO COc1ccnc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1F ZINC000595080375 1033695708 /nfs/dbraw/zinc/69/57/08/1033695708.db2.gz LHMIUIUIUXGKGV-OAHLLOKOSA-N 1 1 345.374 3.695 20 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CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595791008 1034002723 /nfs/dbraw/zinc/00/27/23/1034002723.db2.gz SJIJELZLWRGSCJ-QAPCUYQASA-N 1 1 348.443 3.775 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450286720 1034023137 /nfs/dbraw/zinc/02/31/37/1034023137.db2.gz IUFLTFUQNVZLCX-AWEZNQCLSA-N 1 1 328.416 3.675 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692813 1034098302 /nfs/dbraw/zinc/09/83/02/1034098302.db2.gz XXSUTATXMWCVRX-HSWBROFVSA-N 1 1 332.400 3.640 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000596296320 1034147982 /nfs/dbraw/zinc/14/79/82/1034147982.db2.gz HAVCDQYUSYMCRZ-OCCSQVGLSA-N 1 1 325.359 3.961 20 5 EHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1ccccc1 ZINC000534133315 1034176883 /nfs/dbraw/zinc/17/68/83/1034176883.db2.gz FEFCJTOFZYSFLD-MRXNPFEDSA-N 1 1 343.427 3.620 20 5 EHBDMO CC(C)(CNc1ccsc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000604432712 1034377448 /nfs/dbraw/zinc/37/74/48/1034377448.db2.gz VNXLWRNBYSQFIP-UHFFFAOYSA-N 1 1 331.441 3.905 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000604484476 1034387409 /nfs/dbraw/zinc/38/74/09/1034387409.db2.gz TWQHIUNUQQVYKK-KRWDZBQOSA-N 1 1 328.368 3.646 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000604484476 1034387424 /nfs/dbraw/zinc/38/74/24/1034387424.db2.gz TWQHIUNUQQVYKK-KRWDZBQOSA-N 1 1 328.368 3.646 20 5 EHBDMO CCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC)cc1 ZINC000604492976 1034399339 /nfs/dbraw/zinc/39/93/39/1034399339.db2.gz RTRFNOIHDVGFIM-UHFFFAOYSA-N 1 1 344.411 3.894 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000375891756 1034843343 /nfs/dbraw/zinc/84/33/43/1034843343.db2.gz RZJSFPODOUINQK-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2 ZINC000375891756 1034843356 /nfs/dbraw/zinc/84/33/56/1034843356.db2.gz RZJSFPODOUINQK-UHFFFAOYSA-N 1 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CCC(CC)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000165364522 1036434664 /nfs/dbraw/zinc/43/46/64/1036434664.db2.gz IUZNKOKUTRXYAG-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541555017 1036448010 /nfs/dbraw/zinc/44/80/10/1036448010.db2.gz GULNGSZPEZWURU-INIZCTEOSA-N 1 1 342.443 3.863 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133523 1036563756 /nfs/dbraw/zinc/56/37/56/1036563756.db2.gz DXBGFJMOFRBVPT-GFCCVEGCSA-N 1 1 342.342 3.579 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742946 1036600733 /nfs/dbraw/zinc/60/07/33/1036600733.db2.gz KHVSPHNMVGDLFF-MIGQKNRLSA-N 1 1 338.473 3.808 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464778441 1036773850 /nfs/dbraw/zinc/77/38/50/1036773850.db2.gz QBOFURIBEFVLSQ-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cnn(CC2CCC2)c1 ZINC000897428476 1036838312 /nfs/dbraw/zinc/83/83/12/1036838312.db2.gz KPEFUYIFDXFMAF-UHFFFAOYSA-N 1 1 334.807 3.535 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000464844078 1036885103 /nfs/dbraw/zinc/88/51/03/1036885103.db2.gz CYUWGYHMOSSUEX-GOSISDBHSA-N 1 1 333.432 3.826 20 5 EHBDMO CCC(CC)[N@@H+](CCOC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892798 1036892053 /nfs/dbraw/zinc/89/20/53/1036892053.db2.gz PLQNBDFZDROBJQ-UHFFFAOYSA-N 1 1 347.415 3.887 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601499 1036963962 /nfs/dbraw/zinc/96/39/62/1036963962.db2.gz CMFLOQUQYJZZCG-BBRMVZONSA-N 1 1 328.416 3.515 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccc(Cl)c1 ZINC000007267367 1037026235 /nfs/dbraw/zinc/02/62/35/1037026235.db2.gz MHFBDZPIQBMPEA-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(Cl)c1 ZINC000007267367 1037026251 /nfs/dbraw/zinc/02/62/51/1037026251.db2.gz MHFBDZPIQBMPEA-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO Cc1ccc2nc(CNc3cc(C)[nH+]c4ccc([N+](=O)[O-])cc34)[nH]c2c1 ZINC000542117706 1037094392 /nfs/dbraw/zinc/09/43/92/1037094392.db2.gz GBEKSIJOQIPIDV-UHFFFAOYSA-N 1 1 347.378 3.670 20 5 EHBDMO Cc1cnn([C@@H]2CCC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000493357198 1037270602 /nfs/dbraw/zinc/27/06/02/1037270602.db2.gz GCXUENYFAFTINP-CYBMUJFWSA-N 1 1 334.807 3.590 20 5 EHBDMO Cc1cnn([C@@H]2CCC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000493357198 1037270618 /nfs/dbraw/zinc/27/06/18/1037270618.db2.gz GCXUENYFAFTINP-CYBMUJFWSA-N 1 1 334.807 3.590 20 5 EHBDMO Cc1cc2ncc([C@@H](C)[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])c(C)n2n1 ZINC000271834732 1037428218 /nfs/dbraw/zinc/42/82/18/1037428218.db2.gz VALVTDXIFSZFNC-CHWSQXEVSA-N 1 1 339.399 3.666 20 5 EHBDMO CC1(C)[C@H](O)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000462868196 1037491409 /nfs/dbraw/zinc/49/14/09/1037491409.db2.gz AJQJXRJHPOVMNK-MRXNPFEDSA-N 1 1 332.425 3.669 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)CCC[C@@H]1C ZINC000532571301 1037671059 /nfs/dbraw/zinc/67/10/59/1037671059.db2.gz LWZWJXVAISYVKV-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587414 1037707605 /nfs/dbraw/zinc/70/76/05/1037707605.db2.gz ZHWWHSHKFOILSK-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(C)C ZINC000046064921 1037740897 /nfs/dbraw/zinc/74/08/97/1037740897.db2.gz GYEFHVOFIHSGBR-UHFFFAOYSA-N 1 1 332.347 3.683 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]([C@H]1CC[C@H](O)CC1)[C@H]1C=CCCC1 ZINC000592131271 1037841784 /nfs/dbraw/zinc/84/17/84/1037841784.db2.gz VXUJZVDXNUWSHG-BZSNNMDCSA-N 1 1 330.428 3.809 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCCCF)[C@H]1CC[C@H](O)CC1 ZINC000592132829 1037849778 /nfs/dbraw/zinc/84/97/78/1037849778.db2.gz OCOYTWPBVNOCHB-QAQDUYKDSA-N 1 1 338.423 3.840 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+](C2CC2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000103466263 1037899705 /nfs/dbraw/zinc/89/97/05/1037899705.db2.gz UDCYXKGXYMNRTH-UHFFFAOYSA-N 1 1 331.416 3.639 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3ccc(F)c(F)c3)CC2)c1[N+](=O)[O-] ZINC000595305175 1037984714 /nfs/dbraw/zinc/98/47/14/1037984714.db2.gz XTITTYPAYBKLEV-UHFFFAOYSA-N 1 1 337.326 3.549 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592529431 1038028274 /nfs/dbraw/zinc/02/82/74/1038028274.db2.gz ZIRDBJVHHPMVQO-AAGJOFLKSA-N 1 1 330.428 3.889 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](C4CC4)C3)cs2)c1 ZINC000538752998 1038517793 /nfs/dbraw/zinc/51/77/93/1038517793.db2.gz BXWZMEFSVFSRCO-AWEZNQCLSA-N 1 1 329.425 3.950 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000470180730 1038598758 /nfs/dbraw/zinc/59/87/58/1038598758.db2.gz RSRFRMUMSQTQIL-VHUCWBOISA-N 1 1 330.428 3.747 20 5 EHBDMO Cc1cc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461883445 1038651644 /nfs/dbraw/zinc/65/16/44/1038651644.db2.gz JIGCTHJPEBZBOK-SECBINFHSA-N 1 1 340.305 3.615 20 5 EHBDMO Cc1cc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461883445 1038651647 /nfs/dbraw/zinc/65/16/47/1038651647.db2.gz JIGCTHJPEBZBOK-SECBINFHSA-N 1 1 340.305 3.615 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480064997 1039089700 /nfs/dbraw/zinc/08/97/00/1039089700.db2.gz UFKWSYXMUUHXSA-AWEZNQCLSA-N 1 1 333.432 3.577 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)CO)c1ccccc1 ZINC000554283189 1039156931 /nfs/dbraw/zinc/15/69/31/1039156931.db2.gz LTWQNZYKMSEIJD-GJZGRUSLSA-N 1 1 346.402 3.720 20 5 EHBDMO COc1cc(C[N@@H+](CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485567504 1039246680 /nfs/dbraw/zinc/24/66/80/1039246680.db2.gz HIHNHBLGNHNASM-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000728918106 1039391015 /nfs/dbraw/zinc/39/10/15/1039391015.db2.gz JEJBMXZAZXGMCD-MOPGFXCFSA-N 1 1 344.386 3.822 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@H]1COc2ccccc2O1 ZINC000485769516 1039524008 /nfs/dbraw/zinc/52/40/08/1039524008.db2.gz YIKNZJGCPMBQNF-HOCLYGCPSA-N 1 1 342.395 3.736 20 5 EHBDMO Cc1c(C[NH2+]Cc2nc3c(s2)C[C@@H](C)CC3)cccc1[N+](=O)[O-] ZINC000480488655 1039612056 /nfs/dbraw/zinc/61/20/56/1039612056.db2.gz SNQMSWKRXSGETK-NSHDSACASA-N 1 1 331.441 3.774 20 5 EHBDMO O=C(CC[N@@H+](Cc1cccs1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000027109482 1039896389 /nfs/dbraw/zinc/89/63/89/1039896389.db2.gz FRZJBZDBUYJZTA-UHFFFAOYSA-N 1 1 345.424 3.650 20 5 EHBDMO CCCCC[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845260 1040031889 /nfs/dbraw/zinc/03/18/89/1040031889.db2.gz JFGMOSOAULJPQR-UHFFFAOYSA-N 1 1 334.338 3.598 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1cccc(O)c1 ZINC000490065043 1040330931 /nfs/dbraw/zinc/33/09/31/1040330931.db2.gz DGKNWTAUYQUIJC-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479570004 1040366052 /nfs/dbraw/zinc/36/60/52/1040366052.db2.gz WDQKNQZWBVGHTH-SFHVURJKSA-N 1 1 326.396 3.811 20 5 EHBDMO Cc1noc(C)c1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487158003 1040731447 /nfs/dbraw/zinc/73/14/47/1040731447.db2.gz AJTSYUJVDMNAGY-UHFFFAOYSA-N 1 1 329.278 3.508 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000182279096 1040771811 /nfs/dbraw/zinc/77/18/11/1040771811.db2.gz UUWQADNHVOSOKZ-JTQLQIEISA-N 1 1 334.759 3.828 20 5 EHBDMO CCCN1CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155870 1040938609 /nfs/dbraw/zinc/93/86/09/1040938609.db2.gz ZRXMXAKKYSYUOP-GOSISDBHSA-N 1 1 331.460 3.781 20 5 EHBDMO CCOc1ncccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168572 1040958572 /nfs/dbraw/zinc/95/85/72/1040958572.db2.gz NNXZKWSQZVVIJF-KRWDZBQOSA-N 1 1 341.411 3.901 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCC[C@H]12 ZINC000570894472 1040968075 /nfs/dbraw/zinc/96/80/75/1040968075.db2.gz XFFCQUIRPAOKGV-MRRJBJDNSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCC[C@H]12 ZINC000570894472 1040968094 /nfs/dbraw/zinc/96/80/94/1040968094.db2.gz XFFCQUIRPAOKGV-MRRJBJDNSA-N 1 1 328.416 3.872 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(N3CCC[N@H+](C4CCCC4)CC3)ccc2c1 ZINC000077994927 1041160896 /nfs/dbraw/zinc/16/08/96/1041160896.db2.gz CPEQWBXGRCSOBH-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC000511881140 1041846878 /nfs/dbraw/zinc/84/68/78/1041846878.db2.gz YVIVGZIVKGBHAZ-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC000511881140 1041846884 /nfs/dbraw/zinc/84/68/84/1041846884.db2.gz YVIVGZIVKGBHAZ-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000108086459 1042009127 /nfs/dbraw/zinc/00/91/27/1042009127.db2.gz ILRYCXKYUWEKNW-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C(C)C)C1CCCC1 ZINC000108365179 1042047868 /nfs/dbraw/zinc/04/78/68/1042047868.db2.gz UBOQRUFTTMWKNC-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253531 1042254308 /nfs/dbraw/zinc/25/43/08/1042254308.db2.gz HIZJUVAOCIPLJF-MNOVXSKESA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)c1ccccc1Cl ZINC000069222461 1042798943 /nfs/dbraw/zinc/79/89/43/1042798943.db2.gz PXMNDNRHRXEEPC-LBPRGKRZSA-N 1 1 347.802 3.846 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(-n3ccnc3)cc2)C2CC2)cc1 ZINC000343951397 1042930892 /nfs/dbraw/zinc/93/08/92/1042930892.db2.gz LFCBSWCZKQMCLK-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000039027909 1042981220 /nfs/dbraw/zinc/98/12/20/1042981220.db2.gz KJMIACYHDGJBCL-HNNXBMFYSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000931914783 1043751799 /nfs/dbraw/zinc/75/17/99/1043751799.db2.gz LUCIRUFEISFZNC-LBPRGKRZSA-N 1 1 336.260 3.600 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000931914783 1043751814 /nfs/dbraw/zinc/75/18/14/1043751814.db2.gz LUCIRUFEISFZNC-LBPRGKRZSA-N 1 1 336.260 3.600 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cn1 ZINC000279580025 1044240591 /nfs/dbraw/zinc/24/05/91/1044240591.db2.gz UKFFQBJWNRBAQC-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO NC(CCCc1ccccc1)=[NH+]OCc1c(F)cccc1[N+](=O)[O-] ZINC000728910535 1044670839 /nfs/dbraw/zinc/67/08/39/1044670839.db2.gz OFSADAIGIVQAIT-UHFFFAOYSA-N 1 1 331.347 3.755 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283255 1127473610 /nfs/dbraw/zinc/47/36/10/1127473610.db2.gz PFKBJQOHBYXWMX-NEPJUHHUSA-N 1 1 341.839 3.943 20 5 EHBDMO Cc1ccnc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415283 1127742538 /nfs/dbraw/zinc/74/25/38/1127742538.db2.gz LUXLRCNWWDHECX-XJKSGUPXSA-N 1 1 346.456 3.855 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000765768413 1128148407 /nfs/dbraw/zinc/14/84/07/1128148407.db2.gz ONTGKXUJTMZPND-LBPRGKRZSA-N 1 1 345.355 3.671 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478248 1131242564 /nfs/dbraw/zinc/24/25/64/1131242564.db2.gz XXRKYODHZIPQDE-RHSMWYFYSA-N 1 1 336.395 3.780 20 5 EHBDMO COc1cc2c(cc1OC)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000075618119 1128352471 /nfs/dbraw/zinc/35/24/71/1128352471.db2.gz VWNUAINYFKPBBL-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000075618119 1128352475 /nfs/dbraw/zinc/35/24/75/1128352475.db2.gz VWNUAINYFKPBBL-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cnn(CC3CCC3)c2)c1 ZINC000921835208 1128798467 /nfs/dbraw/zinc/79/84/67/1128798467.db2.gz QGZVVOIRZWYOAT-UHFFFAOYSA-N 1 1 334.807 3.535 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000338739709 1128803048 /nfs/dbraw/zinc/80/30/48/1128803048.db2.gz CVQMOFLISNROHZ-HNNXBMFYSA-N 1 1 343.349 3.536 20 5 EHBDMO CCc1ccc([C@@H](CO)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000542912648 1128832127 /nfs/dbraw/zinc/83/21/27/1128832127.db2.gz OVCIIVKJZHWIFO-MRXNPFEDSA-N 1 1 334.803 3.634 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 ZINC000301669342 1128866613 /nfs/dbraw/zinc/86/66/13/1128866613.db2.gz PTXJFOTWWXMCCT-LBPRGKRZSA-N 1 1 337.383 3.965 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001626016616 1120981493 /nfs/dbraw/zinc/98/14/93/1120981493.db2.gz WJUBDFNFGUMIKG-INIZCTEOSA-N 1 1 347.459 3.596 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000301075500 1121359072 /nfs/dbraw/zinc/35/90/72/1121359072.db2.gz FCUUQZBLNYAFTN-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(=O)c1c(NC[C@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000763206895 1121874767 /nfs/dbraw/zinc/87/47/67/1121874767.db2.gz NNILMQMFLGFBHL-MRXNPFEDSA-N 1 1 343.383 3.639 20 5 EHBDMO C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000301753106 1129034363 /nfs/dbraw/zinc/03/43/63/1129034363.db2.gz VYIOCCCOXUEYNZ-GFCCVEGCSA-N 1 1 334.807 3.576 20 5 EHBDMO Cc1cc(F)ccc1[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744799 1123554336 /nfs/dbraw/zinc/55/43/36/1123554336.db2.gz LAXLRXJCQCVPFF-IBGZPJMESA-N 1 1 344.386 3.740 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350476 1123573349 /nfs/dbraw/zinc/57/33/49/1123573349.db2.gz VEKOSOLNUOBSGT-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350476 1123573354 /nfs/dbraw/zinc/57/33/54/1123573354.db2.gz VEKOSOLNUOBSGT-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@H]12 ZINC000182500294 1125316164 /nfs/dbraw/zinc/31/61/64/1125316164.db2.gz JXUAFBHIIUQWAD-WQVCFCJDSA-N 1 1 342.399 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c1 ZINC000735492271 1131353667 /nfs/dbraw/zinc/35/36/67/1131353667.db2.gz HJBRUYXWSHZURH-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c1 ZINC000735492271 1131353671 /nfs/dbraw/zinc/35/36/71/1131353671.db2.gz HJBRUYXWSHZURH-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@H]21 ZINC000301901921 1129315126 /nfs/dbraw/zinc/31/51/26/1129315126.db2.gz NUTKGGYHIPRQAZ-GDBMZVCRSA-N 1 1 347.459 3.693 20 5 EHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1cccc(O)c1 ZINC000080931879 1129388526 /nfs/dbraw/zinc/38/85/26/1129388526.db2.gz RCYXFLBORNWEAN-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1cccc(O)c1 ZINC000080931879 1129388529 /nfs/dbraw/zinc/38/85/29/1129388529.db2.gz RCYXFLBORNWEAN-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCCO)[C@@H]2CCCc3ccccc32)cs1 ZINC000081549068 1129428188 /nfs/dbraw/zinc/42/81/88/1129428188.db2.gz ZDZIGQODDDUZTL-QGZVFWFLSA-N 1 1 346.452 3.918 20 5 EHBDMO CCCn1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000154252752 1129543800 /nfs/dbraw/zinc/54/38/00/1129543800.db2.gz RPVVFNVEIARTRA-UHFFFAOYSA-N 1 1 342.443 3.983 20 5 EHBDMO CCCn1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000154252752 1129543802 /nfs/dbraw/zinc/54/38/02/1129543802.db2.gz RPVVFNVEIARTRA-UHFFFAOYSA-N 1 1 342.443 3.983 20 5 EHBDMO CO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384181 1129674572 /nfs/dbraw/zinc/67/45/72/1129674572.db2.gz QWCRPNPRXCMMBZ-WBMJQRKESA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384181 1129674574 /nfs/dbraw/zinc/67/45/74/1129674574.db2.gz QWCRPNPRXCMMBZ-WBMJQRKESA-N 1 1 347.440 3.718 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCOc1ccccc1 ZINC000509047885 1129692269 /nfs/dbraw/zinc/69/22/69/1129692269.db2.gz COEKHJFQBKYCCC-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000922880319 1129703309 /nfs/dbraw/zinc/70/33/09/1129703309.db2.gz CTOSXBYBSXKCFP-MRXNPFEDSA-N 1 1 327.384 3.556 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522739 1130230304 /nfs/dbraw/zinc/23/03/04/1130230304.db2.gz UNGCKJPWFFDCCG-QRWLVFNGSA-N 1 1 338.407 3.830 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522739 1130230308 /nfs/dbraw/zinc/23/03/08/1130230308.db2.gz UNGCKJPWFFDCCG-QRWLVFNGSA-N 1 1 338.407 3.830 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2(CCCC2)C1 ZINC000173825387 1130319683 /nfs/dbraw/zinc/31/96/83/1130319683.db2.gz OMOHTTBJPXFIHG-CYBMUJFWSA-N 1 1 342.399 3.972 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000246068376 1130339933 /nfs/dbraw/zinc/33/99/33/1130339933.db2.gz ZBHGKOVUIYECET-ZIAGYGMSSA-N 1 1 329.400 3.770 20 5 EHBDMO CN(CC[N@@H+](C)C1CCCCC1)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208717 1130779430 /nfs/dbraw/zinc/77/94/30/1130779430.db2.gz GZOLKGKLTWKZJN-UHFFFAOYSA-N 1 1 348.472 3.905 20 5 EHBDMO C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000742430426 1131729572 /nfs/dbraw/zinc/72/95/72/1131729572.db2.gz QNNYZRNDWAFIOH-MRXNPFEDSA-N 1 1 325.412 3.696 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172914157 1131902356 /nfs/dbraw/zinc/90/23/56/1131902356.db2.gz DIKQPJCRTVKKOQ-GOSISDBHSA-N 1 1 338.407 3.867 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000743407244 1131917589 /nfs/dbraw/zinc/91/75/89/1131917589.db2.gz RNVHQAANGZNINI-SFHVURJKSA-N 1 1 343.431 3.713 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCn3cccc3[C@H]2C)c1F ZINC001173195372 1131996797 /nfs/dbraw/zinc/99/67/97/1131996797.db2.gz FDYMJOBBRMAAPL-QWHCGFSZSA-N 1 1 347.390 3.552 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCn3cccc3[C@H]2C)c1F ZINC001173195372 1131996804 /nfs/dbraw/zinc/99/68/04/1131996804.db2.gz FDYMJOBBRMAAPL-QWHCGFSZSA-N 1 1 347.390 3.552 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221258 1132004372 /nfs/dbraw/zinc/00/43/72/1132004372.db2.gz GSEJDXUPRPRGAE-FZMZJTMJSA-N 1 1 334.313 3.750 20 5 EHBDMO CCOC(=O)[C@@]1(C)CCCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223260 1132005718 /nfs/dbraw/zinc/00/57/18/1132005718.db2.gz ZEFPSUGKFYKGCA-KXBFYZLASA-N 1 1 348.443 3.581 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001173227878 1132007827 /nfs/dbraw/zinc/00/78/27/1132007827.db2.gz SFKVVKZDQFDNCA-KXBFYZLASA-N 1 1 326.396 3.599 20 5 EHBDMO COc1cc2c(cc1OC)C[NH+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173237109 1132026608 /nfs/dbraw/zinc/02/66/08/1132026608.db2.gz HPWUFKRIGLKECX-ZDUSSCGKSA-N 1 1 342.395 3.559 20 5 EHBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C[C@H]1CC1(C)C ZINC001174915710 1132504016 /nfs/dbraw/zinc/50/40/16/1132504016.db2.gz MTKGJPWSYQWLKO-SNVBAGLBSA-N 1 1 327.222 3.835 20 5 EHBDMO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C[C@H]1CC1(C)C ZINC001174915710 1132504020 /nfs/dbraw/zinc/50/40/20/1132504020.db2.gz MTKGJPWSYQWLKO-SNVBAGLBSA-N 1 1 327.222 3.835 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040028 1132638086 /nfs/dbraw/zinc/63/80/86/1132638086.db2.gz XCAHBRMZIXAPMC-WCQYABFASA-N 1 1 328.334 3.509 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@H]3CCCC(F)(F)C3)ccc([N+](=O)[O-])c2C1 ZINC001169219190 1132698384 /nfs/dbraw/zinc/69/83/84/1132698384.db2.gz OYVFHYZRRNOQRC-NSHDSACASA-N 1 1 325.359 3.573 20 5 EHBDMO C[N@H+]1CCc2c(N[C@H]3CCCC(F)(F)C3)ccc([N+](=O)[O-])c2C1 ZINC001169219190 1132698392 /nfs/dbraw/zinc/69/83/92/1132698392.db2.gz OYVFHYZRRNOQRC-NSHDSACASA-N 1 1 325.359 3.573 20 5 EHBDMO CCOc1cc(C[N@H+]2CCSC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001175698486 1132729928 /nfs/dbraw/zinc/72/99/28/1132729928.db2.gz PTBUPLDDVYUNOT-INIZCTEOSA-N 1 1 338.473 3.957 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC001175690529 1132739580 /nfs/dbraw/zinc/73/95/80/1132739580.db2.gz ZEJHZJIDPVCVIC-UHFFFAOYSA-N 1 1 349.475 3.691 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766842 1133049630 /nfs/dbraw/zinc/04/96/30/1133049630.db2.gz XXEMFNDEPUFUHT-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765451 1133050518 /nfs/dbraw/zinc/05/05/18/1133050518.db2.gz PJTWTYDOIGOYLT-AWEZNQCLSA-N 1 1 331.420 3.650 20 5 EHBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936029 1133072313 /nfs/dbraw/zinc/07/23/13/1133072313.db2.gz OJGMATXFUBRMSZ-VQTJNVASSA-N 1 1 340.423 3.725 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1OCCc2ccccc21 ZINC000768542752 1133153550 /nfs/dbraw/zinc/15/35/50/1133153550.db2.gz YNOOIDAUCCDFAG-GOSISDBHSA-N 1 1 346.814 3.994 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001183464877 1133810602 /nfs/dbraw/zinc/81/06/02/1133810602.db2.gz ZYTXOZZTISBHGB-HNNXBMFYSA-N 1 1 348.443 3.765 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000746662745 1133974860 /nfs/dbraw/zinc/97/48/60/1133974860.db2.gz IBRZLMIVPAJIPH-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000746662745 1133974863 /nfs/dbraw/zinc/97/48/63/1133974863.db2.gz IBRZLMIVPAJIPH-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000746671976 1133990410 /nfs/dbraw/zinc/99/04/10/1133990410.db2.gz CYRYNVPJZPODHK-WFASDCNBSA-N 1 1 325.840 3.553 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001185339682 1134074778 /nfs/dbraw/zinc/07/47/78/1134074778.db2.gz SQSSKCRABSEJSV-LBPRGKRZSA-N 1 1 331.338 3.900 20 5 EHBDMO C[C@@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)OC(C)(C)C ZINC000788489123 1134131352 /nfs/dbraw/zinc/13/13/52/1134131352.db2.gz VMQJJJBYFLYAOM-NSHDSACASA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)OC(C)(C)C ZINC000788489123 1134131354 /nfs/dbraw/zinc/13/13/54/1134131354.db2.gz VMQJJJBYFLYAOM-NSHDSACASA-N 1 1 342.823 3.658 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)C1CCCCC1 ZINC000788817966 1134176105 /nfs/dbraw/zinc/17/61/05/1134176105.db2.gz OAXOXXOFNIAXDN-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)C1CCCCC1 ZINC000788817966 1134176108 /nfs/dbraw/zinc/17/61/08/1134176108.db2.gz OAXOXXOFNIAXDN-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(n2)CCCC3)cc1Cl ZINC000775179636 1134479322 /nfs/dbraw/zinc/47/93/22/1134479322.db2.gz CCLLAVPLVLUOHS-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO C[N@@H+]1CCc2c(NC3CC(C)(C)OC(C)(C)C3)ccc([N+](=O)[O-])c2C1 ZINC001170363405 1134756431 /nfs/dbraw/zinc/75/64/31/1134756431.db2.gz ZDEUJIPTKLJWKF-UHFFFAOYSA-N 1 1 347.459 3.731 20 5 EHBDMO C[N@H+]1CCc2c(NC3CC(C)(C)OC(C)(C)C3)ccc([N+](=O)[O-])c2C1 ZINC001170363405 1134756438 /nfs/dbraw/zinc/75/64/38/1134756438.db2.gz ZDEUJIPTKLJWKF-UHFFFAOYSA-N 1 1 347.459 3.731 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341443 1134758975 /nfs/dbraw/zinc/75/89/75/1134758975.db2.gz IXJKRIIOJRTVGU-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO CC1(C)c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792877159 1134810789 /nfs/dbraw/zinc/81/07/89/1134810789.db2.gz QCHIPJHLQDMPSL-UHFFFAOYSA-N 1 1 341.367 3.796 20 5 EHBDMO CC1(C)c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792877159 1134810794 /nfs/dbraw/zinc/81/07/94/1134810794.db2.gz QCHIPJHLQDMPSL-UHFFFAOYSA-N 1 1 341.367 3.796 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)Cc2cccs2)c1 ZINC001191465278 1134876047 /nfs/dbraw/zinc/87/60/47/1134876047.db2.gz YSDLGKBALDWXLN-GFCCVEGCSA-N 1 1 348.424 3.506 20 5 EHBDMO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424183 1135428103 /nfs/dbraw/zinc/42/81/03/1135428103.db2.gz HXMKKWKEOXIZGJ-CGTJXYLNSA-N 1 1 332.444 3.776 20 5 EHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761672 1135729231 /nfs/dbraw/zinc/72/92/31/1135729231.db2.gz QHDLGQJFXNWVHT-MOPGFXCFSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3ccc4[nH]ccc4c3)CC2)c1[N+](=O)[O-] ZINC001198452281 1135816088 /nfs/dbraw/zinc/81/60/88/1135816088.db2.gz YNCUDHAWDXUYAZ-UHFFFAOYSA-N 1 1 340.383 3.752 20 5 EHBDMO C[C@H]1CSCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001198518086 1135830166 /nfs/dbraw/zinc/83/01/66/1135830166.db2.gz WDJPGNNIPIQJMY-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@H]1CSCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001198518086 1135830169 /nfs/dbraw/zinc/83/01/69/1135830169.db2.gz WDJPGNNIPIQJMY-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO Cc1cc(C)c2c(c1)CC[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)C2 ZINC001198853135 1135860512 /nfs/dbraw/zinc/86/05/12/1135860512.db2.gz VGRACNGIDZHYKC-UHFFFAOYSA-N 1 1 337.379 3.911 20 5 EHBDMO Cc1cc(C)c2c(c1)CC[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)C2 ZINC001198853135 1135860518 /nfs/dbraw/zinc/86/05/18/1135860518.db2.gz VGRACNGIDZHYKC-UHFFFAOYSA-N 1 1 337.379 3.911 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H](CO)c1ccccc1 ZINC000809970635 1135904992 /nfs/dbraw/zinc/90/49/92/1135904992.db2.gz HDMBZYUBHNBVGO-AWEZNQCLSA-N 1 1 341.194 3.725 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@]2(CCOC2)C1 ZINC000809954051 1135905891 /nfs/dbraw/zinc/90/58/91/1135905891.db2.gz PGCBDYCCMHRLDM-AWEZNQCLSA-N 1 1 331.199 3.514 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@]2(CCOC2)C1 ZINC000809954051 1135905893 /nfs/dbraw/zinc/90/58/93/1135905893.db2.gz PGCBDYCCMHRLDM-AWEZNQCLSA-N 1 1 331.199 3.514 20 5 EHBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2ccccc21 ZINC000776270564 1136123904 /nfs/dbraw/zinc/12/39/04/1136123904.db2.gz CTNWEHDRUXFYBE-RTBURBONSA-N 1 1 326.396 3.638 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812853114 1136262625 /nfs/dbraw/zinc/26/26/25/1136262625.db2.gz AOSLJJQSAGCMBL-KXBFYZLASA-N 1 1 328.412 3.581 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585081 1136442268 /nfs/dbraw/zinc/44/22/68/1136442268.db2.gz SOJQKJJBLLGUMZ-DKSSEZFCSA-N 1 1 326.396 3.506 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585279 1136442512 /nfs/dbraw/zinc/44/25/12/1136442512.db2.gz SXEMQMUQDHNZJK-NRXGSXMXSA-N 1 1 344.386 3.645 20 5 EHBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640970 1136487792 /nfs/dbraw/zinc/48/77/92/1136487792.db2.gz ZHQBTRJMNPRNFW-ICSRJNTNSA-N 1 1 340.423 3.680 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814641794 1136488497 /nfs/dbraw/zinc/48/84/97/1136488497.db2.gz LEGZXNDZYLDQDG-MJGOQNOKSA-N 1 1 326.396 3.508 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cc2ccccc2o1 ZINC000815009467 1136536773 /nfs/dbraw/zinc/53/67/73/1136536773.db2.gz GEGFALROKPVZPC-MRXNPFEDSA-N 1 1 326.352 3.506 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cc2ccccc2o1 ZINC000815009467 1136536777 /nfs/dbraw/zinc/53/67/77/1136536777.db2.gz GEGFALROKPVZPC-MRXNPFEDSA-N 1 1 326.352 3.506 20 5 EHBDMO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815596612 1136617132 /nfs/dbraw/zinc/61/71/32/1136617132.db2.gz YUIWBCYXVYXNOZ-XPTSAGLGSA-N 1 1 333.775 3.615 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815573200 1136618100 /nfs/dbraw/zinc/61/81/00/1136618100.db2.gz BIMRBSVVCUSEPM-GFCCVEGCSA-N 1 1 338.367 3.683 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001170858994 1136792495 /nfs/dbraw/zinc/79/24/95/1136792495.db2.gz CRDOCZLZBWESRQ-IAGOWNOFSA-N 1 1 341.411 3.668 20 5 EHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001170858994 1136792496 /nfs/dbraw/zinc/79/24/96/1136792496.db2.gz CRDOCZLZBWESRQ-IAGOWNOFSA-N 1 1 341.411 3.668 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858015369 1136931570 /nfs/dbraw/zinc/93/15/70/1136931570.db2.gz UOQQFCFJZKUTIU-GOSISDBHSA-N 1 1 339.395 3.521 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000846972519 1137377940 /nfs/dbraw/zinc/37/79/40/1137377940.db2.gz GSCPAUGTXOFRKV-ZDUSSCGKSA-N 1 1 331.803 3.941 20 5 EHBDMO CCC1(CC)CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001171954506 1137518655 /nfs/dbraw/zinc/51/86/55/1137518655.db2.gz JUIVXYWBKUXNGS-UHFFFAOYSA-N 1 1 334.416 3.784 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000872022241 1137565272 /nfs/dbraw/zinc/56/52/72/1137565272.db2.gz IHPGXFXMNTWRCD-VBNZEHGJSA-N 1 1 335.473 3.594 20 5 EHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1 ZINC000873186686 1137593304 /nfs/dbraw/zinc/59/33/04/1137593304.db2.gz VIJSXSVVMDVYQM-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO C[C@@]1(C(F)(F)F)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000877813193 1137691146 /nfs/dbraw/zinc/69/11/46/1137691146.db2.gz XRSHEYKJBLCYMR-CYBMUJFWSA-N 1 1 329.278 3.510 20 5 EHBDMO C[C@@]1(C(F)(F)F)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000877813193 1137691147 /nfs/dbraw/zinc/69/11/47/1137691147.db2.gz XRSHEYKJBLCYMR-CYBMUJFWSA-N 1 1 329.278 3.510 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000877819663 1137691569 /nfs/dbraw/zinc/69/15/69/1137691569.db2.gz HHQPLHCOQRCQSX-SAAWKEMMSA-N 1 1 344.333 3.651 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000877819663 1137691570 /nfs/dbraw/zinc/69/15/70/1137691570.db2.gz HHQPLHCOQRCQSX-SAAWKEMMSA-N 1 1 344.333 3.651 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111751 1137702998 /nfs/dbraw/zinc/70/29/98/1137702998.db2.gz CYPDGDZSYOCBNN-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543500 1137719584 /nfs/dbraw/zinc/71/95/84/1137719584.db2.gz DMJQNIVOWYQCIK-CYBMUJFWSA-N 1 1 344.415 3.903 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)cc1F ZINC000880577797 1137781684 /nfs/dbraw/zinc/78/16/84/1137781684.db2.gz LCFZIHMQCDMEPN-INIZCTEOSA-N 1 1 336.407 3.763 20 5 EHBDMO CCC[C@H](C)CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000883257407 1137850963 /nfs/dbraw/zinc/85/09/63/1137850963.db2.gz AMGAIDKIWUEMKW-YOEHRIQHSA-N 1 1 330.432 3.834 20 5 EHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000106877818 1137884921 /nfs/dbraw/zinc/88/49/21/1137884921.db2.gz ZLPLOZYPIVFDKT-NSHDSACASA-N 1 1 335.429 3.870 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000106877818 1137884922 /nfs/dbraw/zinc/88/49/22/1137884922.db2.gz ZLPLOZYPIVFDKT-NSHDSACASA-N 1 1 335.429 3.870 20 5 EHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000331948603 1137926646 /nfs/dbraw/zinc/92/66/46/1137926646.db2.gz PAGXPESNAQDAPZ-HQJJXPTPSA-N 1 1 332.444 3.665 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000886062952 1138037310 /nfs/dbraw/zinc/03/73/10/1138037310.db2.gz ZWJUQSJEAWYKRF-UHFFFAOYSA-N 1 1 337.301 3.788 20 5 EHBDMO Cc1c(NC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000045960119 1138041151 /nfs/dbraw/zinc/04/11/51/1138041151.db2.gz ZMNHFHTVCHRTPU-CQSZACIVSA-N 1 1 348.447 3.679 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962484 1138044597 /nfs/dbraw/zinc/04/45/97/1138044597.db2.gz AQECGINYVMOCIP-SJCJKPOMSA-N 1 1 334.803 3.975 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c1 ZINC000886818103 1138148728 /nfs/dbraw/zinc/14/87/28/1138148728.db2.gz ALHNLERLMDNSSR-IAQYHMDHSA-N 1 1 344.333 3.615 20 5 EHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)cc1 ZINC000083168772 1138175041 /nfs/dbraw/zinc/17/50/41/1138175041.db2.gz GAACHINMPJTBFH-UHFFFAOYSA-N 1 1 341.367 3.767 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)cc1 ZINC000083168772 1138175043 /nfs/dbraw/zinc/17/50/43/1138175043.db2.gz GAACHINMPJTBFH-UHFFFAOYSA-N 1 1 341.367 3.767 20 5 EHBDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092437861 1138228206 /nfs/dbraw/zinc/22/82/06/1138228206.db2.gz YCIXVYRFLXSZSB-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092437861 1138228209 /nfs/dbraw/zinc/22/82/09/1138228209.db2.gz YCIXVYRFLXSZSB-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)cs1 ZINC000174645635 1139432552 /nfs/dbraw/zinc/43/25/52/1139432552.db2.gz WSBVEMQBHGINOB-UHFFFAOYSA-N 1 1 336.388 3.591 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000175387446 1139487411 /nfs/dbraw/zinc/48/74/11/1139487411.db2.gz OSCXTPLFXHBZBX-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1c(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000175387446 1139487420 /nfs/dbraw/zinc/48/74/20/1139487420.db2.gz OSCXTPLFXHBZBX-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3csc([N+](=O)[O-])c3)c2C1 ZINC000179768502 1139781375 /nfs/dbraw/zinc/78/13/75/1139781375.db2.gz VMLRUZOHRDPQQB-UHFFFAOYSA-N 1 1 345.424 3.880 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804333 /nfs/dbraw/zinc/80/43/33/1139804333.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO C[C@@H](N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188795 1140019270 /nfs/dbraw/zinc/01/92/70/1140019270.db2.gz DKNFGLYDYGIMST-BFYDXBDKSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H](N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188795 1140019274 /nfs/dbraw/zinc/01/92/74/1140019274.db2.gz DKNFGLYDYGIMST-BFYDXBDKSA-N 1 1 331.460 3.898 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)c(F)c1 ZINC000266982954 1140746552 /nfs/dbraw/zinc/74/65/52/1140746552.db2.gz BCJUKHDWWWVIAM-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CCC2)CC1 ZINC000269011505 1141046708 /nfs/dbraw/zinc/04/67/08/1141046708.db2.gz NTBQZVAIMLEXTH-OAHLLOKOSA-N 1 1 331.460 3.522 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCC[C@H]1O ZINC000270170600 1141187510 /nfs/dbraw/zinc/18/75/10/1141187510.db2.gz UGPBAVRPUOMXHN-CRAIPNDOSA-N 1 1 337.419 3.539 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)Cc1cc(C)[nH]n1 ZINC000271482973 1141378744 /nfs/dbraw/zinc/37/87/44/1141378744.db2.gz JFHSMLHENLXTFT-TZMCWYRMSA-N 1 1 348.472 3.718 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271490624 1141380465 /nfs/dbraw/zinc/38/04/65/1141380465.db2.gz OVVIBSFXKAMMRV-MLGOLLRUSA-N 1 1 348.374 3.517 20 5 EHBDMO Cc1ccc(C)c(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271694562 1141419617 /nfs/dbraw/zinc/41/96/17/1141419617.db2.gz FZEZGPFTUAGORY-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1cccs1 ZINC000348679637 1141565821 /nfs/dbraw/zinc/56/58/21/1141565821.db2.gz ZTXOVQIBKXWDNO-UHFFFAOYSA-N 1 1 342.424 3.721 20 5 EHBDMO COC(=O)[C@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)[C@H]1C(C)C ZINC000430148978 1014426157 /nfs/dbraw/zinc/42/61/57/1014426157.db2.gz MEZXAAMPYOXFNE-MPYBMCPGSA-N 1 1 346.427 3.518 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000536672117 1032105416 /nfs/dbraw/zinc/10/54/16/1032105416.db2.gz ABRRICAXJBPNFX-YOEHRIQHSA-N 1 1 326.396 3.981 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c[nH]nc2-c2cccnc2)C2CC2)cc1 ZINC000154269219 1015330236 /nfs/dbraw/zinc/33/02/36/1015330236.db2.gz XHYDPDUJLRCPKV-UHFFFAOYSA-N 1 1 349.394 3.545 20 5 EHBDMO CSCCCCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000274943349 1015672834 /nfs/dbraw/zinc/67/28/34/1015672834.db2.gz QUCQWAQVZAADMA-INIZCTEOSA-N 1 1 348.472 3.541 20 5 EHBDMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282945 1015780802 /nfs/dbraw/zinc/78/08/02/1015780802.db2.gz GVQPOCQIIJDSIS-YPMHNXCESA-N 1 1 328.372 3.604 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146912 1016615955 /nfs/dbraw/zinc/61/59/55/1016615955.db2.gz YFBZPXXNOAJOIW-CABCVRRESA-N 1 1 347.459 3.530 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000348631021 1016738685 /nfs/dbraw/zinc/73/86/85/1016738685.db2.gz CANCWTLKEMFIKY-UHFFFAOYSA-N 1 1 344.411 3.595 20 5 EHBDMO CC(C)C[C@@H]([NH3+])c1noc(-c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 ZINC000414613698 1017032854 /nfs/dbraw/zinc/03/28/54/1017032854.db2.gz GBFWXCLHRLMQFV-OAHLLOKOSA-N 1 1 348.406 3.777 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(C)c([N+](=O)[O-])cn2)cc1F ZINC000074743213 1032214106 /nfs/dbraw/zinc/21/41/06/1032214106.db2.gz YUVSWGCFDGPVOW-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000449280744 1032400612 /nfs/dbraw/zinc/40/06/12/1032400612.db2.gz YIPLSXVSLUIVJF-NEPJUHHUSA-N 1 1 332.404 3.557 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1noc2ccccc21)C1CC1 ZINC000593967770 1032661264 /nfs/dbraw/zinc/66/12/64/1032661264.db2.gz YLTDQAYUQTZLMM-UHFFFAOYSA-N 1 1 337.379 3.943 20 5 EHBDMO COc1c(O)cccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449500150 1032677615 /nfs/dbraw/zinc/67/76/15/1032677615.db2.gz NKLYPTNCHVCFLC-HNNXBMFYSA-N 1 1 342.395 3.689 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2cc(F)ccc2o1 ZINC000511108762 1017112751 /nfs/dbraw/zinc/11/27/51/1017112751.db2.gz QJVLEUVRZIGHRN-UHFFFAOYSA-N 1 1 329.331 3.550 20 5 EHBDMO C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]C1 ZINC000414850949 1017250896 /nfs/dbraw/zinc/25/08/96/1017250896.db2.gz IVYKYAYRLANTTP-KGLIPLIRSA-N 1 1 345.468 3.801 20 5 EHBDMO C[N@@H+](CCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177010418 1017545265 /nfs/dbraw/zinc/54/52/65/1017545265.db2.gz KURWMIFNYAJHOB-UHFFFAOYSA-N 1 1 325.368 3.801 20 5 EHBDMO Cc1ccc(C[NH2+][C@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000377407252 1017763538 /nfs/dbraw/zinc/76/35/38/1017763538.db2.gz JWECAAUNIVMATE-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000419373610 1018950134 /nfs/dbraw/zinc/95/01/34/1018950134.db2.gz OLWWMVHRXZQMFB-FVCCEPFGSA-N 1 1 330.388 3.682 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000322407058 1019087454 /nfs/dbraw/zinc/08/74/54/1019087454.db2.gz XMEBHTCUMLYYBG-NWDGAFQWSA-N 1 1 329.322 3.652 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000178857569 1019131979 /nfs/dbraw/zinc/13/19/79/1019131979.db2.gz JMCVYZJBCVBKOH-LIRRHRJNSA-N 1 1 344.411 3.720 20 5 EHBDMO CC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427638 1032816588 /nfs/dbraw/zinc/81/65/88/1032816588.db2.gz LTBKCWBPURVAGN-DYVFJYSZSA-N 1 1 345.468 3.883 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000500980899 1019384595 /nfs/dbraw/zinc/38/45/95/1019384595.db2.gz BEAMRNGZPHDSII-UHFFFAOYSA-N 1 1 331.416 3.602 20 5 EHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000119358011 1020267930 /nfs/dbraw/zinc/26/79/30/1020267930.db2.gz ZCDZDAZSBLDCGY-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO Cn1cc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)c([N+](=O)[O-])n1 ZINC000602439422 1032888793 /nfs/dbraw/zinc/88/87/93/1032888793.db2.gz FMTKAGYVCCRPLY-UHFFFAOYSA-N 1 1 336.395 3.646 20 5 EHBDMO Cn1cc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)c([N+](=O)[O-])n1 ZINC000602439422 1032888815 /nfs/dbraw/zinc/88/88/15/1032888815.db2.gz FMTKAGYVCCRPLY-UHFFFAOYSA-N 1 1 336.395 3.646 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000360870464 1020846125 /nfs/dbraw/zinc/84/61/25/1020846125.db2.gz ILZWXTJIFMIPQM-WBVHZDCISA-N 1 1 340.427 3.763 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000581507903 1021028659 /nfs/dbraw/zinc/02/86/59/1021028659.db2.gz LZYGESNQFORBPT-OAHLLOKOSA-N 1 1 333.432 3.682 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436045 1021147538 /nfs/dbraw/zinc/14/75/38/1021147538.db2.gz YAQLVGKIUURGKP-ZBFHGGJFSA-N 1 1 336.395 3.953 20 5 EHBDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000101434745 1021228568 /nfs/dbraw/zinc/22/85/68/1021228568.db2.gz SPGHISRMUPGKIF-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO O[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)CN1CCCC1 ZINC000051188020 1021624784 /nfs/dbraw/zinc/62/47/84/1021624784.db2.gz BLNJQFIGBPZFFT-IBGZPJMESA-N 1 1 334.463 3.539 20 5 EHBDMO O[C@@H](CNCc1c2ccccc2cc2ccccc21)C[NH+]1CCCC1 ZINC000051188020 1021624794 /nfs/dbraw/zinc/62/47/94/1021624794.db2.gz BLNJQFIGBPZFFT-IBGZPJMESA-N 1 1 334.463 3.539 20 5 EHBDMO COCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506011781 1021696074 /nfs/dbraw/zinc/69/60/74/1021696074.db2.gz GZDWMPDYQICSDX-QPJJXVBHSA-N 1 1 332.425 3.818 20 5 EHBDMO C[N@H+]1CCC2(CN(C(=O)c3cccc4cc5ccccc5cc43)C2)C1 ZINC001270531543 1021711596 /nfs/dbraw/zinc/71/15/96/1021711596.db2.gz LZDYCPJIPVKRRJ-UHFFFAOYSA-N 1 1 330.431 3.771 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000506054774 1021873227 /nfs/dbraw/zinc/87/32/27/1021873227.db2.gz BMVNAQKSVJJBAJ-FNORWQNLSA-N 1 1 342.395 3.627 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000891568859 1021962667 /nfs/dbraw/zinc/96/26/67/1021962667.db2.gz YXBDNNOHYWMPAS-LBPRGKRZSA-N 1 1 346.383 3.511 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000891568859 1021962673 /nfs/dbraw/zinc/96/26/73/1021962673.db2.gz YXBDNNOHYWMPAS-LBPRGKRZSA-N 1 1 346.383 3.511 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000129482175 1022075667 /nfs/dbraw/zinc/07/56/67/1022075667.db2.gz CBFLGOYXQLMUOY-KRWDZBQOSA-N 1 1 332.425 3.670 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000441409822 1022220973 /nfs/dbraw/zinc/22/09/73/1022220973.db2.gz CIGUHBWALBNKGP-MRXNPFEDSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000441409822 1022220985 /nfs/dbraw/zinc/22/09/85/1022220985.db2.gz CIGUHBWALBNKGP-MRXNPFEDSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000084137965 1022278009 /nfs/dbraw/zinc/27/80/09/1022278009.db2.gz PJJGCWBKKWRIGY-UHFFFAOYSA-N 1 1 332.322 3.638 20 5 EHBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668131 1033064567 /nfs/dbraw/zinc/06/45/67/1033064567.db2.gz UCMCBYREOSOMFR-OAHLLOKOSA-N 1 1 346.349 3.741 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000438346718 1022584215 /nfs/dbraw/zinc/58/42/15/1022584215.db2.gz LUYVSZYBKOPLMU-QGZVFWFLSA-N 1 1 346.452 3.916 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)[C@@H](C)O1 ZINC000438346893 1022584442 /nfs/dbraw/zinc/58/44/42/1022584442.db2.gz FEYCVKWXBZHJQK-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)[C@@H](C)O1 ZINC000438346893 1022584452 /nfs/dbraw/zinc/58/44/52/1022584452.db2.gz FEYCVKWXBZHJQK-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C(C)C)s1 ZINC000144922749 1033062095 /nfs/dbraw/zinc/06/20/95/1033062095.db2.gz DJGCMPBDFLAHGF-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO Cc1ccc(C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C(C)C)s1 ZINC000144922749 1033062100 /nfs/dbraw/zinc/06/21/00/1033062100.db2.gz DJGCMPBDFLAHGF-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO CCC1(CC)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000438507518 1022743930 /nfs/dbraw/zinc/74/39/30/1022743930.db2.gz WAALIOXACYKKLG-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602683109 1033083549 /nfs/dbraw/zinc/08/35/49/1033083549.db2.gz IHLDWNGDWSHWMD-ZDUSSCGKSA-N 1 1 346.349 3.597 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](CCCO)[C@@H]2CCc3ccccc32)cc1 ZINC000510652598 1022839246 /nfs/dbraw/zinc/83/92/46/1022839246.db2.gz SWJKBALHRQCPCF-HXUWFJFHSA-N 1 1 340.423 3.509 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@@H]43)o2)c1 ZINC000510694444 1022907712 /nfs/dbraw/zinc/90/77/12/1022907712.db2.gz XYVISZPRJMVFIA-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@@H]43)o2)c1 ZINC000510694444 1022907722 /nfs/dbraw/zinc/90/77/22/1022907722.db2.gz XYVISZPRJMVFIA-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536345655 1022955535 /nfs/dbraw/zinc/95/55/35/1022955535.db2.gz NJUZGNASMGCPAF-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](CC)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000276836579 1023151883 /nfs/dbraw/zinc/15/18/83/1023151883.db2.gz BRIYTDKRVHZHEW-ZDUSSCGKSA-N 1 1 335.429 3.999 20 5 EHBDMO C[C@H](C[N@H+](C)Cc1ccccc1)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256562 1023173258 /nfs/dbraw/zinc/17/32/58/1023173258.db2.gz FOHWHCSUULQSFA-HZPDHXFCSA-N 1 1 327.428 3.766 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256562 1023173263 /nfs/dbraw/zinc/17/32/63/1023173263.db2.gz FOHWHCSUULQSFA-HZPDHXFCSA-N 1 1 327.428 3.766 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])cc2)cc1F ZINC000063254727 1033144432 /nfs/dbraw/zinc/14/44/32/1033144432.db2.gz OJJWTZSIPKXFAX-UHFFFAOYSA-N 1 1 326.331 3.840 20 5 EHBDMO Cc1cc(NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000480500568 1033149663 /nfs/dbraw/zinc/14/96/63/1033149663.db2.gz LEZCPHOJSCMCQO-GOSISDBHSA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000060889725 1033175201 /nfs/dbraw/zinc/17/52/01/1033175201.db2.gz ZPGZNLJVKWKDFJ-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522551454 1024074885 /nfs/dbraw/zinc/07/48/85/1024074885.db2.gz JBBXPUZUVAAOQV-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO Cc1ccn(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)n1 ZINC000434505984 1024087404 /nfs/dbraw/zinc/08/74/04/1024087404.db2.gz ANIQCGLIZXVFPA-UHFFFAOYSA-N 1 1 334.807 3.590 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000465052459 1024334760 /nfs/dbraw/zinc/33/47/60/1024334760.db2.gz ITNDUCREBREZMK-GFCCVEGCSA-N 1 1 343.374 3.586 20 5 EHBDMO C[C@@H]1C[C@H](C)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000443655147 1024357533 /nfs/dbraw/zinc/35/75/33/1024357533.db2.gz NZJROEVXRGGKDT-VXGBXAGGSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000443655147 1024357582 /nfs/dbraw/zinc/35/75/82/1024357582.db2.gz NZJROEVXRGGKDT-VXGBXAGGSA-N 1 1 339.823 3.555 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H](c3cccnc3)C2)c(F)c1 ZINC000602852164 1033208625 /nfs/dbraw/zinc/20/86/25/1033208625.db2.gz DDMPIKMHUIVTIV-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H](c3cccnc3)C2)c(F)c1 ZINC000602852164 1033208635 /nfs/dbraw/zinc/20/86/35/1033208635.db2.gz DDMPIKMHUIVTIV-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000320438313 1024437470 /nfs/dbraw/zinc/43/74/70/1024437470.db2.gz CKOPMACPUULORS-NSHDSACASA-N 1 1 331.338 3.756 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000435055010 1024584675 /nfs/dbraw/zinc/58/46/75/1024584675.db2.gz GKGPVGSPMFWEJU-ILCZHQDMSA-N 1 1 339.395 3.546 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(-c2cc[nH]n2)o1)C1CC1 ZINC000435138281 1024648234 /nfs/dbraw/zinc/64/82/34/1024648234.db2.gz RCFNLQMDSDPBIT-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)C1CC1 ZINC000435138281 1024648246 /nfs/dbraw/zinc/64/82/46/1024648246.db2.gz RCFNLQMDSDPBIT-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO COc1cc(NCCCC[N@H+]2CCC[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000508272943 1025013378 /nfs/dbraw/zinc/01/33/78/1025013378.db2.gz WIKRUJYLQJSVEQ-CYBMUJFWSA-N 1 1 339.411 3.667 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000895990359 1025032796 /nfs/dbraw/zinc/03/27/96/1025032796.db2.gz VJUOADBGGIOQDJ-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)c1cncs1 ZINC000897935360 1033251889 /nfs/dbraw/zinc/25/18/89/1033251889.db2.gz VIEBBLUNURKOES-QMMMGPOBSA-N 1 1 329.328 3.504 20 5 EHBDMO CSC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000602919681 1033266666 /nfs/dbraw/zinc/26/66/66/1033266666.db2.gz KPAFFZOYYKYPCF-UHFFFAOYSA-N 1 1 334.363 3.941 20 5 EHBDMO CSC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000602922614 1033268212 /nfs/dbraw/zinc/26/82/12/1033268212.db2.gz LGYSFWQGEICJER-UHFFFAOYSA-N 1 1 333.413 3.577 20 5 EHBDMO Cc1ncc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)s1 ZINC000602958596 1033279010 /nfs/dbraw/zinc/27/90/10/1033279010.db2.gz YIPBZUHWYCUBGQ-NSHDSACASA-N 1 1 335.429 3.998 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)o1 ZINC000551826593 1025474804 /nfs/dbraw/zinc/47/48/04/1025474804.db2.gz NTAARYCJMYRPON-MJGOQNOKSA-N 1 1 342.395 3.998 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)(F)CC1 ZINC000602992682 1033290597 /nfs/dbraw/zinc/29/05/97/1033290597.db2.gz CJYXVPYKMWRLSL-NSHDSACASA-N 1 1 334.351 3.530 20 5 EHBDMO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000436307284 1025572338 /nfs/dbraw/zinc/57/23/38/1025572338.db2.gz KIUPCLDMCZQHHO-MNOVXSKESA-N 1 1 346.353 3.541 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@H](C4CCOCC4)C3)c2c1 ZINC000896590887 1025691230 /nfs/dbraw/zinc/69/12/30/1025691230.db2.gz FICGHAKWEAVLKH-OAHLLOKOSA-N 1 1 341.411 3.786 20 5 EHBDMO CC[N@H+](Cc1ccc(C)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000521860767 1025736236 /nfs/dbraw/zinc/73/62/36/1025736236.db2.gz LWMHPBKVNOASOK-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000521860767 1025736252 /nfs/dbraw/zinc/73/62/52/1025736252.db2.gz LWMHPBKVNOASOK-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO C[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000530494592 1025942318 /nfs/dbraw/zinc/94/23/18/1025942318.db2.gz PFQAFVRUIUNXEE-QGZVFWFLSA-N 1 1 332.425 3.670 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCOCC(F)(F)F)C2)cc1 ZINC000451547195 1026099940 /nfs/dbraw/zinc/09/99/40/1026099940.db2.gz KNDWHDBWXIXJFZ-CQSZACIVSA-N 1 1 346.349 3.743 20 5 EHBDMO Cc1nc(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451550864 1026101254 /nfs/dbraw/zinc/10/12/54/1026101254.db2.gz SRHMPICDMHUWEX-HNNXBMFYSA-N 1 1 331.441 3.782 20 5 EHBDMO C[C@H](CC[NH+](C)C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237446994 1026380550 /nfs/dbraw/zinc/38/05/50/1026380550.db2.gz JCCRKIYPHQKWIF-CYBMUJFWSA-N 1 1 333.457 3.753 20 5 EHBDMO C[C@H](CCN(C)C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237446994 1026380564 /nfs/dbraw/zinc/38/05/64/1026380564.db2.gz JCCRKIYPHQKWIF-CYBMUJFWSA-N 1 1 333.457 3.753 20 5 EHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001167582124 1026525513 /nfs/dbraw/zinc/52/55/13/1026525513.db2.gz KYTAXLXQPXEXBG-AWEZNQCLSA-N 1 1 334.441 3.988 20 5 EHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccc([N+](=O)[O-])c(N)c1F ZINC000348739656 1026714869 /nfs/dbraw/zinc/71/48/69/1026714869.db2.gz DEKAECGVWLMZOD-UHFFFAOYSA-N 1 1 346.406 3.768 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)n1 ZINC000611616499 1027154846 /nfs/dbraw/zinc/15/48/46/1027154846.db2.gz ULTPPOBCNVRUNB-DLBZAZTESA-N 1 1 346.475 3.697 20 5 EHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501854087 1027600712 /nfs/dbraw/zinc/60/07/12/1027600712.db2.gz WYYOLKVIMCONRR-AWEZNQCLSA-N 1 1 333.432 3.824 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000078338101 1027686804 /nfs/dbraw/zinc/68/68/04/1027686804.db2.gz PBMBNLHBQZRWOB-BLLLJJGKSA-N 1 1 332.429 3.546 20 5 EHBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391411 1027795569 /nfs/dbraw/zinc/79/55/69/1027795569.db2.gz XQEKOAKWZBNORR-MRXNPFEDSA-N 1 1 334.416 3.862 20 5 EHBDMO CC[C@@H](c1ccc(F)cc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496897 1028090267 /nfs/dbraw/zinc/09/02/67/1028090267.db2.gz TUFRHUSGOXDCPR-RDJZCZTQSA-N 1 1 344.390 3.766 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(N3CCc4ccccc43)CC2)cs1 ZINC000502323605 1028102410 /nfs/dbraw/zinc/10/24/10/1028102410.db2.gz XIJMJWDQAQUOKV-UHFFFAOYSA-N 1 1 343.452 3.683 20 5 EHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680973 1028150152 /nfs/dbraw/zinc/15/01/52/1028150152.db2.gz XWJDRIGGGIGOOL-WMLDXEAASA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000444764104 1028247276 /nfs/dbraw/zinc/24/72/76/1028247276.db2.gz AYHXGEMYDBVGJE-AWEZNQCLSA-N 1 1 330.388 3.513 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000444773062 1028260209 /nfs/dbraw/zinc/26/02/09/1028260209.db2.gz QBSKRRISHZYWAP-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000444773062 1028260222 /nfs/dbraw/zinc/26/02/22/1028260222.db2.gz QBSKRRISHZYWAP-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H](O)CC34CCC4)o2)c1 ZINC000421380633 1028343630 /nfs/dbraw/zinc/34/36/30/1028343630.db2.gz YQTDKUPWCPRRMS-MRXNPFEDSA-N 1 1 342.395 3.734 20 5 EHBDMO COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000519917717 1028379007 /nfs/dbraw/zinc/37/90/07/1028379007.db2.gz FRSJTXCCESYBLK-INIZCTEOSA-N 1 1 344.411 3.683 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ncccc2F)CC1 ZINC000278030706 1028600403 /nfs/dbraw/zinc/60/04/03/1028600403.db2.gz BJLQCMXMZSXFEH-ZDUSSCGKSA-N 1 1 345.374 3.733 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC000523791359 1028627445 /nfs/dbraw/zinc/62/74/45/1028627445.db2.gz XZNZEHVJVSGBEC-QGZVFWFLSA-N 1 1 344.436 3.764 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000523855636 1028665624 /nfs/dbraw/zinc/66/56/24/1028665624.db2.gz RIEFTSYSBYPSIW-GFCCVEGCSA-N 1 1 326.824 3.764 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000504495216 1028676340 /nfs/dbraw/zinc/67/63/40/1028676340.db2.gz YUQFKJDEMIGUBM-QGZVFWFLSA-N 1 1 326.396 3.901 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569540 1028703314 /nfs/dbraw/zinc/70/33/14/1028703314.db2.gz GGUGPPOWGDJJQL-XIVBQZFQSA-N 1 1 332.444 3.746 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CC[N@@H+](C3CCCC3)C1)CCC2 ZINC000583064226 1028714435 /nfs/dbraw/zinc/71/44/35/1028714435.db2.gz ISPNGHAGZNTJAO-BEFAXECRSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CC[N@H+](C3CCCC3)C1)CCC2 ZINC000583064226 1028714452 /nfs/dbraw/zinc/71/44/52/1028714452.db2.gz ISPNGHAGZNTJAO-BEFAXECRSA-N 1 1 329.444 3.579 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000532901485 1029044653 /nfs/dbraw/zinc/04/46/53/1029044653.db2.gz PRBSPPWFRHAFKF-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000532901485 1029044671 /nfs/dbraw/zinc/04/46/71/1029044671.db2.gz PRBSPPWFRHAFKF-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000514892760 1029049186 /nfs/dbraw/zinc/04/91/86/1029049186.db2.gz BAPUVPWRCTZNCY-KGLIPLIRSA-N 1 1 348.447 3.542 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912014 1029056109 /nfs/dbraw/zinc/05/61/09/1029056109.db2.gz OVGQBILFCUNYPI-PMPSAXMXSA-N 1 1 349.475 3.907 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912014 1029056129 /nfs/dbraw/zinc/05/61/29/1029056129.db2.gz OVGQBILFCUNYPI-PMPSAXMXSA-N 1 1 349.475 3.907 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000532935226 1029102435 /nfs/dbraw/zinc/10/24/35/1029102435.db2.gz WYSUJZKEKIQDEX-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO COc1ccc(C[N@H+](Cc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000052161770 1029128218 /nfs/dbraw/zinc/12/82/18/1029128218.db2.gz PSMBXMXGHNJKGM-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000052161770 1029128225 /nfs/dbraw/zinc/12/82/25/1029128225.db2.gz PSMBXMXGHNJKGM-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO Cc1ccc(C)c([C@@H](C)[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000532977476 1029133309 /nfs/dbraw/zinc/13/33/09/1029133309.db2.gz MLYCYPYFMCWMEA-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000532977476 1029133319 /nfs/dbraw/zinc/13/33/19/1029133319.db2.gz MLYCYPYFMCWMEA-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC4(CCCC4)C3)n2)c1 ZINC000615000541 1029237592 /nfs/dbraw/zinc/23/75/92/1029237592.db2.gz UGNGUSUYCYDXSS-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453441176 1030259534 /nfs/dbraw/zinc/25/95/34/1030259534.db2.gz MVOJNVOGVFRGOT-JENIJYKNSA-N 1 1 342.443 3.832 20 5 EHBDMO COc1ccc(C[N@@H+](CCc2nccs2)C(C)C)cc1[N+](=O)[O-] ZINC000159753089 1030349685 /nfs/dbraw/zinc/34/96/85/1030349685.db2.gz SZGVAZZRKMJTHP-UHFFFAOYSA-N 1 1 335.429 3.513 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000532144619 1030436531 /nfs/dbraw/zinc/43/65/31/1030436531.db2.gz LHTRUERRJOEJBD-UHFFFAOYSA-N 1 1 340.423 3.902 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267979 1030515701 /nfs/dbraw/zinc/51/57/01/1030515701.db2.gz PLWBTDCXRCYIBG-DYVFJYSZSA-N 1 1 334.416 3.862 20 5 EHBDMO C[C@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@H+]1C ZINC000343436002 1030867384 /nfs/dbraw/zinc/86/73/84/1030867384.db2.gz LJGSGCBFLROKBB-IFXJQAMLSA-N 1 1 333.435 3.601 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483101751 1030957338 /nfs/dbraw/zinc/95/73/38/1030957338.db2.gz DFXZDIHAVQUJFQ-OAHLLOKOSA-N 1 1 330.359 3.602 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360660 1030986406 /nfs/dbraw/zinc/98/64/06/1030986406.db2.gz CORVCHKFCXLNDS-PBHICJAKSA-N 1 1 344.411 3.980 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000593069977 1031313413 /nfs/dbraw/zinc/31/34/13/1031313413.db2.gz MIUIELICYXDGTQ-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H](C)[C@@H]1C ZINC000475744576 1031834086 /nfs/dbraw/zinc/83/40/86/1031834086.db2.gz RBVXSTGVJDEZRJ-SNPRPXQTSA-N 1 1 333.432 3.598 20 5 EHBDMO NC(=[NH+]OCc1cccc([N+](=O)[O-])c1Br)C1CCCC1 ZINC000842020765 1033311267 /nfs/dbraw/zinc/31/12/67/1033311267.db2.gz DXOKKTBPLHCHIJ-UHFFFAOYSA-N 1 1 342.193 3.546 20 5 EHBDMO CCOc1cncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000598679061 1033377641 /nfs/dbraw/zinc/37/76/41/1033377641.db2.gz OZWYXUSHCMBNPR-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000598679061 1033377653 /nfs/dbraw/zinc/37/76/53/1033377653.db2.gz OZWYXUSHCMBNPR-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000594522098 1033428889 /nfs/dbraw/zinc/42/88/89/1033428889.db2.gz HLUGHZMUWFEJCV-HNNXBMFYSA-N 1 1 348.786 3.870 20 5 EHBDMO O=C(CC[N@H+]1CC[C@@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000594716279 1033501137 /nfs/dbraw/zinc/50/11/37/1033501137.db2.gz NYDMNLVVRNHBDY-MRXNPFEDSA-N 1 1 343.358 3.510 20 5 EHBDMO Cc1c(C[NH2+]Cc2cc(F)ccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000594937927 1033585822 /nfs/dbraw/zinc/58/58/22/1033585822.db2.gz KGWXYLKHYUOYRM-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OC(C)C)nc1 ZINC000595011262 1033604644 /nfs/dbraw/zinc/60/46/44/1033604644.db2.gz KVMPFOZSSUWJER-CYBMUJFWSA-N 1 1 345.399 3.636 20 5 EHBDMO CCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595009622 1033632410 /nfs/dbraw/zinc/63/24/10/1033632410.db2.gz CKQLJNKTUCTLJA-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1cccc(OC)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000595072641 1033647026 /nfs/dbraw/zinc/64/70/26/1033647026.db2.gz IYSICKPNWSHTIP-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO C[N@H+]1CCCC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994321 1033647881 /nfs/dbraw/zinc/64/78/81/1033647881.db2.gz JUNTYYGIAQVNRF-OAHLLOKOSA-N 1 1 343.427 3.676 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329287 1033730709 /nfs/dbraw/zinc/73/07/09/1033730709.db2.gz PNKBPDJKGXXKPE-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H](CCO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000593693797 1033800655 /nfs/dbraw/zinc/80/06/55/1033800655.db2.gz DVOSIWNXEKQAHA-LLVKDONJSA-N 1 1 338.791 3.711 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)ccc1[N+](=O)[O-] ZINC000595502817 1033834506 /nfs/dbraw/zinc/83/45/06/1033834506.db2.gz NZWRDGCFJWINQV-INIZCTEOSA-N 1 1 341.411 3.768 20 5 EHBDMO C[N@H+](CCCC(=O)c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000450229776 1033949063 /nfs/dbraw/zinc/94/90/63/1033949063.db2.gz YBNWUAZMQZHTTH-UHFFFAOYSA-N 1 1 330.359 3.829 20 5 EHBDMO C[N@@H+](CCCC(=O)c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000450229776 1033949077 /nfs/dbraw/zinc/94/90/77/1033949077.db2.gz YBNWUAZMQZHTTH-UHFFFAOYSA-N 1 1 330.359 3.829 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000595715487 1033959704 /nfs/dbraw/zinc/95/97/04/1033959704.db2.gz AKXRIPKPGVBMBX-GOSISDBHSA-N 1 1 342.395 3.584 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000603837175 1033961955 /nfs/dbraw/zinc/96/19/55/1033961955.db2.gz AJHYNQWJRCGOLA-QGZVFWFLSA-N 1 1 326.396 3.983 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976014 1033969147 /nfs/dbraw/zinc/96/91/47/1033969147.db2.gz KRQPAHPXSNRLEN-KUHUBIRLSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976014 1033969162 /nfs/dbraw/zinc/96/91/62/1033969162.db2.gz KRQPAHPXSNRLEN-KUHUBIRLSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976013 1033969507 /nfs/dbraw/zinc/96/95/07/1033969507.db2.gz KRQPAHPXSNRLEN-IFXJQAMLSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976013 1033969518 /nfs/dbraw/zinc/96/95/18/1033969518.db2.gz KRQPAHPXSNRLEN-IFXJQAMLSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000603853712 1033977263 /nfs/dbraw/zinc/97/72/63/1033977263.db2.gz KHPXTNFVBKJDLO-UONOGXRCSA-N 1 1 328.416 3.818 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692812 1034098771 /nfs/dbraw/zinc/09/87/71/1034098771.db2.gz XXSUTATXMWCVRX-BAABZTOOSA-N 1 1 332.400 3.640 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679785 1034108368 /nfs/dbraw/zinc/10/83/68/1034108368.db2.gz OVYJVFDHZXZOJV-OAHLLOKOSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H](NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413039 1034298773 /nfs/dbraw/zinc/29/87/73/1034298773.db2.gz SKMDWINSCADWGZ-KDOFPFPSSA-N 1 1 345.443 3.569 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000604435949 1034377974 /nfs/dbraw/zinc/37/79/74/1034377974.db2.gz OHAMOWXAWCUCHW-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534475657 1034601057 /nfs/dbraw/zinc/60/10/57/1034601057.db2.gz PWFNYBVTRCXBMM-AWEZNQCLSA-N 1 1 338.407 3.959 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)CC2 ZINC000614976493 1034742872 /nfs/dbraw/zinc/74/28/72/1034742872.db2.gz CUDYJUOXYAXJNG-UHFFFAOYSA-N 1 1 347.459 3.837 20 5 EHBDMO C[C@@H](NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000601931592 1034829503 /nfs/dbraw/zinc/82/95/03/1034829503.db2.gz BAZBIDPVUNPTMO-RBSFLKMASA-N 1 1 341.411 3.511 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179893610 1034984374 /nfs/dbraw/zinc/98/43/74/1034984374.db2.gz UPKPJHNXBMQCGY-UHFFFAOYSA-N 1 1 344.358 3.622 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000580984601 1035468777 /nfs/dbraw/zinc/46/87/77/1035468777.db2.gz OFXFYGGHCMQXGU-SQUITACLSA-N 1 1 349.434 3.745 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000588072502 1035700563 /nfs/dbraw/zinc/70/05/63/1035700563.db2.gz RXUHBDIRTIXGRB-SFHVURJKSA-N 1 1 343.452 3.759 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c1 ZINC000540906905 1035785623 /nfs/dbraw/zinc/78/56/23/1035785623.db2.gz AJWCMXNXBDGEAW-HZPDHXFCSA-N 1 1 347.459 3.694 20 5 EHBDMO Cc1ccccc1C1CC([N@@H+](CCn2cc([N+](=O)[O-])cn2)C2CC2)C1 ZINC000350150613 1035964327 /nfs/dbraw/zinc/96/43/27/1035964327.db2.gz CLBGXEZRYQWLRB-UHFFFAOYSA-N 1 1 340.427 3.510 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056495176 1036330006 /nfs/dbraw/zinc/33/00/06/1036330006.db2.gz WSNYYWVDFMCRKF-UHFFFAOYSA-N 1 1 325.478 3.600 20 5 EHBDMO C[N@@H+]1CCO[C@H](CSCc2nc3ccccc3c3ccccc23)C1 ZINC000572601736 1036396164 /nfs/dbraw/zinc/39/61/64/1036396164.db2.gz YTKVUBROWGFLGG-HNNXBMFYSA-N 1 1 338.476 3.952 20 5 EHBDMO C[N@H+]1CCO[C@H](CSCc2nc3ccccc3c3ccccc23)C1 ZINC000572601736 1036396185 /nfs/dbraw/zinc/39/61/85/1036396185.db2.gz YTKVUBROWGFLGG-HNNXBMFYSA-N 1 1 338.476 3.952 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)Cc2cc(C)ccc2C)c1 ZINC000589515123 1036488452 /nfs/dbraw/zinc/48/84/52/1036488452.db2.gz CJADIVOWSBFYMX-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)Cc2cc(C)ccc2C)c1 ZINC000589515123 1036488466 /nfs/dbraw/zinc/48/84/66/1036488466.db2.gz CJADIVOWSBFYMX-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO CCC[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541699418 1036568441 /nfs/dbraw/zinc/56/84/41/1036568441.db2.gz FSNVZSQDKAVUAP-GFCCVEGCSA-N 1 1 339.823 3.841 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541699418 1036568452 /nfs/dbraw/zinc/56/84/52/1036568452.db2.gz FSNVZSQDKAVUAP-GFCCVEGCSA-N 1 1 339.823 3.841 20 5 EHBDMO Cc1cnn(CC2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000493074968 1036639297 /nfs/dbraw/zinc/63/92/97/1036639297.db2.gz FFSAYRINFHUPEB-UHFFFAOYSA-N 1 1 348.834 3.665 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000541773770 1036646550 /nfs/dbraw/zinc/64/65/50/1036646550.db2.gz MHEXTPJTPDWKTP-DNVCBOLYSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000541773770 1036646563 /nfs/dbraw/zinc/64/65/63/1036646563.db2.gz MHEXTPJTPDWKTP-DNVCBOLYSA-N 1 1 326.396 3.865 20 5 EHBDMO COc1cc(C[NH2+]C2(c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1F ZINC000464674479 1036649547 /nfs/dbraw/zinc/64/95/47/1036649547.db2.gz BLGWYGLDPAIKOJ-UHFFFAOYSA-N 1 1 334.322 3.661 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC34CCOCC4)o2)cc1 ZINC000376463052 1037025985 /nfs/dbraw/zinc/02/59/85/1037025985.db2.gz KLGXMGCQEUMWGI-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1CCCC[C@H]1C ZINC000761520403 1037097900 /nfs/dbraw/zinc/09/79/00/1037097900.db2.gz FAYVCUCMLRBQLX-OLZOCXBDSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@H]1C ZINC000761520403 1037097907 /nfs/dbraw/zinc/09/79/07/1037097907.db2.gz FAYVCUCMLRBQLX-OLZOCXBDSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@H](C[N@H+](C)Cc1ccccc1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761527037 1037101897 /nfs/dbraw/zinc/10/18/97/1037101897.db2.gz LZIVRSDIRLSUQI-CQSZACIVSA-N 1 1 347.846 3.858 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761527037 1037101911 /nfs/dbraw/zinc/10/19/11/1037101911.db2.gz LZIVRSDIRLSUQI-CQSZACIVSA-N 1 1 347.846 3.858 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc3c2OCCCO3)cc1Cl ZINC000761528166 1037105341 /nfs/dbraw/zinc/10/53/41/1037105341.db2.gz MMMGZNQTXOYDCD-UHFFFAOYSA-N 1 1 348.786 3.699 20 5 EHBDMO COCC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccco1 ZINC000595035082 1037191128 /nfs/dbraw/zinc/19/11/28/1037191128.db2.gz URPHZHKVRKGDJZ-SWLSCSKDSA-N 1 1 334.372 3.625 20 5 EHBDMO CCc1cccc(C)c1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271781913 1037209473 /nfs/dbraw/zinc/20/94/73/1037209473.db2.gz SJDIVTJRKMELEW-AWEZNQCLSA-N 1 1 341.411 3.755 20 5 EHBDMO CC[C@@H]1CCCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532583638 1037704169 /nfs/dbraw/zinc/70/41/69/1037704169.db2.gz ZGSGSWHBRRUDOF-GFCCVEGCSA-N 1 1 339.823 3.841 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532583638 1037704182 /nfs/dbraw/zinc/70/41/82/1037704182.db2.gz ZGSGSWHBRRUDOF-GFCCVEGCSA-N 1 1 339.823 3.841 20 5 EHBDMO CC(C)C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000031582054 1037722836 /nfs/dbraw/zinc/72/28/36/1037722836.db2.gz ZOVMXWKWCSLGDP-UHFFFAOYSA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)c2c(c1)COCO2 ZINC000046089270 1037727482 /nfs/dbraw/zinc/72/74/82/1037727482.db2.gz XMULSKDRZVWHKT-INIZCTEOSA-N 1 1 346.408 3.860 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2ccsc2)c2c(c1)COCO2 ZINC000046089270 1037727501 /nfs/dbraw/zinc/72/75/01/1037727501.db2.gz XMULSKDRZVWHKT-INIZCTEOSA-N 1 1 346.408 3.860 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc3n(n2)CCCC3)cc1[N+](=O)[O-] ZINC000592387717 1037953991 /nfs/dbraw/zinc/95/39/91/1037953991.db2.gz IRAZPHKINDWVAK-ZIAGYGMSSA-N 1 1 328.416 3.848 20 5 EHBDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549999401 1038011457 /nfs/dbraw/zinc/01/14/57/1038011457.db2.gz DQLZZBPNTWFTKM-OAHLLOKOSA-N 1 1 346.349 3.741 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000470172232 1038449888 /nfs/dbraw/zinc/44/98/88/1038449888.db2.gz UCIFHHKMJDBRRU-SVEZXWBTSA-N 1 1 330.428 3.747 20 5 EHBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1C ZINC000538726462 1038507518 /nfs/dbraw/zinc/50/75/18/1038507518.db2.gz SVZFNYZBJSJCBU-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1C ZINC000538726462 1038507522 /nfs/dbraw/zinc/50/75/22/1038507522.db2.gz SVZFNYZBJSJCBU-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000538743504 1038509249 /nfs/dbraw/zinc/50/92/49/1038509249.db2.gz JTMVTNWGNFBDQZ-INIZCTEOSA-N 1 1 347.459 3.514 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1C ZINC000538937424 1038604655 /nfs/dbraw/zinc/60/46/55/1038604655.db2.gz RXEDLIPLELGNDY-DGCLKSJQSA-N 1 1 343.374 3.505 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CNCC[NH+]3CCCC3)o2)c(Cl)c1 ZINC000500507704 1038886752 /nfs/dbraw/zinc/88/67/52/1038886752.db2.gz KOAOIVQTSOMPPJ-UHFFFAOYSA-N 1 1 349.818 3.694 20 5 EHBDMO CCOc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015293392 1039088051 /nfs/dbraw/zinc/08/80/51/1039088051.db2.gz PHHRWHGEVNFAFU-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015293392 1039088065 /nfs/dbraw/zinc/08/80/65/1039088065.db2.gz PHHRWHGEVNFAFU-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000485738641 1039491676 /nfs/dbraw/zinc/49/16/76/1039491676.db2.gz OUYPIWTXIXEYJE-ZDUSSCGKSA-N 1 1 328.368 3.825 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCOc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485774313 1039530911 /nfs/dbraw/zinc/53/09/11/1039530911.db2.gz RDSDSZAHVNRSBZ-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489106243 1039626331 /nfs/dbraw/zinc/62/63/31/1039626331.db2.gz PPYXQCDENILANO-INIZCTEOSA-N 1 1 342.395 3.949 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128418619 1039628554 /nfs/dbraw/zinc/62/85/54/1039628554.db2.gz PREWWBXGVWTJEJ-ZDUSSCGKSA-N 1 1 337.395 3.573 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cn3ccsc3n1)CCCC2 ZINC000417309518 1039663507 /nfs/dbraw/zinc/66/35/07/1039663507.db2.gz FABCHYQJVAKILY-INIZCTEOSA-N 1 1 342.424 3.861 20 5 EHBDMO Cc1ccnc(OC2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000341492701 1039702536 /nfs/dbraw/zinc/70/25/36/1039702536.db2.gz DXPLEKTXQLJNQK-UHFFFAOYSA-N 1 1 341.411 3.650 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490038971 1040300841 /nfs/dbraw/zinc/30/08/41/1040300841.db2.gz BFDBVCYSMOIBGQ-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042478 1040318073 /nfs/dbraw/zinc/31/80/73/1040318073.db2.gz VQNBYVJQIFRNLF-IBGZPJMESA-N 1 1 326.396 3.767 20 5 EHBDMO C[C@@H]1C[C@@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@H+]1Cc1ccccc1 ZINC000511649212 1040398985 /nfs/dbraw/zinc/39/89/85/1040398985.db2.gz WCRKZIVYPNTJCS-NVXWUHKLSA-N 1 1 340.427 3.702 20 5 EHBDMO COc1cccc(C2CCN(Cc3cc([O-])ccc3[N+](=O)[O-])CC2)c1 ZINC000555334626 1040419631 /nfs/dbraw/zinc/41/96/31/1040419631.db2.gz ZHWDIMVIHMEMGE-UHFFFAOYSA-N 1 1 342.395 3.689 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000512673668 1040486487 /nfs/dbraw/zinc/48/64/87/1040486487.db2.gz PZNITONOQYNHGN-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2noc3ccccc23)cc1[N+](=O)[O-] ZINC000566571447 1040543823 /nfs/dbraw/zinc/54/38/23/1040543823.db2.gz BHKTWSYMPPYCLG-GFCCVEGCSA-N 1 1 341.367 3.986 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H](c4ccccc4)C3)nc2c1 ZINC000433053568 1040575000 /nfs/dbraw/zinc/57/50/00/1040575000.db2.gz QRMNRMOTPUBHDJ-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487200449 1040786828 /nfs/dbraw/zinc/78/68/28/1040786828.db2.gz PPYTYQPJSFPUNB-CQSZACIVSA-N 1 1 335.448 3.550 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]C2CCN(CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154341 1040917843 /nfs/dbraw/zinc/91/78/43/1040917843.db2.gz ZBZKAYMXQWGLPA-LJQANCHMSA-N 1 1 343.471 3.781 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC000491137925 1040922363 /nfs/dbraw/zinc/92/23/63/1040922363.db2.gz HASDKCMUYLTTFG-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](C)c1ccccc1 ZINC000066854376 1041242787 /nfs/dbraw/zinc/24/27/87/1041242787.db2.gz QGJTZXQMKBQXIR-HNNXBMFYSA-N 1 1 341.411 3.577 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185701 1041371908 /nfs/dbraw/zinc/37/19/08/1041371908.db2.gz HQSDAPJWDSECDG-QGZVFWFLSA-N 1 1 326.396 3.901 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCCO1 ZINC000511665840 1041449306 /nfs/dbraw/zinc/44/93/06/1041449306.db2.gz STGRGVROAOWALT-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC000511881139 1041847564 /nfs/dbraw/zinc/84/75/64/1041847564.db2.gz YVIVGZIVKGBHAZ-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC000511881139 1041847570 /nfs/dbraw/zinc/84/75/70/1041847570.db2.gz YVIVGZIVKGBHAZ-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cc(N2CCC[N@@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000108101731 1042008032 /nfs/dbraw/zinc/00/80/32/1042008032.db2.gz HHJRMKHQWJPWCA-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO CCOc1ccc(NC(=O)C[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000108364384 1042047481 /nfs/dbraw/zinc/04/74/81/1042047481.db2.gz KXROGPQKRZPNJJ-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@@H+]2CCc3sccc3C2)c(Cl)c1 ZINC000108851050 1042107375 /nfs/dbraw/zinc/10/73/75/1042107375.db2.gz PSPRHEKLRSLXTK-UHFFFAOYSA-N 1 1 337.832 3.780 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3sccc3C2)c(Cl)c1 ZINC000108851050 1042107376 /nfs/dbraw/zinc/10/73/76/1042107376.db2.gz PSPRHEKLRSLXTK-UHFFFAOYSA-N 1 1 337.832 3.780 20 5 EHBDMO CSCCC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000305936827 1042955499 /nfs/dbraw/zinc/95/54/99/1042955499.db2.gz KRYBQBAWCVVAEQ-UHFFFAOYSA-N 1 1 333.251 3.542 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432333876 1042968234 /nfs/dbraw/zinc/96/82/34/1042968234.db2.gz DAGYOLBFQVIFDM-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO COc1ccc(C[NH2+]Cc2nc(C(C)C)c(C)s2)cc1[N+](=O)[O-] ZINC000344145712 1043328520 /nfs/dbraw/zinc/32/85/20/1043328520.db2.gz AJVFBUVAKKBKSX-UHFFFAOYSA-N 1 1 335.429 3.782 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2cn3ccsc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000279146084 1043448937 /nfs/dbraw/zinc/44/89/37/1043448937.db2.gz SIIDOYCMBHNFLG-HNNXBMFYSA-N 1 1 342.424 3.816 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301398762 1127740855 /nfs/dbraw/zinc/74/08/55/1127740855.db2.gz ARWFIRQVVHLYJM-PWSUYJOCSA-N 1 1 331.338 3.533 20 5 EHBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172235136 1127838330 /nfs/dbraw/zinc/83/83/30/1127838330.db2.gz IXOOHLQXTCJBRD-MRXNPFEDSA-N 1 1 347.462 3.802 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000282220541 1128097940 /nfs/dbraw/zinc/09/79/40/1128097940.db2.gz HYNJQAUBNSDKQW-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000715651301 1128655839 /nfs/dbraw/zinc/65/58/39/1128655839.db2.gz VYZCAAKJODHLGT-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO Cc1nc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000301626268 1128765227 /nfs/dbraw/zinc/76/52/27/1128765227.db2.gz HKRXUJCIUSJDKB-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCc1ccc(Cl)cc1)CC2 ZINC000495456286 1121215605 /nfs/dbraw/zinc/21/56/05/1121215605.db2.gz ZCKCMLLURBHJMR-UHFFFAOYSA-N 1 1 331.803 3.634 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663106 1121561447 /nfs/dbraw/zinc/56/14/47/1121561447.db2.gz PXQLMBNSJXFWRQ-GDBMZVCRSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663106 1121561449 /nfs/dbraw/zinc/56/14/49/1121561449.db2.gz PXQLMBNSJXFWRQ-GDBMZVCRSA-N 1 1 347.459 3.661 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000322473396 1121652238 /nfs/dbraw/zinc/65/22/38/1121652238.db2.gz PFBGZDFNODWRKA-MJEQTWJJSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@H](O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536205 1121683571 /nfs/dbraw/zinc/68/35/71/1121683571.db2.gz OCUXWHABLIVFPY-QWHCGFSZSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccncc2)cs1 ZINC000076895667 1121970562 /nfs/dbraw/zinc/97/05/62/1121970562.db2.gz AFAFCTVAAPEFID-LBPRGKRZSA-N 1 1 340.408 3.964 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301180698 1122311676 /nfs/dbraw/zinc/31/16/76/1122311676.db2.gz HTEBAJOGVIRPLL-QGZVFWFLSA-N 1 1 325.412 3.571 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCC[C@H]1O ZINC000497157475 1122354616 /nfs/dbraw/zinc/35/46/16/1122354616.db2.gz AFRLKOUSTVCDGC-CRAIPNDOSA-N 1 1 344.411 3.838 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007613999 1122411278 /nfs/dbraw/zinc/41/12/78/1122411278.db2.gz HIMGCWOFBIBWTC-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007613999 1122411281 /nfs/dbraw/zinc/41/12/81/1122411281.db2.gz HIMGCWOFBIBWTC-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000154310980 1122552467 /nfs/dbraw/zinc/55/24/67/1122552467.db2.gz BLSAAPSXYBFRKY-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000174870734 1122912133 /nfs/dbraw/zinc/91/21/33/1122912133.db2.gz SMEHTIKVQHHKRC-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000498891882 1123103561 /nfs/dbraw/zinc/10/35/61/1123103561.db2.gz GIYQJGCMSPHVQH-UHFFFAOYSA-N 1 1 342.395 3.591 20 5 EHBDMO C[C@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136470 1123167404 /nfs/dbraw/zinc/16/74/04/1123167404.db2.gz IWCAWLSRKOURNS-FUHWJXTLSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136470 1123167407 /nfs/dbraw/zinc/16/74/07/1123167407.db2.gz IWCAWLSRKOURNS-FUHWJXTLSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136470 1123167408 /nfs/dbraw/zinc/16/74/08/1123167408.db2.gz IWCAWLSRKOURNS-FUHWJXTLSA-N 1 1 339.439 3.768 20 5 EHBDMO CCCCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000734829046 1131282760 /nfs/dbraw/zinc/28/27/60/1131282760.db2.gz GNNVVGNJEXHRQI-UHFFFAOYSA-N 1 1 331.420 3.711 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)nc1 ZINC000619785171 1125404059 /nfs/dbraw/zinc/40/40/59/1125404059.db2.gz DDJRQIPRPHIRHQ-UHFFFAOYSA-N 1 1 348.406 3.726 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891198 1129286268 /nfs/dbraw/zinc/28/62/68/1129286268.db2.gz UNHCMNHRBYCPRR-YOEHRIQHSA-N 1 1 346.818 3.809 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@@H]21 ZINC000301901924 1129311805 /nfs/dbraw/zinc/31/18/05/1129311805.db2.gz NUTKGGYHIPRQAZ-ZBFHGGJFSA-N 1 1 347.459 3.693 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccccc1 ZINC000067961104 1129326632 /nfs/dbraw/zinc/32/66/32/1129326632.db2.gz GARMWXDKGGPYHJ-HNNXBMFYSA-N 1 1 341.411 3.925 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453581 1129360913 /nfs/dbraw/zinc/36/09/13/1129360913.db2.gz HQKURWMNINJHKO-CMPLNLGQSA-N 1 1 342.342 3.579 20 5 EHBDMO CCOc1cc(Nc2ccc3c(c2)[nH+]c(C)n3C)ccc1[N+](=O)[O-] ZINC000301944255 1129400490 /nfs/dbraw/zinc/40/04/90/1129400490.db2.gz AGIKDGLACLDMBF-UHFFFAOYSA-N 1 1 326.356 3.932 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccco1 ZINC000069070382 1129420718 /nfs/dbraw/zinc/42/07/18/1129420718.db2.gz LRCPGGBATQZETI-ZDUSSCGKSA-N 1 1 331.372 3.518 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000069222473 1129432732 /nfs/dbraw/zinc/43/27/32/1129432732.db2.gz RFLVJOUAWGVTRZ-GFCCVEGCSA-N 1 1 347.802 3.846 20 5 EHBDMO C[NH+](C)CC1(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCC1 ZINC000466422579 1129437565 /nfs/dbraw/zinc/43/75/65/1129437565.db2.gz ULHBRQUJCZVIDQ-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO C[C@H]1c2ccccc2CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000170954610 1129449017 /nfs/dbraw/zinc/44/90/17/1129449017.db2.gz XEMIJZWTBFUMDX-ZDUSSCGKSA-N 1 1 340.379 3.581 20 5 EHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000170954610 1129449020 /nfs/dbraw/zinc/44/90/20/1129449020.db2.gz XEMIJZWTBFUMDX-ZDUSSCGKSA-N 1 1 340.379 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@H]4C3)s2)cc1 ZINC000543413224 1129473447 /nfs/dbraw/zinc/47/34/47/1129473447.db2.gz ZUKMGJDZOAPXOS-JQFCIGGWSA-N 1 1 344.436 3.526 20 5 EHBDMO Cc1nc(Nc2cccc(CC[N@H+](C)C3CC3)c2)ccc1[N+](=O)[O-] ZINC000301985586 1129486041 /nfs/dbraw/zinc/48/60/41/1129486041.db2.gz JRDGUJYOPBXIDW-UHFFFAOYSA-N 1 1 326.400 3.679 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802845 1129590664 /nfs/dbraw/zinc/59/06/64/1129590664.db2.gz YFWXURGDCNIZEK-BLLLJJGKSA-N 1 1 346.818 3.576 20 5 EHBDMO CC1(C)[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]21 ZINC000093660985 1129598509 /nfs/dbraw/zinc/59/85/09/1129598509.db2.gz NSIMYTNHEAEOTA-GASCZTMLSA-N 1 1 329.425 3.806 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)c1 ZINC000302385649 1129776834 /nfs/dbraw/zinc/77/68/34/1129776834.db2.gz ARXDAUVTOOVNMC-UHFFFAOYSA-N 1 1 340.427 3.627 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000543559403 1129973425 /nfs/dbraw/zinc/97/34/25/1129973425.db2.gz SDIRMULNCVVHAI-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000246201014 1130356033 /nfs/dbraw/zinc/35/60/33/1130356033.db2.gz WALCDVDUTBFCFG-IVMMDQJWSA-N 1 1 342.399 3.798 20 5 EHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000175217149 1130413669 /nfs/dbraw/zinc/41/36/69/1130413669.db2.gz KSCUSPMUNBALIF-QGZVFWFLSA-N 1 1 336.432 3.775 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893302 1130854410 /nfs/dbraw/zinc/85/44/10/1130854410.db2.gz OYQRGHFUBZRXCT-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893302 1130854413 /nfs/dbraw/zinc/85/44/13/1130854413.db2.gz OYQRGHFUBZRXCT-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@H](c4ccco4)C3)c2c1 ZINC000732181696 1130893133 /nfs/dbraw/zinc/89/31/33/1130893133.db2.gz KHVSROJTCZKERQ-LLVKDONJSA-N 1 1 345.380 3.912 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H](c4ccco4)C3)c2c1 ZINC000732181696 1130893139 /nfs/dbraw/zinc/89/31/39/1130893139.db2.gz KHVSROJTCZKERQ-LLVKDONJSA-N 1 1 345.380 3.912 20 5 EHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150029 1131693294 /nfs/dbraw/zinc/69/32/94/1131693294.db2.gz TYFOILBQSHBOSC-GDBMZVCRSA-N 1 1 343.431 3.711 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H]3CCC[C@@H]3C2)c1F ZINC001173178277 1131992797 /nfs/dbraw/zinc/99/27/97/1131992797.db2.gz ACFXDYLKKMQTEN-MELADBBJSA-N 1 1 336.407 3.796 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2cccnc2C)c1F ZINC001173191214 1131995138 /nfs/dbraw/zinc/99/51/38/1131995138.db2.gz BBSXRBZUACGLJF-GFCCVEGCSA-N 1 1 347.390 3.509 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CCCCC2(F)F)c1F ZINC001173193741 1131995327 /nfs/dbraw/zinc/99/53/27/1131995327.db2.gz WPWCOTQDTDNDKJ-HZMBPMFUSA-N 1 1 346.349 3.841 20 5 EHBDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196591 1131996996 /nfs/dbraw/zinc/99/69/96/1131996996.db2.gz NXYQHKPFNQDJGI-ZDUSSCGKSA-N 1 1 347.390 3.591 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001173225508 1132007263 /nfs/dbraw/zinc/00/72/63/1132007263.db2.gz CTAUERXGTCDXFH-WMLDXEAASA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C(=O)OC(C)(C)C ZINC001173225508 1132007269 /nfs/dbraw/zinc/00/72/69/1132007269.db2.gz CTAUERXGTCDXFH-WMLDXEAASA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001173228540 1132007706 /nfs/dbraw/zinc/00/77/06/1132007706.db2.gz XMSPKYVQYRCTLA-DNVCBOLYSA-N 1 1 325.412 3.628 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ncc(Cl)cc2C1 ZINC001173229920 1132008376 /nfs/dbraw/zinc/00/83/76/1132008376.db2.gz BURQXRVNYVUIEF-GFCCVEGCSA-N 1 1 331.803 3.633 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232825 1132010337 /nfs/dbraw/zinc/01/03/37/1132010337.db2.gz IEGDTODFCYJTRE-OAHLLOKOSA-N 1 1 328.412 3.709 20 5 EHBDMO Cc1csc(C[C@H]2CCC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)n1 ZINC001176218350 1132877960 /nfs/dbraw/zinc/87/79/60/1132877960.db2.gz PLICJFFFZYCHNO-CYBMUJFWSA-N 1 1 349.431 3.954 20 5 EHBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001169942269 1132903756 /nfs/dbraw/zinc/90/37/56/1132903756.db2.gz LDLTYHWENUFTNG-LBPRGKRZSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CC1 ZINC000768673148 1133169506 /nfs/dbraw/zinc/16/95/06/1133169506.db2.gz IOLVRKDEQZUKIX-UHFFFAOYSA-N 1 1 327.222 3.978 20 5 EHBDMO CC(C)[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CC1 ZINC000768673148 1133169510 /nfs/dbraw/zinc/16/95/10/1133169510.db2.gz IOLVRKDEQZUKIX-UHFFFAOYSA-N 1 1 327.222 3.978 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC001180533059 1133383763 /nfs/dbraw/zinc/38/37/63/1133383763.db2.gz XMDZQFUKVNUCJO-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCCC2(CC2)C1 ZINC000770673837 1133457541 /nfs/dbraw/zinc/45/75/41/1133457541.db2.gz JRZZHHIDDWKCEG-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCCC2(CC2)C1 ZINC000770673837 1133457546 /nfs/dbraw/zinc/45/75/46/1133457546.db2.gz JRZZHHIDDWKCEG-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3ccc4ncccc4c3)nc2c1 ZINC001181435838 1133492417 /nfs/dbraw/zinc/49/24/17/1133492417.db2.gz INQOLKYZXALIHZ-UHFFFAOYSA-N 1 1 334.335 3.574 20 5 EHBDMO C[N@@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636711 1133811817 /nfs/dbraw/zinc/81/18/17/1133811817.db2.gz XJVAFXHWOMPFHC-UHFFFAOYSA-N 1 1 330.775 3.687 20 5 EHBDMO C[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774636711 1133811824 /nfs/dbraw/zinc/81/18/24/1133811824.db2.gz XJVAFXHWOMPFHC-UHFFFAOYSA-N 1 1 330.775 3.687 20 5 EHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998592 1134018241 /nfs/dbraw/zinc/01/82/41/1134018241.db2.gz FIDYFXUKQMUMRD-QLFBSQMISA-N 1 1 342.443 3.921 20 5 EHBDMO Cc1ccccc1C[N@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000746709452 1134040159 /nfs/dbraw/zinc/04/01/59/1134040159.db2.gz QEOHBLBFWLCXJW-UHFFFAOYSA-N 1 1 336.395 3.875 20 5 EHBDMO Cc1ccccc1C[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000746709452 1134040162 /nfs/dbraw/zinc/04/01/62/1134040162.db2.gz QEOHBLBFWLCXJW-UHFFFAOYSA-N 1 1 336.395 3.875 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1F ZINC000788486381 1134131027 /nfs/dbraw/zinc/13/10/27/1134131027.db2.gz UUOAODKQRXVKBR-LJQANCHMSA-N 1 1 344.386 3.507 20 5 EHBDMO CC(C)Oc1nc(NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187064506 1134291812 /nfs/dbraw/zinc/29/18/12/1134291812.db2.gz WTYZBRMIEBYKDW-HNNXBMFYSA-N 1 1 348.447 3.596 20 5 EHBDMO CC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001190741290 1134745244 /nfs/dbraw/zinc/74/52/44/1134745244.db2.gz DLMFIAXNWNRNIW-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170326930 1134748473 /nfs/dbraw/zinc/74/84/73/1134748473.db2.gz CNKVCOIRHNTKGI-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329565 1134749643 /nfs/dbraw/zinc/74/96/43/1134749643.db2.gz RMAHSEWKPYDGIL-YVEFUNNKSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2c2cc(C)on2)c([N+](=O)[O-])c1 ZINC001170329565 1134749650 /nfs/dbraw/zinc/74/96/50/1134749650.db2.gz RMAHSEWKPYDGIL-YVEFUNNKSA-N 1 1 345.399 3.668 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC001190840313 1134757636 /nfs/dbraw/zinc/75/76/36/1134757636.db2.gz ZBQAPZWYIGQPEQ-UHFFFAOYSA-N 1 1 326.396 3.860 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000792873189 1134821794 /nfs/dbraw/zinc/82/17/94/1134821794.db2.gz BDSSBABQUUUGDM-UHFFFAOYSA-N 1 1 347.758 3.935 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000747207767 1135164666 /nfs/dbraw/zinc/16/46/66/1135164666.db2.gz NTSRSLJIJMDENS-CYBMUJFWSA-N 1 1 339.411 3.667 20 5 EHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCOc1ccccc1C ZINC001195324420 1135406189 /nfs/dbraw/zinc/40/61/89/1135406189.db2.gz PHAQLDXQSHHGNH-UHFFFAOYSA-N 1 1 344.411 3.683 20 5 EHBDMO Cc1c(C[N@@H+]2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495920 1135433870 /nfs/dbraw/zinc/43/38/70/1135433870.db2.gz AZTAXIBMQFYEQG-BBRMVZONSA-N 1 1 348.443 3.703 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1CC1CCCC1 ZINC001195639451 1135445877 /nfs/dbraw/zinc/44/58/77/1135445877.db2.gz URHSTALJFIOSQE-INIZCTEOSA-N 1 1 345.443 3.886 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](CC[C@H](O)c2ccccc2)C2CC2)c1 ZINC000808735551 1135732508 /nfs/dbraw/zinc/73/25/08/1135732508.db2.gz RFHYMECUFNMGCC-IBGZPJMESA-N 1 1 326.396 3.683 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000809973119 1135907561 /nfs/dbraw/zinc/90/75/61/1135907561.db2.gz ITOOKFSZXQFMKL-QMTHXVAHSA-N 1 1 347.242 3.885 20 5 EHBDMO CCC[N@@H+](CC)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811484351 1136091923 /nfs/dbraw/zinc/09/19/23/1136091923.db2.gz ZULVEAMBTJNBEL-UHFFFAOYSA-N 1 1 334.247 3.723 20 5 EHBDMO CC(C)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000852077975 1136431975 /nfs/dbraw/zinc/43/19/75/1136431975.db2.gz HWDFKJYCRXYCAW-UHFFFAOYSA-N 1 1 333.319 3.667 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](c3ccccc3)CC2)cc1 ZINC000776582451 1136442604 /nfs/dbraw/zinc/44/26/04/1136442604.db2.gz UQSAUXLICLMWSP-FXAWDEMLSA-N 1 1 340.423 3.898 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587636 1136447866 /nfs/dbraw/zinc/44/78/66/1136447866.db2.gz XPPZBTKYBXIYEC-BBATYDOGSA-N 1 1 348.349 3.526 20 5 EHBDMO C[C@H]1c2cc(F)cc(F)c2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587636 1136447868 /nfs/dbraw/zinc/44/78/68/1136447868.db2.gz XPPZBTKYBXIYEC-BBATYDOGSA-N 1 1 348.349 3.526 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000852724736 1136480574 /nfs/dbraw/zinc/48/05/74/1136480574.db2.gz KZFRYYPUVZLYCS-AWEZNQCLSA-N 1 1 341.367 3.665 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000338956984 1136558873 /nfs/dbraw/zinc/55/88/73/1136558873.db2.gz CJBDZGAHCFXBLN-UHFFFAOYSA-N 1 1 340.383 3.561 20 5 EHBDMO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584069 1136614481 /nfs/dbraw/zinc/61/44/81/1136614481.db2.gz UXJDYJQFGMYEJX-LBPRGKRZSA-N 1 1 338.367 3.683 20 5 EHBDMO CC(C)(CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CC1 ZINC000816092431 1136672174 /nfs/dbraw/zinc/67/21/74/1136672174.db2.gz CYVOGSWRSMFJOW-KRWDZBQOSA-N 1 1 346.427 3.539 20 5 EHBDMO CC(C)(CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CC1 ZINC000816092431 1136672176 /nfs/dbraw/zinc/67/21/76/1136672176.db2.gz CYVOGSWRSMFJOW-KRWDZBQOSA-N 1 1 346.427 3.539 20 5 EHBDMO CC[N@H+](C)Cc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387623 1136989533 /nfs/dbraw/zinc/98/95/33/1136989533.db2.gz QLWRXOXFRHMFRA-OAHLLOKOSA-N 1 1 327.428 3.897 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387623 1136989536 /nfs/dbraw/zinc/98/95/36/1136989536.db2.gz QLWRXOXFRHMFRA-OAHLLOKOSA-N 1 1 327.428 3.897 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC(OCc2ccccc2)C1 ZINC000821343442 1137024059 /nfs/dbraw/zinc/02/40/59/1137024059.db2.gz XADDFTXIZJWSOF-UHFFFAOYSA-N 1 1 326.396 3.774 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccns1 ZINC000860061022 1137042856 /nfs/dbraw/zinc/04/28/56/1137042856.db2.gz FILKMYBMFXCNSG-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823606944 1137106526 /nfs/dbraw/zinc/10/65/26/1137106526.db2.gz XTVZZIRTUBBQCD-BEFAXECRSA-N 1 1 328.412 3.804 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])nc1 ZINC000339029421 1137111125 /nfs/dbraw/zinc/11/11/25/1137111125.db2.gz LDKPVVDMGKQMNK-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359979 1137215271 /nfs/dbraw/zinc/21/52/71/1137215271.db2.gz LXGJXYNJJPNODU-KBXCAEBGSA-N 1 1 346.452 3.741 20 5 EHBDMO C[C@H](CSc1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359981 1137215355 /nfs/dbraw/zinc/21/53/55/1137215355.db2.gz LXGJXYNJJPNODU-KDOFPFPSSA-N 1 1 346.452 3.741 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@]4(CC4(F)F)C3)c2)c1 ZINC000844749790 1137249715 /nfs/dbraw/zinc/24/97/15/1137249715.db2.gz IMFDZIYVVFVEHI-INIZCTEOSA-N 1 1 348.353 3.537 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@]4(CC4(F)F)C3)c2)c1 ZINC000844749790 1137249716 /nfs/dbraw/zinc/24/97/16/1137249716.db2.gz IMFDZIYVVFVEHI-INIZCTEOSA-N 1 1 348.353 3.537 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1cc(Cl)c(F)cc1[N+](=O)[O-] ZINC000845491609 1137294786 /nfs/dbraw/zinc/29/47/86/1137294786.db2.gz DSDSIDVKJVYNPV-UHFFFAOYSA-N 1 1 326.759 3.785 20 5 EHBDMO C[C@@H](NC[C@H](c1cccs1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017571 1137564749 /nfs/dbraw/zinc/56/47/49/1137564749.db2.gz CJEZCOYSCCEICF-BXUZGUMPSA-N 1 1 337.420 3.749 20 5 EHBDMO C[C@H]([NH2+]Cc1ccnc(N2CCCC2)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020210 1137564976 /nfs/dbraw/zinc/56/49/76/1137564976.db2.gz FHWXYNHJCSHMRH-ZDUSSCGKSA-N 1 1 344.390 3.580 20 5 EHBDMO C[C@H]([NH2+]CCOC(F)(F)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872110971 1137571737 /nfs/dbraw/zinc/57/17/37/1137571737.db2.gz VWPZSBDWTORIHD-ZETCQYMHSA-N 1 1 346.227 3.556 20 5 EHBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842444 1137624410 /nfs/dbraw/zinc/62/44/10/1137624410.db2.gz HMSGIULCUUKMML-UXHICEINSA-N 1 1 345.446 3.697 20 5 EHBDMO C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877825431 1137692402 /nfs/dbraw/zinc/69/24/02/1137692402.db2.gz ZYSXONRLJIAMFX-BQUOTFMISA-N 1 1 344.333 3.650 20 5 EHBDMO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877825431 1137692403 /nfs/dbraw/zinc/69/24/03/1137692403.db2.gz ZYSXONRLJIAMFX-BQUOTFMISA-N 1 1 344.333 3.650 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880101781 1137768274 /nfs/dbraw/zinc/76/82/74/1137768274.db2.gz PWPPIANEMCFYQV-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cncs1 ZINC000883294810 1137853310 /nfs/dbraw/zinc/85/33/10/1137853310.db2.gz MALNCIBOYXYDPD-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000883322130 1137854783 /nfs/dbraw/zinc/85/47/83/1137854783.db2.gz VMGKUZJPDYWLJQ-OWLYRPNTSA-N 1 1 340.427 3.586 20 5 EHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000331948606 1137926644 /nfs/dbraw/zinc/92/66/44/1137926644.db2.gz PAGXPESNAQDAPZ-IVJVFBROSA-N 1 1 332.444 3.665 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962515 1138044618 /nfs/dbraw/zinc/04/46/18/1138044618.db2.gz AQECGINYVMOCIP-PXAZEXFGSA-N 1 1 334.803 3.975 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3C)c2C1 ZINC000066514219 1138075473 /nfs/dbraw/zinc/07/54/73/1138075473.db2.gz VZWTVXCJEDPQOH-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3C)c2C1 ZINC000066514219 1138075476 /nfs/dbraw/zinc/07/54/76/1138075476.db2.gz VZWTVXCJEDPQOH-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089910192 1138207472 /nfs/dbraw/zinc/20/74/72/1138207472.db2.gz GZFNVPIVINWNGS-OAHLLOKOSA-N 1 1 333.413 3.577 20 5 EHBDMO Cn1cc(C[N@@H+](C)C(C2CC2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092703956 1138230698 /nfs/dbraw/zinc/23/06/98/1138230698.db2.gz TZFZOSQOOYPWQP-UHFFFAOYSA-N 1 1 340.427 3.616 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000336965387 1138436453 /nfs/dbraw/zinc/43/64/53/1138436453.db2.gz JADPNDIUFXVTTR-QGZVFWFLSA-N 1 1 339.395 3.543 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@]2(CC=CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337211487 1138496412 /nfs/dbraw/zinc/49/64/12/1138496412.db2.gz DORXUPKSUBJCQI-LJQANCHMSA-N 1 1 343.427 3.746 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000135450829 1138752065 /nfs/dbraw/zinc/75/20/65/1138752065.db2.gz ZBABXGVGHUVFGC-HNNXBMFYSA-N 1 1 347.440 3.620 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCCOC1 ZINC000174146224 1139402236 /nfs/dbraw/zinc/40/22/36/1139402236.db2.gz STWSBAGUZAOVGJ-OAHLLOKOSA-N 1 1 337.419 3.805 20 5 EHBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383539 1139487487 /nfs/dbraw/zinc/48/74/87/1139487487.db2.gz BCMNRSQRDHZAMW-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383539 1139487490 /nfs/dbraw/zinc/48/74/90/1139487490.db2.gz BCMNRSQRDHZAMW-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)cc1 ZINC000175850965 1139523303 /nfs/dbraw/zinc/52/33/03/1139523303.db2.gz MMMWFNBRIUKGCB-DLBZAZTESA-N 1 1 346.452 3.787 20 5 EHBDMO COc1cc(C[NH2+]C(C)(C)c2cccc(F)c2)c([N+](=O)[O-])cc1F ZINC000184308609 1140094848 /nfs/dbraw/zinc/09/48/48/1140094848.db2.gz DFYALICMIMWOPV-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC000266525333 1140699123 /nfs/dbraw/zinc/69/91/23/1140699123.db2.gz KBMJQFSNWBOPGW-CYBMUJFWSA-N 1 1 334.416 3.710 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000271045876 1141299448 /nfs/dbraw/zinc/29/94/48/1141299448.db2.gz VDHFSCYRFVGLQG-QGZVFWFLSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000271045876 1141299454 /nfs/dbraw/zinc/29/94/54/1141299454.db2.gz VDHFSCYRFVGLQG-QGZVFWFLSA-N 1 1 327.384 3.726 20 5 EHBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115119 1141501809 /nfs/dbraw/zinc/50/18/09/1141501809.db2.gz YVOZLVAZHHZQKL-UEKVPHQBSA-N 1 1 346.349 3.595 20 5 EHBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115119 1141501810 /nfs/dbraw/zinc/50/18/10/1141501810.db2.gz YVOZLVAZHHZQKL-UEKVPHQBSA-N 1 1 346.349 3.595 20 5 EHBDMO COCC[N@H+](Cc1cccnc1)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348997564 1141619981 /nfs/dbraw/zinc/61/99/81/1141619981.db2.gz BRGNUBBDYRVWOP-UHFFFAOYSA-N 1 1 343.427 3.762 20 5 EHBDMO COCC[N@@H+](Cc1cccnc1)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348997564 1141619983 /nfs/dbraw/zinc/61/99/83/1141619983.db2.gz BRGNUBBDYRVWOP-UHFFFAOYSA-N 1 1 343.427 3.762 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430208123 1014954102 /nfs/dbraw/zinc/95/41/02/1014954102.db2.gz AEZZHMYTRIMAPS-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2c(CC)noc2CC)cc1[N+](=O)[O-] ZINC000154198337 1015182766 /nfs/dbraw/zinc/18/27/66/1015182766.db2.gz GZYZZEHAXIMETF-LBPRGKRZSA-N 1 1 347.415 3.957 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432115 1016240672 /nfs/dbraw/zinc/24/06/72/1016240672.db2.gz RDKJEEDLWGEHKI-QWHCGFSZSA-N 1 1 336.823 3.569 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226898 1016662974 /nfs/dbraw/zinc/66/29/74/1016662974.db2.gz DJIBNAFALYIQGT-YPMHNXCESA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1c([C@@H](C)[NH2+][C@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368980 1032252360 /nfs/dbraw/zinc/25/23/60/1032252360.db2.gz PVQVZKDNOAOGGV-RDTXWAMCSA-N 1 1 345.418 3.996 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000459723744 1032431483 /nfs/dbraw/zinc/43/14/83/1032431483.db2.gz CSOLKMVDINTWPX-UHFFFAOYSA-N 1 1 344.358 3.825 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCc3ccccc3)CC2)cs1 ZINC000054173124 1032521702 /nfs/dbraw/zinc/52/17/02/1032521702.db2.gz ZOCNCSKKJWROKA-UHFFFAOYSA-N 1 1 332.425 3.838 20 5 EHBDMO Cn1cc([C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000537176079 1032548861 /nfs/dbraw/zinc/54/88/61/1032548861.db2.gz PKXHJWOFMBOCMK-OAHLLOKOSA-N 1 1 336.823 3.859 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000597664907 1032598734 /nfs/dbraw/zinc/59/87/34/1032598734.db2.gz AIBVAXOYSOLDKD-HNNXBMFYSA-N 1 1 345.443 3.805 20 5 EHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000610282441 1017623178 /nfs/dbraw/zinc/62/31/78/1017623178.db2.gz VENBGDGEVKYKSG-CYBMUJFWSA-N 1 1 328.397 3.786 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1nccn1-c1ccccc1 ZINC000377406854 1017761133 /nfs/dbraw/zinc/76/11/33/1017761133.db2.gz DOFKCUUXHKZMIQ-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171265 1017807739 /nfs/dbraw/zinc/80/77/39/1017807739.db2.gz SXHCYJDMZDYKIA-LLVKDONJSA-N 1 1 327.340 3.635 20 5 EHBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171265 1017807757 /nfs/dbraw/zinc/80/77/57/1017807757.db2.gz SXHCYJDMZDYKIA-LLVKDONJSA-N 1 1 327.340 3.635 20 5 EHBDMO CC[N@H+](C)[C@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000340668056 1032736669 /nfs/dbraw/zinc/73/66/69/1032736669.db2.gz APDFXYCKWQHLCU-KRWDZBQOSA-N 1 1 327.384 3.535 20 5 EHBDMO CC[N@@H+](C)[C@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000340668056 1032736695 /nfs/dbraw/zinc/73/66/95/1032736695.db2.gz APDFXYCKWQHLCU-KRWDZBQOSA-N 1 1 327.384 3.535 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000468609439 1018139787 /nfs/dbraw/zinc/13/97/87/1018139787.db2.gz HCBSFVIUHULGAF-DMVFFGLYSA-N 1 1 345.487 3.956 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000468609439 1018139792 /nfs/dbraw/zinc/13/97/92/1018139792.db2.gz HCBSFVIUHULGAF-DMVFFGLYSA-N 1 1 345.487 3.956 20 5 EHBDMO CC[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866653 1018543456 /nfs/dbraw/zinc/54/34/56/1018543456.db2.gz DJEJMQDPYMIZCT-RDJZCZTQSA-N 1 1 326.400 3.627 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1[N+](=O)[O-] ZINC000449550999 1032771568 /nfs/dbraw/zinc/77/15/68/1032771568.db2.gz FEIPREZFTDINMT-IXDOHACOSA-N 1 1 332.444 3.701 20 5 EHBDMO Cc1c(CN2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610433479 1019124960 /nfs/dbraw/zinc/12/49/60/1019124960.db2.gz NBGRSVXYGOLOOY-LJQANCHMSA-N 1 1 339.439 3.610 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](OC3CCC3)C2)ccc1[N+](=O)[O-] ZINC000594027220 1032809771 /nfs/dbraw/zinc/80/97/71/1032809771.db2.gz SNRFKHCRDDUIOK-MRXNPFEDSA-N 1 1 334.416 3.527 20 5 EHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000340686668 1019324710 /nfs/dbraw/zinc/32/47/10/1019324710.db2.gz IWHPMXGTRITDAI-LLVKDONJSA-N 1 1 330.331 3.579 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280316299 1020283605 /nfs/dbraw/zinc/28/36/05/1020283605.db2.gz PZEQFBGTNMNZFL-MRXNPFEDSA-N 1 1 344.358 3.587 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610476500 1020414898 /nfs/dbraw/zinc/41/48/98/1020414898.db2.gz WIKVCDAYICLDAS-OIISXLGYSA-N 1 1 336.407 3.759 20 5 EHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000510416142 1020815014 /nfs/dbraw/zinc/81/50/14/1020815014.db2.gz SAJHBANFLOXJDI-CYBMUJFWSA-N 1 1 348.374 3.993 20 5 EHBDMO O=c1[nH]c2ccccc2cc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135226917 1020918634 /nfs/dbraw/zinc/91/86/34/1020918634.db2.gz KSYXWDHXKGSUDZ-UHFFFAOYSA-N 1 1 349.390 3.601 20 5 EHBDMO O=c1[nH]c2ccccc2cc1C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135226917 1020918640 /nfs/dbraw/zinc/91/86/40/1020918640.db2.gz KSYXWDHXKGSUDZ-UHFFFAOYSA-N 1 1 349.390 3.601 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441240834 1022077164 /nfs/dbraw/zinc/07/71/64/1022077164.db2.gz CLZSYKUHLIPYGY-QGZVFWFLSA-N 1 1 342.395 3.819 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000441409821 1022218972 /nfs/dbraw/zinc/21/89/72/1022218972.db2.gz CIGUHBWALBNKGP-INIZCTEOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000441409821 1022218983 /nfs/dbraw/zinc/21/89/83/1022218983.db2.gz CIGUHBWALBNKGP-INIZCTEOSA-N 1 1 334.803 3.804 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCOC(C)(C)C1 ZINC000602671156 1033050609 /nfs/dbraw/zinc/05/06/09/1033050609.db2.gz RDORHKOVWYPUJG-CYBMUJFWSA-N 1 1 333.388 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](C[C@@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582758 1022823264 /nfs/dbraw/zinc/82/32/64/1022823264.db2.gz VSTDMEQYGZDITG-HNNXBMFYSA-N 1 1 345.399 3.660 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](CCO)[C@H]2CCCc3ccccc32)cc1 ZINC000510653278 1022831632 /nfs/dbraw/zinc/83/16/32/1022831632.db2.gz YTVOHVJBMLPYAX-FQEVSTJZSA-N 1 1 340.423 3.509 20 5 EHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000602685393 1033086435 /nfs/dbraw/zinc/08/64/35/1033086435.db2.gz NWZHCOYIIBFXBL-XHDPSFHLSA-N 1 1 346.349 3.861 20 5 EHBDMO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[nH]1 ZINC000894771498 1022866654 /nfs/dbraw/zinc/86/66/54/1022866654.db2.gz KTMZIXVLRLTDEU-JTQLQIEISA-N 1 1 343.412 3.601 20 5 EHBDMO CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000509578247 1023075843 /nfs/dbraw/zinc/07/58/43/1023075843.db2.gz GUNLDIXIRXBCAC-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509578247 1023075852 /nfs/dbraw/zinc/07/58/52/1023075852.db2.gz GUNLDIXIRXBCAC-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000509578247 1023075862 /nfs/dbraw/zinc/07/58/62/1023075862.db2.gz GUNLDIXIRXBCAC-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507233859 1023207815 /nfs/dbraw/zinc/20/78/15/1023207815.db2.gz PPZXYOSDYYOSFS-AUUYWEPGSA-N 1 1 326.396 3.902 20 5 EHBDMO CCCC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507254255 1023210208 /nfs/dbraw/zinc/21/02/08/1023210208.db2.gz UNOBLEGAYDLJGG-UHFFFAOYSA-N 1 1 328.416 3.760 20 5 EHBDMO CCOc1cc(C[NH2+]C2(c3nc(C)cs3)CCC2)ccc1[N+](=O)[O-] ZINC000276850040 1023214939 /nfs/dbraw/zinc/21/49/39/1023214939.db2.gz DLKMBJDSDHWNOR-UHFFFAOYSA-N 1 1 347.440 3.927 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)c(Cl)c1 ZINC000449733930 1033127074 /nfs/dbraw/zinc/12/70/74/1033127074.db2.gz QMRKNTXXVRCHPC-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO Cc1ccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000535825209 1023799504 /nfs/dbraw/zinc/79/95/04/1023799504.db2.gz PIMDEYZPBQMVAU-LJQANCHMSA-N 1 1 340.423 3.737 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@](C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000535840816 1023845582 /nfs/dbraw/zinc/84/55/82/1023845582.db2.gz AINKGDXYBNGWLU-QGZVFWFLSA-N 1 1 334.347 3.797 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@](C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000535840816 1023845584 /nfs/dbraw/zinc/84/55/84/1023845584.db2.gz AINKGDXYBNGWLU-QGZVFWFLSA-N 1 1 334.347 3.797 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214689 1023883155 /nfs/dbraw/zinc/88/31/55/1023883155.db2.gz RDNQYOPNYMKOKK-GFCCVEGCSA-N 1 1 334.807 3.670 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288606 1024011162 /nfs/dbraw/zinc/01/11/62/1024011162.db2.gz YEGPFBVVNKFQJR-OLZOCXBDSA-N 1 1 336.823 3.569 20 5 EHBDMO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000602806483 1033181569 /nfs/dbraw/zinc/18/15/69/1033181569.db2.gz URAYESKHHKCVPB-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1OC ZINC000611252209 1024265772 /nfs/dbraw/zinc/26/57/72/1024265772.db2.gz OLPXBTQRGJNIDE-VURMDHGXSA-N 1 1 342.395 3.757 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220662 1024654487 /nfs/dbraw/zinc/65/44/87/1024654487.db2.gz UNIIWLDRCUUIBZ-KRWDZBQOSA-N 1 1 345.468 3.657 20 5 EHBDMO CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220662 1024654499 /nfs/dbraw/zinc/65/44/99/1024654499.db2.gz UNIIWLDRCUUIBZ-KRWDZBQOSA-N 1 1 345.468 3.657 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614185 1024659404 /nfs/dbraw/zinc/65/94/04/1024659404.db2.gz QORSMNVXIGWMGJ-KBPBESRZSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614185 1024659408 /nfs/dbraw/zinc/65/94/08/1024659408.db2.gz QORSMNVXIGWMGJ-KBPBESRZSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000507915328 1024764353 /nfs/dbraw/zinc/76/43/53/1024764353.db2.gz SOSQWNKAFDUJSB-HNNXBMFYSA-N 1 1 343.402 3.613 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123759 1025034506 /nfs/dbraw/zinc/03/45/06/1025034506.db2.gz OLIVCRXKDJLMBK-IBGZPJMESA-N 1 1 342.395 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Nc3ccccn3)CC2)cc1Cl ZINC000896196079 1025228057 /nfs/dbraw/zinc/22/80/57/1025228057.db2.gz VWPAPOMNSMNFNM-UHFFFAOYSA-N 1 1 346.818 3.720 20 5 EHBDMO CSCCC[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425441975 1025293626 /nfs/dbraw/zinc/29/36/26/1025293626.db2.gz ICFNDLWXQLBFAT-UHFFFAOYSA-N 1 1 333.251 3.542 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195295 1025663050 /nfs/dbraw/zinc/66/30/50/1025663050.db2.gz JQBOFFQFEQVNIO-BBRMVZONSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195295 1025663057 /nfs/dbraw/zinc/66/30/57/1025663057.db2.gz JQBOFFQFEQVNIO-BBRMVZONSA-N 1 1 327.384 3.582 20 5 EHBDMO CC(C)n1ccc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451545187 1026094512 /nfs/dbraw/zinc/09/45/12/1026094512.db2.gz GXWTYSKGFJPHFE-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO CC(C)n1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451545187 1026094531 /nfs/dbraw/zinc/09/45/31/1026094531.db2.gz GXWTYSKGFJPHFE-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO COCCSCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550451 1026103033 /nfs/dbraw/zinc/10/30/33/1026103033.db2.gz RTLUEPSCFZWVPI-INIZCTEOSA-N 1 1 338.473 3.544 20 5 EHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000530627263 1026151624 /nfs/dbraw/zinc/15/16/24/1026151624.db2.gz NATVLFBXZOMGNG-GOSISDBHSA-N 1 1 328.412 3.674 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)C1 ZINC000127629585 1026195582 /nfs/dbraw/zinc/19/55/82/1026195582.db2.gz GHVULNVRYMBPBZ-QWHCGFSZSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000339166170 1026397716 /nfs/dbraw/zinc/39/77/16/1026397716.db2.gz CVKREIBEBXZTMJ-CABCVRRESA-N 1 1 344.333 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000339166170 1026397724 /nfs/dbraw/zinc/39/77/24/1026397724.db2.gz CVKREIBEBXZTMJ-CABCVRRESA-N 1 1 344.333 3.757 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000159192069 1026529055 /nfs/dbraw/zinc/52/90/55/1026529055.db2.gz OYOUQEQAXGMGGS-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630729 1026822302 /nfs/dbraw/zinc/82/23/02/1026822302.db2.gz DNYIMVCWWHBMAJ-TZMCWYRMSA-N 1 1 346.818 3.891 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630726 1026822784 /nfs/dbraw/zinc/82/27/84/1026822784.db2.gz DNYIMVCWWHBMAJ-GXTWGEPZSA-N 1 1 346.818 3.891 20 5 EHBDMO CC(C)([NH2+]Cc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000611450417 1027009596 /nfs/dbraw/zinc/00/95/96/1027009596.db2.gz IXLLDJIGSQTVRO-UHFFFAOYSA-N 1 1 331.441 3.955 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000543907458 1027303334 /nfs/dbraw/zinc/30/33/34/1027303334.db2.gz PVBSDAWFUDAVAI-YXJHDRRASA-N 1 1 345.443 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCCOC4)o2)cc1 ZINC000342836624 1027559364 /nfs/dbraw/zinc/55/93/64/1027559364.db2.gz KMUXOTBUQOGMCK-LJQANCHMSA-N 1 1 342.395 3.857 20 5 EHBDMO CCC[N@@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000533397917 1027766322 /nfs/dbraw/zinc/76/63/22/1027766322.db2.gz DJZKMVFLGKPNPW-SFHVURJKSA-N 1 1 341.411 3.925 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924954779 1027789629 /nfs/dbraw/zinc/78/96/29/1027789629.db2.gz LDIBKSMUTZGSLH-AWEZNQCLSA-N 1 1 343.427 3.516 20 5 EHBDMO CC(C)(CNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000502105963 1027791653 /nfs/dbraw/zinc/79/16/53/1027791653.db2.gz PERLKIBJELDZQM-UHFFFAOYSA-N 1 1 325.412 3.844 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174539 1027911805 /nfs/dbraw/zinc/91/18/05/1027911805.db2.gz FTRCTTWJOZAUOI-SCLBCKFNSA-N 1 1 330.359 3.948 20 5 EHBDMO Cc1c(CN2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512141 1027994411 /nfs/dbraw/zinc/99/44/11/1027994411.db2.gz MNPPQENNCPBYRU-DAYGRLMNSA-N 1 1 331.460 3.740 20 5 EHBDMO N[C@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915002 1028048268 /nfs/dbraw/zinc/04/82/68/1028048268.db2.gz AFEQBXDCYLHTAI-RBUKOAKNSA-N 1 1 325.412 3.652 20 5 EHBDMO NC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCCC1 ZINC000423198791 1028268552 /nfs/dbraw/zinc/26/85/52/1028268552.db2.gz HYZDMLNFPMBAKV-KRWDZBQOSA-N 1 1 331.460 3.557 20 5 EHBDMO CO[C@H](C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000583156219 1029037717 /nfs/dbraw/zinc/03/77/17/1029037717.db2.gz MQFAJBAZTNGMKR-LJQANCHMSA-N 1 1 326.396 3.947 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533288749 1029581679 /nfs/dbraw/zinc/58/16/79/1029581679.db2.gz YOVUDFKPJKPRIR-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccsc2)CC1 ZINC000533814979 1029861637 /nfs/dbraw/zinc/86/16/37/1029861637.db2.gz JLEDWCAFSBXFJB-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO Cc1noc([C@@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529480 1030121075 /nfs/dbraw/zinc/12/10/75/1030121075.db2.gz RLFWDKNBSQVDCM-TZMCWYRMSA-N 1 1 330.388 3.535 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000441250935 1030132925 /nfs/dbraw/zinc/13/29/25/1030132925.db2.gz RMEYKDXNTODCFZ-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603050 1030258159 /nfs/dbraw/zinc/25/81/59/1030258159.db2.gz HYBPHRIOTILXHN-MRXNPFEDSA-N 1 1 341.411 3.767 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327135 1030265883 /nfs/dbraw/zinc/26/58/83/1030265883.db2.gz XWTWASJTLPYNLB-KSSFIOAISA-N 1 1 342.443 3.823 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482383576 1030364420 /nfs/dbraw/zinc/36/44/20/1030364420.db2.gz YRDPTKGZIUOMDB-FQEVSTJZSA-N 1 1 338.407 3.925 20 5 EHBDMO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000482526120 1030504527 /nfs/dbraw/zinc/50/45/27/1030504527.db2.gz SOLNBPVTEBNEGO-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000482526120 1030504538 /nfs/dbraw/zinc/50/45/38/1030504538.db2.gz SOLNBPVTEBNEGO-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+](C)C1CCCCC1 ZINC000537640858 1030629067 /nfs/dbraw/zinc/62/90/67/1030629067.db2.gz CRLUCTRRBHUVEC-UHFFFAOYSA-N 1 1 347.459 3.514 20 5 EHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000483631317 1031254729 /nfs/dbraw/zinc/25/47/29/1031254729.db2.gz BFBFSIUMDKPDEM-OAHLLOKOSA-N 1 1 344.411 3.632 20 5 EHBDMO CC(C)Oc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000278610419 1031632567 /nfs/dbraw/zinc/63/25/67/1031632567.db2.gz GKIAQMCENQRBRE-UHFFFAOYSA-N 1 1 340.383 3.548 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ccsc1)Nc1ccccc1[N+](=O)[O-] ZINC000052803844 1031702132 /nfs/dbraw/zinc/70/21/32/1031702132.db2.gz RQYSBNHQSMCTJP-OAHLLOKOSA-N 1 1 345.424 3.822 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000052907273 1032002825 /nfs/dbraw/zinc/00/28/25/1032002825.db2.gz QFEPPDVWWDJFQY-CQSZACIVSA-N 1 1 327.384 3.535 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000052907273 1032002844 /nfs/dbraw/zinc/00/28/44/1032002844.db2.gz QFEPPDVWWDJFQY-CQSZACIVSA-N 1 1 327.384 3.535 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCCCC1 ZINC000063493763 1033403956 /nfs/dbraw/zinc/40/39/56/1033403956.db2.gz NEUJWXHSZSUJDY-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000063522466 1033434683 /nfs/dbraw/zinc/43/46/83/1033434683.db2.gz NLOZAYZYEKXBTG-UHFFFAOYSA-N 1 1 345.443 3.885 20 5 EHBDMO COc1cc(F)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000593611067 1033441667 /nfs/dbraw/zinc/44/16/67/1033441667.db2.gz IVEWCZPVOFOIAW-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](c1ccccc1)[NH+](C)C ZINC000595003262 1033629150 /nfs/dbraw/zinc/62/91/50/1033629150.db2.gz FKWJXWFHEUCCAW-KSSFIOAISA-N 1 1 343.427 3.557 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@H]2C[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599092349 1033731592 /nfs/dbraw/zinc/73/15/92/1033731592.db2.gz LMWYVKVZKWHJLK-OWQGQXMQSA-N 1 1 330.384 3.607 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000595340932 1033731906 /nfs/dbraw/zinc/73/19/06/1033731906.db2.gz ZFYGJECLAFRVSL-SFHVURJKSA-N 1 1 344.386 3.568 20 5 EHBDMO COC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000595480085 1033825344 /nfs/dbraw/zinc/82/53/44/1033825344.db2.gz IHKZQFNIQAJWEG-OAHLLOKOSA-N 1 1 338.766 3.865 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000603838144 1033950797 /nfs/dbraw/zinc/95/07/97/1033950797.db2.gz ZFZCMONEJZAMIM-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO Cc1cc(NCCC[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000603848701 1033971887 /nfs/dbraw/zinc/97/18/87/1033971887.db2.gz FRUWMPFQRUMQAE-UHFFFAOYSA-N 1 1 325.412 3.764 20 5 EHBDMO CCOc1ccccc1C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603856703 1033981508 /nfs/dbraw/zinc/98/15/08/1033981508.db2.gz TURKZFHUEGGBBM-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000603859556 1033986054 /nfs/dbraw/zinc/98/60/54/1033986054.db2.gz JEOOPXBUOBXJLQ-HNNXBMFYSA-N 1 1 342.443 3.631 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1 ZINC000595788257 1033998872 /nfs/dbraw/zinc/99/88/72/1033998872.db2.gz HOEYLHIGZDOHEK-LPHOPBHVSA-N 1 1 348.443 3.645 20 5 EHBDMO CC[C@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C(C)C ZINC000595849668 1034007850 /nfs/dbraw/zinc/00/78/50/1034007850.db2.gz CLLCSKGGWFQMLY-GOSISDBHSA-N 1 1 343.427 3.618 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000595866558 1034032999 /nfs/dbraw/zinc/03/29/99/1034032999.db2.gz JCYUZQVLERDWTO-UONOGXRCSA-N 1 1 349.431 3.585 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097530 1034061677 /nfs/dbraw/zinc/06/16/77/1034061677.db2.gz YSLCWDCUIXHZLA-RDJZCZTQSA-N 1 1 331.460 3.676 20 5 EHBDMO C[N@H+](Cc1c[nH]nc1-c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315977 1034108565 /nfs/dbraw/zinc/10/85/65/1034108565.db2.gz KDUGTRHSSIWCLY-UHFFFAOYSA-N 1 1 340.358 3.756 20 5 EHBDMO C[N@@H+](Cc1c[nH]nc1-c1ccc(F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315977 1034108572 /nfs/dbraw/zinc/10/85/72/1034108572.db2.gz KDUGTRHSSIWCLY-UHFFFAOYSA-N 1 1 340.358 3.756 20 5 EHBDMO Cc1ccc(C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000604013535 1034138516 /nfs/dbraw/zinc/13/85/16/1034138516.db2.gz OFVBDQVLJBJMKD-UHFFFAOYSA-N 1 1 330.384 3.930 20 5 EHBDMO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000604016298 1034142346 /nfs/dbraw/zinc/14/23/46/1034142346.db2.gz MWUYCXXCPORTOY-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000604016298 1034142357 /nfs/dbraw/zinc/14/23/57/1034142357.db2.gz MWUYCXXCPORTOY-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000596308345 1034165708 /nfs/dbraw/zinc/16/57/08/1034165708.db2.gz RDUWAESAKUDEEU-LLVKDONJSA-N 1 1 343.374 3.729 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571727 1034293695 /nfs/dbraw/zinc/29/36/95/1034293695.db2.gz ZEUVPSOXNXQMDG-HNNXBMFYSA-N 1 1 345.443 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)c(F)c1 ZINC000612174290 1034378516 /nfs/dbraw/zinc/37/85/16/1034378516.db2.gz DCJGAVSHHSJBHM-INIZCTEOSA-N 1 1 334.322 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)c(F)c1 ZINC000612174290 1034378530 /nfs/dbraw/zinc/37/85/30/1034378530.db2.gz DCJGAVSHHSJBHM-INIZCTEOSA-N 1 1 334.322 3.526 20 5 EHBDMO CC[N@@H+](CCCNC(=O)c1cc(C)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000593249765 1034479250 /nfs/dbraw/zinc/47/92/50/1034479250.db2.gz KZPIDYBXVGEMFV-UHFFFAOYSA-N 1 1 347.459 3.678 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000597247773 1034640843 /nfs/dbraw/zinc/64/08/43/1034640843.db2.gz CBFNWRAAJGSJRZ-MMHDITDQSA-N 1 1 328.412 3.501 20 5 EHBDMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948227 1034731940 /nfs/dbraw/zinc/73/19/40/1034731940.db2.gz UADYPSSSQNFBNO-MNOVXSKESA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451977994 1034821727 /nfs/dbraw/zinc/82/17/27/1034821727.db2.gz NZLALFPAGJGDMW-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO CC(C)C[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000467181739 1035485974 /nfs/dbraw/zinc/48/59/74/1035485974.db2.gz PTGUTZNAVJMZCD-GFCCVEGCSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000467181739 1035485977 /nfs/dbraw/zinc/48/59/77/1035485977.db2.gz PTGUTZNAVJMZCD-GFCCVEGCSA-N 1 1 339.823 3.555 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c(C)c1OC ZINC000588216072 1035824993 /nfs/dbraw/zinc/82/49/93/1035824993.db2.gz HJZJXQWQXYTIIR-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047257 1035957026 /nfs/dbraw/zinc/95/70/26/1035957026.db2.gz YTZPWSOFVASMBX-RISCZKNCSA-N 1 1 333.354 3.518 20 5 EHBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000589199780 1036306187 /nfs/dbraw/zinc/30/61/87/1036306187.db2.gz IGWXIPJHTDIPTB-IBGZPJMESA-N 1 1 344.411 3.982 20 5 EHBDMO CCCC[C@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000589310157 1036353794 /nfs/dbraw/zinc/35/37/94/1036353794.db2.gz ZDZOOFJMMWZDCK-NSHDSACASA-N 1 1 327.812 3.697 20 5 EHBDMO CC(C)c1ncc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000443065136 1036874765 /nfs/dbraw/zinc/87/47/65/1036874765.db2.gz HGKRHGQXJLSIQK-VURMDHGXSA-N 1 1 326.400 3.653 20 5 EHBDMO CC(C)c1ncc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000443065136 1036874785 /nfs/dbraw/zinc/87/47/85/1036874785.db2.gz HGKRHGQXJLSIQK-VURMDHGXSA-N 1 1 326.400 3.653 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651834 1036941786 /nfs/dbraw/zinc/94/17/86/1036941786.db2.gz JXVZIURJJKLCLL-GUTXKFCHSA-N 1 1 333.432 3.598 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3[nH]nc4ccccc43)C2)cc1 ZINC000590659589 1036995667 /nfs/dbraw/zinc/99/56/67/1036995667.db2.gz QWZVOJQKOKWIPB-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659589 1036995680 /nfs/dbraw/zinc/99/56/80/1036995680.db2.gz QWZVOJQKOKWIPB-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659589 1036995694 /nfs/dbraw/zinc/99/56/94/1036995694.db2.gz QWZVOJQKOKWIPB-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO CCn1c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)nc2ccccc21 ZINC000761535543 1037118050 /nfs/dbraw/zinc/11/80/50/1037118050.db2.gz WQJQSWBLWAJXIX-UHFFFAOYSA-N 1 1 344.802 3.908 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccs1 ZINC000532473151 1037422372 /nfs/dbraw/zinc/42/23/72/1037422372.db2.gz GKNVDPNPUBLUHX-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO Cc1ccc2nc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cn2c1 ZINC000532491075 1037536117 /nfs/dbraw/zinc/53/61/17/1037536117.db2.gz LZRAZCGRLZYXEN-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO Cc1ccc2nc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cn2c1 ZINC000532491075 1037536126 /nfs/dbraw/zinc/53/61/26/1037536126.db2.gz LZRAZCGRLZYXEN-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000058274914 1037710669 /nfs/dbraw/zinc/71/06/69/1037710669.db2.gz RHIMLUBFULEGKN-MRXNPFEDSA-N 1 1 347.462 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000046065117 1037740796 /nfs/dbraw/zinc/74/07/96/1037740796.db2.gz FWEAYETZIVPBJB-UHFFFAOYSA-N 1 1 331.460 3.683 20 5 EHBDMO CCC[C@H](O)C[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000542474377 1037848929 /nfs/dbraw/zinc/84/89/29/1037848929.db2.gz FFLYAIBJMHXYQH-YJBOKZPZSA-N 1 1 332.400 3.590 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000463198566 1037863410 /nfs/dbraw/zinc/86/34/10/1037863410.db2.gz NKMMWJVLBOQQFG-JFIYKMOQSA-N 1 1 348.443 3.509 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC2 ZINC000378265885 1038345370 /nfs/dbraw/zinc/34/53/70/1038345370.db2.gz PMOYFIDRIOOMOU-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC2 ZINC000378265885 1038345384 /nfs/dbraw/zinc/34/53/84/1038345384.db2.gz PMOYFIDRIOOMOU-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000541326122 1038475227 /nfs/dbraw/zinc/47/52/27/1038475227.db2.gz UNFIPJRQLZXUNK-ZDUSSCGKSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000541392884 1038602571 /nfs/dbraw/zinc/60/25/71/1038602571.db2.gz MECIXZPWURARCD-CQSZACIVSA-N 1 1 333.432 3.600 20 5 EHBDMO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000539376789 1038867343 /nfs/dbraw/zinc/86/73/43/1038867343.db2.gz KJOHZKHXLZVPRC-KGLIPLIRSA-N 1 1 341.411 3.835 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000552293346 1039163764 /nfs/dbraw/zinc/16/37/64/1039163764.db2.gz YZTYMNPUWAZWHW-PRDNPTHXSA-N 1 1 340.423 3.534 20 5 EHBDMO CCC[N@@H+]1CC[C@H](CN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309055 1039662433 /nfs/dbraw/zinc/66/24/33/1039662433.db2.gz DFKABBOVOIVWRR-BEFAXECRSA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@H+]1CC[C@H](CN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309055 1039662447 /nfs/dbraw/zinc/66/24/47/1039662447.db2.gz DFKABBOVOIVWRR-BEFAXECRSA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@@H+]1CC[C@@H](CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309057 1039664327 /nfs/dbraw/zinc/66/43/27/1039664327.db2.gz DFKABBOVOIVWRR-HNAYVOBHSA-N 1 1 331.460 3.684 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309057 1039664335 /nfs/dbraw/zinc/66/43/35/1039664335.db2.gz DFKABBOVOIVWRR-HNAYVOBHSA-N 1 1 331.460 3.684 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000554945286 1039969522 /nfs/dbraw/zinc/96/95/22/1039969522.db2.gz GQADKLUSSFVRDP-RDJZCZTQSA-N 1 1 337.423 3.793 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000027284904 1040158767 /nfs/dbraw/zinc/15/87/67/1040158767.db2.gz BJAQROLQRRHMJQ-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO CCOc1cc(C[N@H+](Cc2cnn(CC)c2)C(C)C)ccc1[N+](=O)[O-] ZINC000593083250 1040177877 /nfs/dbraw/zinc/17/78/77/1040177877.db2.gz ZYMDHDAYXXXBMR-UHFFFAOYSA-N 1 1 346.431 3.621 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2cnn(CC)c2)C(C)C)ccc1[N+](=O)[O-] ZINC000593083250 1040177889 /nfs/dbraw/zinc/17/78/89/1040177889.db2.gz ZYMDHDAYXXXBMR-UHFFFAOYSA-N 1 1 346.431 3.621 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787132 1040443621 /nfs/dbraw/zinc/44/36/21/1040443621.db2.gz HEDIZDDHMCMDDG-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371473 1040790749 /nfs/dbraw/zinc/79/07/49/1040790749.db2.gz MXYURLXIVJSOIU-JQWIXIFHSA-N 1 1 344.358 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC=C(c3ccco3)C2)cc1 ZINC000586773630 1040991162 /nfs/dbraw/zinc/99/11/62/1040991162.db2.gz QBERYICQPGTXAS-UHFFFAOYSA-N 1 1 328.368 3.746 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)cs1 ZINC000555685349 1041009426 /nfs/dbraw/zinc/00/94/26/1041009426.db2.gz HZIQNBJOHXNJQP-CQSZACIVSA-N 1 1 338.816 3.963 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)cs1 ZINC000555685349 1041009440 /nfs/dbraw/zinc/00/94/40/1041009440.db2.gz HZIQNBJOHXNJQP-CQSZACIVSA-N 1 1 338.816 3.963 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC000511830622 1041671688 /nfs/dbraw/zinc/67/16/88/1041671688.db2.gz RCNZGEBNULTBFM-ZIAGYGMSSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC000511830622 1041671696 /nfs/dbraw/zinc/67/16/96/1041671696.db2.gz RCNZGEBNULTBFM-ZIAGYGMSSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765589 1043029423 /nfs/dbraw/zinc/02/94/23/1043029423.db2.gz XKIDBMLUNRPZKI-CQSZACIVSA-N 1 1 338.411 3.625 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@@H](CCO)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279223029 1043598835 /nfs/dbraw/zinc/59/88/35/1043598835.db2.gz ZEPJFHIEHOPZCD-HOTGVXAUSA-N 1 1 330.384 3.624 20 5 EHBDMO COc1cc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301410308 1127742607 /nfs/dbraw/zinc/74/26/07/1127742607.db2.gz XQFPFCBJHWJXEK-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478249 1131242392 /nfs/dbraw/zinc/24/23/92/1131242392.db2.gz XXRKYODHZIPQDE-WMLDXEAASA-N 1 1 336.395 3.780 20 5 EHBDMO COCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccco1 ZINC000273305471 1128483665 /nfs/dbraw/zinc/48/36/65/1128483665.db2.gz SLKHNMQHCYOENJ-MRXNPFEDSA-N 1 1 348.399 3.842 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506895 1128484229 /nfs/dbraw/zinc/48/42/29/1128484229.db2.gz CYWKYZJRUCPULH-BEFAXECRSA-N 1 1 325.412 3.917 20 5 EHBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301583524 1128500265 /nfs/dbraw/zinc/50/02/65/1128500265.db2.gz QNSBBYKFJHQLFD-OLZOCXBDSA-N 1 1 343.349 3.677 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000542702724 1128549517 /nfs/dbraw/zinc/54/95/17/1128549517.db2.gz RJVJZXPPFLWGSD-FQEVSTJZSA-N 1 1 340.423 3.775 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cccnc1 ZINC000162128389 1120197877 /nfs/dbraw/zinc/19/78/77/1120197877.db2.gz HBQSQAGJXSWOJJ-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccn(C)n1 ZINC000494467667 1120565058 /nfs/dbraw/zinc/56/50/58/1120565058.db2.gz RLEXQDOLQMYYLK-CYBMUJFWSA-N 1 1 342.321 3.588 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000915211820 1121248766 /nfs/dbraw/zinc/24/87/66/1121248766.db2.gz HDKUWOIXRTULBS-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO COC1(C)CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000272353784 1121557706 /nfs/dbraw/zinc/55/77/06/1121557706.db2.gz LHCYIBMBGBLNLZ-UHFFFAOYSA-N 1 1 347.440 3.719 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301106794 1121921882 /nfs/dbraw/zinc/92/18/82/1121921882.db2.gz QOTAYMILIYXEMD-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(C2CCOCC2)CC1 ZINC000153780653 1121983131 /nfs/dbraw/zinc/98/31/31/1121983131.db2.gz VLKFNZHZSDFACT-UHFFFAOYSA-N 1 1 338.835 3.887 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1CCOC1 ZINC000132015974 1129032167 /nfs/dbraw/zinc/03/21/67/1129032167.db2.gz VUSPUBYAVLKADS-GFCCVEGCSA-N 1 1 336.775 3.729 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000311667873 1129033626 /nfs/dbraw/zinc/03/36/26/1129033626.db2.gz XXRDLFGDAXRQLS-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO COCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000127154306 1122466193 /nfs/dbraw/zinc/46/61/93/1122466193.db2.gz KVFHTOMBNOWCLE-UHFFFAOYSA-N 1 1 334.347 3.604 20 5 EHBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000917481007 1122614049 /nfs/dbraw/zinc/61/40/49/1122614049.db2.gz WLPYGSVJCCMEEX-HNNXBMFYSA-N 1 1 345.399 3.505 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301784060 1129075032 /nfs/dbraw/zinc/07/50/32/1129075032.db2.gz OEOZOOLUUZUVOF-HNNXBMFYSA-N 1 1 342.443 3.923 20 5 EHBDMO 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ZINC000067386572 1129269260 /nfs/dbraw/zinc/26/92/60/1129269260.db2.gz IRUXVIHYGAFQCB-UHFFFAOYSA-N 1 1 343.408 3.715 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2s1 ZINC000067386572 1129269263 /nfs/dbraw/zinc/26/92/63/1129269263.db2.gz IRUXVIHYGAFQCB-UHFFFAOYSA-N 1 1 343.408 3.715 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)c(F)c1 ZINC000301915216 1129347013 /nfs/dbraw/zinc/34/70/13/1129347013.db2.gz VGUKRBFFWXTONX-DOTOQJQBSA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)c(F)c1 ZINC000301915216 1129347016 /nfs/dbraw/zinc/34/70/16/1129347016.db2.gz VGUKRBFFWXTONX-DOTOQJQBSA-N 1 1 333.338 3.730 20 5 EHBDMO CCOc1cc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971348 1129465479 /nfs/dbraw/zinc/46/54/79/1129465479.db2.gz GFQJSYWUWVDUKL-LPHOPBHVSA-N 1 1 341.411 3.851 20 5 EHBDMO Cc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000301984760 1129484197 /nfs/dbraw/zinc/48/41/97/1129484197.db2.gz CESWSVCZGTUIDE-CYBMUJFWSA-N 1 1 337.383 3.559 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000301996913 1129505936 /nfs/dbraw/zinc/50/59/36/1129505936.db2.gz HWJWMIYDVZQDFV-HNNXBMFYSA-N 1 1 331.441 3.615 20 5 EHBDMO Cc1ccc2ncc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)n2c1 ZINC000154300859 1129548529 /nfs/dbraw/zinc/54/85/29/1129548529.db2.gz NVFDWQUBOBSSBL-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1ccc2ncc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)n2c1 ZINC000154300859 1129548532 /nfs/dbraw/zinc/54/85/32/1129548532.db2.gz NVFDWQUBOBSSBL-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000092586112 1129552750 /nfs/dbraw/zinc/55/27/50/1129552750.db2.gz FUCPPIXUMHSNHS-CQSZACIVSA-N 1 1 328.416 3.617 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1cnccn1 ZINC000092590918 1129552916 /nfs/dbraw/zinc/55/29/16/1129552916.db2.gz CGBRJSZYFDLXAN-UHFFFAOYSA-N 1 1 340.408 3.745 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1cnccn1 ZINC000092590918 1129552920 /nfs/dbraw/zinc/55/29/20/1129552920.db2.gz CGBRJSZYFDLXAN-UHFFFAOYSA-N 1 1 340.408 3.745 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000154462576 1129560810 /nfs/dbraw/zinc/56/08/10/1129560810.db2.gz VCXAIWZCGCRJFX-KRWDZBQOSA-N 1 1 330.384 3.590 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1OC ZINC000922542732 1129568758 /nfs/dbraw/zinc/56/87/58/1129568758.db2.gz XSTLKCYULJRBJK-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCOCC1 ZINC000123964775 1129569249 /nfs/dbraw/zinc/56/92/49/1129569249.db2.gz OPGXCMDROVQMAQ-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000125434282 1129691544 /nfs/dbraw/zinc/69/15/44/1129691544.db2.gz FOXKSGOKCFWXCY-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000303584879 1129857425 /nfs/dbraw/zinc/85/74/25/1129857425.db2.gz FVMHXMNALOUFJY-OAHLLOKOSA-N 1 1 333.432 3.682 20 5 EHBDMO C[N@H+]1CCC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987161 1130335965 /nfs/dbraw/zinc/33/59/65/1130335965.db2.gz QFCLJLXJDVBIHZ-OXQOHEQNSA-N 1 1 339.439 3.616 20 5 EHBDMO Cc1ncccc1C[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913892 1131903099 /nfs/dbraw/zinc/90/30/99/1131903099.db2.gz VMPGMBLUKUNKHB-GOSISDBHSA-N 1 1 325.412 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCC[C@H](F)C(F)(F)C1)CC2 ZINC001172909605 1131916299 /nfs/dbraw/zinc/91/62/99/1131916299.db2.gz UBEKSAFZRUCDPM-HOCLYGCPSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H](F)C(F)(F)C1)CC2 ZINC001172909605 1131916303 /nfs/dbraw/zinc/91/63/03/1131916303.db2.gz UBEKSAFZRUCDPM-HOCLYGCPSA-N 1 1 342.361 3.911 20 5 EHBDMO CO[C@@H]1CCC[C@@H]2C[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910546 1131916386 /nfs/dbraw/zinc/91/63/86/1131916386.db2.gz LVERWRJPTAWPSX-IZBJGVDFSA-N 1 1 344.455 3.589 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(C)cc1 ZINC000743868657 1131993358 /nfs/dbraw/zinc/99/33/58/1131993358.db2.gz YNNVVLPWPDABKW-LJQANCHMSA-N 1 1 328.412 3.501 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1F ZINC001173183478 1131993664 /nfs/dbraw/zinc/99/36/64/1131993664.db2.gz YTRTVRFUIPNBQQ-MELADBBJSA-N 1 1 336.407 3.796 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(C)cc1 ZINC000743868656 1131994041 /nfs/dbraw/zinc/99/40/41/1131994041.db2.gz YNNVVLPWPDABKW-IBGZPJMESA-N 1 1 328.412 3.501 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2ccc(C)nc2)c1F ZINC001173191205 1131994786 /nfs/dbraw/zinc/99/47/86/1131994786.db2.gz BACCWDNJIGCXIZ-ZDUSSCGKSA-N 1 1 347.390 3.509 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](OCc2ccccc2)C1 ZINC001173225459 1132006323 /nfs/dbraw/zinc/00/63/23/1132006323.db2.gz CGAYBEKHFCWWEH-UZLBHIALSA-N 1 1 340.423 3.817 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001173236001 1132012101 /nfs/dbraw/zinc/01/21/01/1132012101.db2.gz DJHVRJQVJVSTOQ-TWOQFEAHSA-N 1 1 340.423 3.988 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035325 1132637392 /nfs/dbraw/zinc/63/73/92/1132637392.db2.gz KGZRHNQMIXRWNC-XHDPSFHLSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040264 1132638175 /nfs/dbraw/zinc/63/81/75/1132638175.db2.gz ZFYBVASWXCFSPX-ABAIWWIYSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040265 1132638186 /nfs/dbraw/zinc/63/81/86/1132638186.db2.gz ZFYBVASWXCFSPX-IAQYHMDHSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052017 1132643186 /nfs/dbraw/zinc/64/31/86/1132643186.db2.gz FOHUXDDFXMMXCI-JSGCOSHPSA-N 1 1 329.425 3.571 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052017 1132643191 /nfs/dbraw/zinc/64/31/91/1132643191.db2.gz FOHUXDDFXMMXCI-JSGCOSHPSA-N 1 1 329.425 3.571 20 5 EHBDMO C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057911 1132646114 /nfs/dbraw/zinc/64/61/14/1132646114.db2.gz YXKXZQDVZAAALQ-DZGCQCFKSA-N 1 1 330.350 3.625 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC001175688946 1132738793 /nfs/dbraw/zinc/73/87/93/1132738793.db2.gz QVIWUJIEBPVSTR-QGZVFWFLSA-N 1 1 348.443 3.632 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001169667944 1132814728 /nfs/dbraw/zinc/81/47/28/1132814728.db2.gz YFFZMRHXIDAXRE-VQTJNVASSA-N 1 1 340.423 3.989 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC001169723330 1132835388 /nfs/dbraw/zinc/83/53/88/1132835388.db2.gz BZGPQKDBIBMYKM-OAHLLOKOSA-N 1 1 347.459 3.990 20 5 EHBDMO C[N@H+]1CCC[C@@H](CCNc2cc3ccc(Cl)nc3cc2[N+](=O)[O-])C1 ZINC001156385400 1132877481 /nfs/dbraw/zinc/87/74/81/1132877481.db2.gz FWDGPAHGPSUWCB-LBPRGKRZSA-N 1 1 348.834 3.940 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1[N+](=O)[O-] ZINC000768333612 1133125602 /nfs/dbraw/zinc/12/56/02/1133125602.db2.gz HMXIOYFJHPAPQU-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1[N+](=O)[O-] ZINC000768333612 1133125604 /nfs/dbraw/zinc/12/56/04/1133125604.db2.gz HMXIOYFJHPAPQU-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000768543319 1133154977 /nfs/dbraw/zinc/15/49/77/1133154977.db2.gz RGSXCDCFILXMRI-CYBMUJFWSA-N 1 1 348.786 3.520 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000768543319 1133154979 /nfs/dbraw/zinc/15/49/79/1133154979.db2.gz RGSXCDCFILXMRI-CYBMUJFWSA-N 1 1 348.786 3.520 20 5 EHBDMO O=C1OC[C@@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769482565 1133287809 /nfs/dbraw/zinc/28/78/09/1133287809.db2.gz ATOHCYHMBISZTI-KRWDZBQOSA-N 1 1 332.403 3.629 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513297 1133380013 /nfs/dbraw/zinc/38/00/13/1133380013.db2.gz BOCMBFSSJLVOBS-HNNXBMFYSA-N 1 1 346.358 3.785 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513297 1133380017 /nfs/dbraw/zinc/38/00/17/1133380017.db2.gz BOCMBFSSJLVOBS-HNNXBMFYSA-N 1 1 346.358 3.785 20 5 EHBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)CC(F)F ZINC001182965870 1133751833 /nfs/dbraw/zinc/75/18/33/1133751833.db2.gz DLCKPSAATAZCNN-UHFFFAOYSA-N 1 1 345.349 3.550 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000786880486 1133923514 /nfs/dbraw/zinc/92/35/14/1133923514.db2.gz QSCMDQWVTXCZKY-KSSFIOAISA-N 1 1 346.427 3.914 20 5 EHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000746668804 1133988532 /nfs/dbraw/zinc/98/85/32/1133988532.db2.gz BGUKFVMXVSDDOC-SFHVURJKSA-N 1 1 346.402 3.814 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000746670332 1133989591 /nfs/dbraw/zinc/98/95/91/1133989591.db2.gz FSQHXKKSJSATCM-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000746670332 1133989595 /nfs/dbraw/zinc/98/95/95/1133989595.db2.gz FSQHXKKSJSATCM-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO CC1(C)CCC[N@H+]1CCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001186681324 1134249181 /nfs/dbraw/zinc/24/91/81/1134249181.db2.gz QRFZAACYMVJJTM-UHFFFAOYSA-N 1 1 348.834 3.505 20 5 EHBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775205527 1134515285 /nfs/dbraw/zinc/51/52/85/1134515285.db2.gz ZDTXTXOHOXTGQM-CQSZACIVSA-N 1 1 343.383 3.874 20 5 EHBDMO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1 ZINC001170305814 1134739918 /nfs/dbraw/zinc/73/99/18/1134739918.db2.gz QERXGBVDCCXFGI-XHDPSFHLSA-N 1 1 328.359 3.702 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170342614 1134758838 /nfs/dbraw/zinc/75/88/38/1134758838.db2.gz MMCSBLPDLJUDMO-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340092 1134758995 /nfs/dbraw/zinc/75/89/95/1134758995.db2.gz DKJSTUQVEMFDHN-DGCLKSJQSA-N 1 1 346.349 3.809 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792913114 1134823803 /nfs/dbraw/zinc/82/38/03/1134823803.db2.gz LXXBCWHCFXSCGY-UONOGXRCSA-N 1 1 345.226 3.619 20 5 EHBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834352 1135332883 /nfs/dbraw/zinc/33/28/83/1135332883.db2.gz FXIKGSHGOYLJKN-ZWKOTPCHSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@H](C(=O)OC(C)(C)C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC001195250334 1135399401 /nfs/dbraw/zinc/39/94/01/1135399401.db2.gz MBUCTEKVNBDKTA-XJKSGUPXSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@@]1(Cc2ccccc2Cl)CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC001196020268 1135506684 /nfs/dbraw/zinc/50/66/84/1135506684.db2.gz AQCKLEYBYZAAPB-KRWDZBQOSA-N 1 1 348.834 3.542 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613677 1135589730 /nfs/dbraw/zinc/58/97/30/1135589730.db2.gz KVZAUSKWLRDCPT-VUBDOFJKSA-N 1 1 331.416 3.600 20 5 EHBDMO COc1cc2c(cc1OC)[C@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC001197498204 1135700183 /nfs/dbraw/zinc/70/01/83/1135700183.db2.gz YJUWJTITRRTNEX-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)[C@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC001197498204 1135700184 /nfs/dbraw/zinc/70/01/84/1135700184.db2.gz YJUWJTITRRTNEX-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO CCC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)(C)O ZINC000809942317 1135902708 /nfs/dbraw/zinc/90/27/08/1135902708.db2.gz HOVAWQDDYJGSMD-UHFFFAOYSA-N 1 1 335.231 3.885 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2CCc2ccccc2)cc1 ZINC000776279062 1136133789 /nfs/dbraw/zinc/13/37/89/1136133789.db2.gz WYKOBLSYIXTKMK-UYAOXDASSA-N 1 1 340.423 3.725 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280111 1136135528 /nfs/dbraw/zinc/13/55/28/1136135528.db2.gz ZVIKIQHRUIEEBB-OALUTQOASA-N 1 1 326.396 3.774 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847513 1136259301 /nfs/dbraw/zinc/25/93/01/1136259301.db2.gz DSJZYOMGWITDER-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812848511 1136259870 /nfs/dbraw/zinc/25/98/70/1136259870.db2.gz COILRPFHUGTIRW-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812848511 1136259874 /nfs/dbraw/zinc/25/98/74/1136259874.db2.gz COILRPFHUGTIRW-UGSOOPFHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849007 1136260152 /nfs/dbraw/zinc/26/01/52/1136260152.db2.gz NSPWHADXAJSQLL-KUHUBIRLSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c(F)c1 ZINC000747840762 1136306896 /nfs/dbraw/zinc/30/68/96/1136306896.db2.gz SRKSQGUKILHNLQ-RTBURBONSA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@]1(c2ccccc2)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584560 1136442493 /nfs/dbraw/zinc/44/24/93/1136442493.db2.gz MYFGNYYSFWLFEQ-PMACEKPBSA-N 1 1 340.423 3.682 20 5 EHBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592484 1136453996 /nfs/dbraw/zinc/45/39/96/1136453996.db2.gz OXCPKEBBPPXBKE-BPAFIMBUSA-N 1 1 340.423 3.581 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3ccco3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000853526866 1136540885 /nfs/dbraw/zinc/54/08/85/1136540885.db2.gz AQFCPGSFYHWTFI-UHFFFAOYSA-N 1 1 340.383 3.683 20 5 EHBDMO C[C@@H](OC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448824 1136597130 /nfs/dbraw/zinc/59/71/30/1136597130.db2.gz VGJNTCBBHHMVRF-KDOFPFPSSA-N 1 1 346.427 3.996 20 5 EHBDMO Cc1cc([NH+]2CCCC2)ccc1NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819397701 1136936095 /nfs/dbraw/zinc/93/60/95/1136936095.db2.gz MJOHKSKADNCYQM-IBGZPJMESA-N 1 1 341.411 3.649 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215041 1137008261 /nfs/dbraw/zinc/00/82/61/1137008261.db2.gz VAQWOEPTCNPZRI-HNNXBMFYSA-N 1 1 327.428 3.849 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@@H]4C[C@@H](c5ccccc5)[C@@H]4C3)nc2c1 ZINC000859929972 1137037276 /nfs/dbraw/zinc/03/72/76/1137037276.db2.gz NWJDBEMKDSSVJM-BHYGNILZSA-N 1 1 349.390 3.972 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccns1 ZINC000860061021 1137042884 /nfs/dbraw/zinc/04/28/84/1137042884.db2.gz FILKMYBMFXCNSG-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1F ZINC000860102785 1137044370 /nfs/dbraw/zinc/04/43/70/1137044370.db2.gz HFUWPDBWGJLLCB-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823607018 1137106402 /nfs/dbraw/zinc/10/64/02/1137106402.db2.gz XTVZZIRTUBBQCD-KXBFYZLASA-N 1 1 328.412 3.804 20 5 EHBDMO COCCOc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872024063 1137565617 /nfs/dbraw/zinc/56/56/17/1137565617.db2.gz XZPSMJBDCQAKRM-CYBMUJFWSA-N 1 1 348.374 3.610 20 5 EHBDMO CCn1cc([C@@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872078610 1137570147 /nfs/dbraw/zinc/57/01/47/1137570147.db2.gz RMAZQGBEFVLKSS-VXGBXAGGSA-N 1 1 334.445 3.945 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877797490 1137690280 /nfs/dbraw/zinc/69/02/80/1137690280.db2.gz VOONVPACVOOTNC-AWEZNQCLSA-N 1 1 344.411 3.838 20 5 EHBDMO Cc1csc([C@@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813817 1137690937 /nfs/dbraw/zinc/69/09/37/1137690937.db2.gz PKNJCVQOEWWUBX-CSPWOOARSA-N 1 1 329.425 3.862 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966240 1137697440 /nfs/dbraw/zinc/69/74/40/1137697440.db2.gz DXQYDBVYFMXNAO-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@@H](C)C[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878092965 1137702090 /nfs/dbraw/zinc/70/20/90/1137702090.db2.gz CQTNLAYEUMHKDG-SNVBAGLBSA-N 1 1 338.795 3.776 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H](C3CC3)C2)o1 ZINC000878323656 1137710913 /nfs/dbraw/zinc/71/09/13/1137710913.db2.gz BASXXAOKQGVUTE-LLVKDONJSA-N 1 1 348.790 3.530 20 5 EHBDMO COCCSc1ccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886109289 1138047546 /nfs/dbraw/zinc/04/75/46/1138047546.db2.gz GXKASRGUUYUALY-ZDUSSCGKSA-N 1 1 347.440 3.579 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089912546 1138207447 /nfs/dbraw/zinc/20/74/47/1138207447.db2.gz SVSFCAIPVPMOBO-LBPRGKRZSA-N 1 1 335.429 3.823 20 5 EHBDMO CCCn1nccc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000337355851 1138542552 /nfs/dbraw/zinc/54/25/52/1138542552.db2.gz DXDDKOCHGRWVCG-UHFFFAOYSA-N 1 1 346.406 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cc1 ZINC000175850985 1139523110 /nfs/dbraw/zinc/52/31/10/1139523110.db2.gz MMMWFNBRIUKGCB-IRXDYDNUSA-N 1 1 346.452 3.787 20 5 EHBDMO C[C@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192460149 1140534649 /nfs/dbraw/zinc/53/46/49/1140534649.db2.gz BFEMBQSIUVIRLB-DZGCQCFKSA-N 1 1 346.456 3.541 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000266420083 1140684217 /nfs/dbraw/zinc/68/42/17/1140684217.db2.gz ACAYIICGNDUUIN-NSHDSACASA-N 1 1 348.786 3.870 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN(C2CC2)C1 ZINC000271128442 1141311690 /nfs/dbraw/zinc/31/16/90/1141311690.db2.gz LAIZTEMBCWBCRL-LSDHHAIUSA-N 1 1 349.500 3.539 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000271525767 1141388043 /nfs/dbraw/zinc/38/80/43/1141388043.db2.gz QELNQHPSGUEEQR-IAOVAPTHSA-N 1 1 340.427 3.696 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000283052302 1141544821 /nfs/dbraw/zinc/54/48/21/1141544821.db2.gz JAWJFCBLWYAXGX-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO CC(C)n1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278710126 1032086976 /nfs/dbraw/zinc/08/69/76/1032086976.db2.gz KGUJVZNXIZNNMD-UHFFFAOYSA-N 1 1 342.321 3.681 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000430160267 1014484823 /nfs/dbraw/zinc/48/48/23/1014484823.db2.gz FWIYKJFUIJRHTA-BXBOZWQASA-N 1 1 330.428 3.747 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000198594758 1125488306 /nfs/dbraw/zinc/48/83/06/1125488306.db2.gz HPQZQNBZKJZKPH-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430219338 1015070886 /nfs/dbraw/zinc/07/08/86/1015070886.db2.gz NRGXELAXOFAWDX-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430219338 1015070892 /nfs/dbraw/zinc/07/08/92/1015070892.db2.gz NRGXELAXOFAWDX-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430219338 1015070898 /nfs/dbraw/zinc/07/08/98/1015070898.db2.gz NRGXELAXOFAWDX-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CC(=O)Nc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000154464034 1015465529 /nfs/dbraw/zinc/46/55/29/1015465529.db2.gz MQLJDLJRVQBZRU-UHFFFAOYSA-N 1 1 341.411 3.964 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032801278 1015735220 /nfs/dbraw/zinc/73/52/20/1015735220.db2.gz VSOQYFKMUAAMKV-NWDGAFQWSA-N 1 1 347.802 3.926 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246944317 1016193258 /nfs/dbraw/zinc/19/32/58/1016193258.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000246944317 1016193261 /nfs/dbraw/zinc/19/32/61/1016193261.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000246944317 1016193265 /nfs/dbraw/zinc/19/32/65/1016193265.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 1 1 329.444 3.605 20 5 EHBDMO Cc1ccc(OCC[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083132348 1016354392 /nfs/dbraw/zinc/35/43/92/1016354392.db2.gz CNJPVHOFEBMCRY-UHFFFAOYSA-N 1 1 341.367 3.555 20 5 EHBDMO Cc1ccc(OCC[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083132348 1016354402 /nfs/dbraw/zinc/35/44/02/1016354402.db2.gz CNJPVHOFEBMCRY-UHFFFAOYSA-N 1 1 341.367 3.555 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000189944815 1016793957 /nfs/dbraw/zinc/79/39/57/1016793957.db2.gz UGHHWJFNABFZKP-UHFFFAOYSA-N 1 1 330.384 3.590 20 5 EHBDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414524724 1016954863 /nfs/dbraw/zinc/95/48/63/1016954863.db2.gz KYXLJTZCSCXDEZ-CYBMUJFWSA-N 1 1 328.416 3.616 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536707464 1032182391 /nfs/dbraw/zinc/18/23/91/1032182391.db2.gz FLDPWDBXKLWBGS-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536707464 1032182396 /nfs/dbraw/zinc/18/23/96/1032182396.db2.gz FLDPWDBXKLWBGS-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COCCCCc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1C ZINC000461227175 1032329022 /nfs/dbraw/zinc/32/90/22/1032329022.db2.gz PZEQRUOMEJGIFN-UHFFFAOYSA-N 1 1 329.400 3.879 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000459742357 1032456634 /nfs/dbraw/zinc/45/66/34/1032456634.db2.gz KYROTHBVKAUXML-GOSISDBHSA-N 1 1 340.427 3.799 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000459742790 1032457430 /nfs/dbraw/zinc/45/74/30/1032457430.db2.gz KYROTHBVKAUXML-SFHVURJKSA-N 1 1 340.427 3.799 20 5 EHBDMO CC[C@H](CO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000449379240 1032506092 /nfs/dbraw/zinc/50/60/92/1032506092.db2.gz ZVLUDVVBAXEDIX-LLVKDONJSA-N 1 1 338.791 3.711 20 5 EHBDMO CCn1nc(C)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000449497179 1032669458 /nfs/dbraw/zinc/66/94/58/1032669458.db2.gz IGWXTWJOEDVMGK-QGZVFWFLSA-N 1 1 342.443 3.808 20 5 EHBDMO C[C@@H]([NH3+])[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656694 1017108138 /nfs/dbraw/zinc/10/81/38/1017108138.db2.gz IZXJBBZCULKIES-KGLIPLIRSA-N 1 1 345.468 3.883 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000610368097 1018530446 /nfs/dbraw/zinc/53/04/46/1018530446.db2.gz KIYLKOXCSNLJRN-UHFFFAOYSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCSC4(CCCCC4)C3)nc2c1 ZINC000083243524 1018564870 /nfs/dbraw/zinc/56/48/70/1018564870.db2.gz RXCORIMPIWHXCF-UHFFFAOYSA-N 1 1 347.440 3.988 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCSC4(CCCCC4)C3)nc2c1 ZINC000083243524 1018564874 /nfs/dbraw/zinc/56/48/74/1018564874.db2.gz RXCORIMPIWHXCF-UHFFFAOYSA-N 1 1 347.440 3.988 20 5 EHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(C)(C)O ZINC000579498974 1018843814 /nfs/dbraw/zinc/84/38/14/1018843814.db2.gz SSODIFUBDHDROG-UHFFFAOYSA-N 1 1 334.338 3.597 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000419373612 1018951723 /nfs/dbraw/zinc/95/17/23/1018951723.db2.gz OLWWMVHRXZQMFB-YVECIDJPSA-N 1 1 330.388 3.682 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000052589536 1018993141 /nfs/dbraw/zinc/99/31/41/1018993141.db2.gz PEXJPOMDACSUQB-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO CN(C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116428 1019028193 /nfs/dbraw/zinc/02/81/93/1019028193.db2.gz FIAIFFAEYZQBBF-MRXNPFEDSA-N 1 1 345.468 3.849 20 5 EHBDMO CN(C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116428 1019028234 /nfs/dbraw/zinc/02/82/34/1019028234.db2.gz FIAIFFAEYZQBBF-MRXNPFEDSA-N 1 1 345.468 3.849 20 5 EHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1ccc([N+](=O)[O-])cc1F ZINC000379668327 1019073243 /nfs/dbraw/zinc/07/32/43/1019073243.db2.gz DHXFBWKFXRHECY-UHFFFAOYSA-N 1 1 345.418 3.734 20 5 EHBDMO CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000379668327 1019073256 /nfs/dbraw/zinc/07/32/56/1019073256.db2.gz DHXFBWKFXRHECY-UHFFFAOYSA-N 1 1 345.418 3.734 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556408 1032822881 /nfs/dbraw/zinc/82/28/81/1032822881.db2.gz NVGITNDEMYXRMG-HOCLYGCPSA-N 1 1 343.402 3.914 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556411 1032823105 /nfs/dbraw/zinc/82/31/05/1032823105.db2.gz NVGITNDEMYXRMG-ZBFHGGJFSA-N 1 1 343.402 3.914 20 5 EHBDMO CC(C)[N@H+](CC(=O)N[C@H]1CCCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513411062 1019615837 /nfs/dbraw/zinc/61/58/37/1019615837.db2.gz JDNKUODSXUYMEZ-QAPCUYQASA-N 1 1 347.459 3.500 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N[C@H]1CCCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513411062 1019615846 /nfs/dbraw/zinc/61/58/46/1019615846.db2.gz JDNKUODSXUYMEZ-QAPCUYQASA-N 1 1 347.459 3.500 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000513486568 1019745852 /nfs/dbraw/zinc/74/58/52/1019745852.db2.gz ZQRWAQYCXTXZIM-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000060773976 1032866557 /nfs/dbraw/zinc/86/65/57/1032866557.db2.gz KPZRSKPZOMWIEY-MRXNPFEDSA-N 1 1 349.818 3.768 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855572 1020213444 /nfs/dbraw/zinc/21/34/44/1020213444.db2.gz DDLCOMAYZDYNNC-NSHDSACASA-N 1 1 327.812 3.555 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(F)c2Br)cc1 ZINC000156703370 1020280670 /nfs/dbraw/zinc/28/06/70/1020280670.db2.gz PWDPFKOEHKWPRK-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO CO[C@@]1(C)CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000280468638 1020408856 /nfs/dbraw/zinc/40/88/56/1020408856.db2.gz CJVSZABLCIGYTJ-KRWDZBQOSA-N 1 1 347.440 3.719 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000280468638 1020408868 /nfs/dbraw/zinc/40/88/68/1020408868.db2.gz CJVSZABLCIGYTJ-KRWDZBQOSA-N 1 1 347.440 3.719 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1cccc(C)c1C ZINC001167463750 1020923531 /nfs/dbraw/zinc/92/35/31/1020923531.db2.gz AUGRXSRGPTXHQZ-QGZVFWFLSA-N 1 1 328.416 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)cc1F ZINC000276270540 1020984183 /nfs/dbraw/zinc/98/41/83/1020984183.db2.gz CSXDPFDLTXTHKC-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO Cc1c(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000516514786 1021506332 /nfs/dbraw/zinc/50/63/32/1021506332.db2.gz CLAIPALGZWCTBC-GOSISDBHSA-N 1 1 337.423 3.540 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000518834896 1021603873 /nfs/dbraw/zinc/60/38/73/1021603873.db2.gz JNMRZYGEXSSSOZ-AUUYWEPGSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000518834896 1021603880 /nfs/dbraw/zinc/60/38/80/1021603880.db2.gz JNMRZYGEXSSSOZ-AUUYWEPGSA-N 1 1 326.396 3.865 20 5 EHBDMO CC[N@H+](CCc1nccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182362765 1021901404 /nfs/dbraw/zinc/90/14/04/1021901404.db2.gz WVIADFFGDUNUPH-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182362765 1021901419 /nfs/dbraw/zinc/90/14/19/1021901419.db2.gz WVIADFFGDUNUPH-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000891568857 1021962047 /nfs/dbraw/zinc/96/20/47/1021962047.db2.gz YXBDNNOHYWMPAS-GFCCVEGCSA-N 1 1 346.383 3.511 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000891568857 1021962054 /nfs/dbraw/zinc/96/20/54/1021962054.db2.gz YXBDNNOHYWMPAS-GFCCVEGCSA-N 1 1 346.383 3.511 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1[N+](=O)[O-] ZINC000891619002 1022115908 /nfs/dbraw/zinc/11/59/08/1022115908.db2.gz YNVBPSXEXMGUMC-CYBMUJFWSA-N 1 1 334.397 3.708 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1[N+](=O)[O-] ZINC000891619002 1022115916 /nfs/dbraw/zinc/11/59/16/1022115916.db2.gz YNVBPSXEXMGUMC-CYBMUJFWSA-N 1 1 334.397 3.708 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnn(C3CCC3)c2)C2CC2)c1 ZINC000891623073 1022136228 /nfs/dbraw/zinc/13/62/28/1022136228.db2.gz LIWXPLVKNWJCJY-UHFFFAOYSA-N 1 1 326.400 3.681 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnn(C3CCC3)c2)C2CC2)c1 ZINC000891623073 1022136233 /nfs/dbraw/zinc/13/62/33/1022136233.db2.gz LIWXPLVKNWJCJY-UHFFFAOYSA-N 1 1 326.400 3.681 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](CC4CC4)C3)co2)cc1 ZINC000550405560 1022815143 /nfs/dbraw/zinc/81/51/43/1022815143.db2.gz UDYKVXZHCNIJSD-AWEZNQCLSA-N 1 1 327.384 3.872 20 5 EHBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N(C(=O)c1c3ccccc3cc3ccccc31)C2 ZINC001270378030 1022914475 /nfs/dbraw/zinc/91/44/75/1022914475.db2.gz XMMLZOWGKQEERN-QAPCUYQASA-N 1 1 330.431 3.769 20 5 EHBDMO Cc1c2ccccc2oc1[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(C)C ZINC000341685542 1023015437 /nfs/dbraw/zinc/01/54/37/1023015437.db2.gz SCPLAGMUKYVKJK-INIZCTEOSA-N 1 1 342.399 3.870 20 5 EHBDMO CCC(CC)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000165364218 1033101951 /nfs/dbraw/zinc/10/19/51/1033101951.db2.gz AIHSPOIZCSRWQM-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO Cc1c(C[N@@H+](C)C[C@H]2OCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000507256801 1023213909 /nfs/dbraw/zinc/21/39/09/1023213909.db2.gz LSXQUUSYZKGNSZ-LJQANCHMSA-N 1 1 326.396 3.649 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000276979529 1023536404 /nfs/dbraw/zinc/53/64/04/1023536404.db2.gz YCNBOSQEFLDZJM-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccncc2)ccc1[N+](=O)[O-] ZINC000276979529 1023536407 /nfs/dbraw/zinc/53/64/07/1023536407.db2.gz YCNBOSQEFLDZJM-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)o2)c1 ZINC000535801271 1023647700 /nfs/dbraw/zinc/64/77/00/1023647700.db2.gz GFPMOJHYYBTBHI-YJBOKZPZSA-N 1 1 342.395 3.856 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000602767474 1033164986 /nfs/dbraw/zinc/16/49/86/1033164986.db2.gz QYESDBMQVRBSTR-OAHLLOKOSA-N 1 1 334.807 3.590 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccc(F)cc2)C2CC2)cc1 ZINC000065208977 1023916613 /nfs/dbraw/zinc/91/66/13/1023916613.db2.gz SCANEEKGWOEYRL-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO COc1ccc(OCC[N@@H+](CC(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000441528414 1024036589 /nfs/dbraw/zinc/03/65/89/1024036589.db2.gz YZPPRJZFHKZFNB-UHFFFAOYSA-N 1 1 336.432 3.883 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000280899670 1024410666 /nfs/dbraw/zinc/41/06/66/1024410666.db2.gz DSUPKIIDKRLVOC-QAPCUYQASA-N 1 1 341.411 3.650 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(NC[C@@H]2CC[N@H+](C3CC3)C2)c(Cl)c1 ZINC000228842362 1033209894 /nfs/dbraw/zinc/20/98/94/1033209894.db2.gz JKLOAGYBQVEZJV-VIFPVBQESA-N 1 1 330.215 3.798 20 5 EHBDMO COc1nc2ccccc2cc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000538726218 1024482100 /nfs/dbraw/zinc/48/21/00/1024482100.db2.gz DSNKUPBNNONLKU-UHFFFAOYSA-N 1 1 349.390 3.710 20 5 EHBDMO COc1nc2ccccc2cc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000538726218 1024482110 /nfs/dbraw/zinc/48/21/10/1024482110.db2.gz DSNKUPBNNONLKU-UHFFFAOYSA-N 1 1 349.390 3.710 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957239 1024525605 /nfs/dbraw/zinc/52/56/05/1024525605.db2.gz ZMKBBUVSXQAOEL-SWLSCSKDSA-N 1 1 346.818 3.891 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2cccs2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000505605008 1024626805 /nfs/dbraw/zinc/62/68/05/1024626805.db2.gz FSNCBKIGUJEPGY-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1nccc1[C@H]1CCCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000281220838 1024759448 /nfs/dbraw/zinc/75/94/48/1024759448.db2.gz KHUZSWLKXFXYMR-JHTBKMLMSA-N 1 1 326.400 3.569 20 5 EHBDMO Cn1nccc1[C@H]1CCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000281220838 1024759458 /nfs/dbraw/zinc/75/94/58/1024759458.db2.gz KHUZSWLKXFXYMR-JHTBKMLMSA-N 1 1 326.400 3.569 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1CC(C)(C)C ZINC000435441719 1024927305 /nfs/dbraw/zinc/92/73/05/1024927305.db2.gz HJIQQKIJLYRHQZ-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc(C[NH+]2CCC(c3ncc(C)s3)CC2)cc1[N+](=O)[O-] ZINC000277456755 1025157819 /nfs/dbraw/zinc/15/78/19/1025157819.db2.gz LBBFZBPJOIZRLD-UHFFFAOYSA-N 1 1 347.440 3.748 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000185480335 1025184558 /nfs/dbraw/zinc/18/45/58/1025184558.db2.gz ICKBIUYCMAAUFH-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000521479192 1025404292 /nfs/dbraw/zinc/40/42/92/1025404292.db2.gz BVPWMOUXGJTRJZ-SFHVURJKSA-N 1 1 330.359 3.950 20 5 EHBDMO Cc1cnc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)s1 ZINC000277510370 1025550237 /nfs/dbraw/zinc/55/02/37/1025550237.db2.gz OMTWRXSAQVFLMB-UHFFFAOYSA-N 1 1 335.404 3.878 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000451324672 1025827687 /nfs/dbraw/zinc/82/76/87/1025827687.db2.gz LPPMQIOITFIETQ-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccc(F)cc2)C2CCCCC2)n1 ZINC000478418078 1026097200 /nfs/dbraw/zinc/09/72/00/1026097200.db2.gz OXOWBFFACKGVBN-UHFFFAOYSA-N 1 1 346.406 3.765 20 5 EHBDMO C[NH+](C)C1(c2nc(-c3c4ccccc4nc4ccccc43)no2)CC1 ZINC000896944440 1026137953 /nfs/dbraw/zinc/13/79/53/1026137953.db2.gz PICCPXFCZTXGAD-UHFFFAOYSA-N 1 1 330.391 3.989 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000511127475 1026283302 /nfs/dbraw/zinc/28/33/02/1026283302.db2.gz VQQCGKRKXGSPMP-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]CC(C)(C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544381205 1026404419 /nfs/dbraw/zinc/40/44/19/1026404419.db2.gz JNWMCVNWNVSLJR-KRWDZBQOSA-N 1 1 332.400 3.854 20 5 EHBDMO CSCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235056615 1026668637 /nfs/dbraw/zinc/66/86/37/1026668637.db2.gz BJESGQUSCOEABU-JTQLQIEISA-N 1 1 347.278 3.931 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235056615 1026668642 /nfs/dbraw/zinc/66/86/42/1026668642.db2.gz BJESGQUSCOEABU-JTQLQIEISA-N 1 1 347.278 3.931 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000187786726 1027081339 /nfs/dbraw/zinc/08/13/39/1027081339.db2.gz NCOUYHQDXCOPFQ-GUYCJALGSA-N 1 1 334.441 3.643 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000501785391 1027533486 /nfs/dbraw/zinc/53/34/86/1027533486.db2.gz PNJOGZPWKNIOPE-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000300241790 1027777116 /nfs/dbraw/zinc/77/71/16/1027777116.db2.gz RPZZFRIKFQXCSR-UWVGGRQHSA-N 1 1 330.215 3.940 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](C4CCCC4)C3)n2)cc1 ZINC000420958747 1027928045 /nfs/dbraw/zinc/92/80/45/1027928045.db2.gz CLPIMNJYUZYSMP-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000533512677 1027996137 /nfs/dbraw/zinc/99/61/37/1027996137.db2.gz LEAIDSLTDMOUEO-UHFFFAOYSA-N 1 1 337.379 3.513 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000533512677 1027996154 /nfs/dbraw/zinc/99/61/54/1027996154.db2.gz LEAIDSLTDMOUEO-UHFFFAOYSA-N 1 1 337.379 3.513 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648643 1028110259 /nfs/dbraw/zinc/11/02/59/1028110259.db2.gz HKHOHHZCBJCWGN-ZFWWWQNUSA-N 1 1 336.395 3.849 20 5 EHBDMO C[NH+]1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000237169519 1028116267 /nfs/dbraw/zinc/11/62/67/1028116267.db2.gz HYHGWWKYRHHKLH-UHFFFAOYSA-N 1 1 331.441 3.507 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)Cc2cc(C)ccc2F)c([N+](=O)[O-])c1 ZINC000444743296 1028228392 /nfs/dbraw/zinc/22/83/92/1028228392.db2.gz YLYRCMXOVJZFGS-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]34CCOC4)o2)c(Cl)c1 ZINC000421393938 1028374426 /nfs/dbraw/zinc/37/44/26/1028374426.db2.gz FOQIHNOIRRPWAQ-QGZVFWFLSA-N 1 1 348.786 3.873 20 5 EHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350091 1028477109 /nfs/dbraw/zinc/47/71/09/1028477109.db2.gz CZCXXMNYGYCGCQ-UHFFFAOYSA-N 1 1 341.411 3.834 20 5 EHBDMO COCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000523702110 1028556812 /nfs/dbraw/zinc/55/68/12/1028556812.db2.gz FERTZQIZYRXNEQ-INIZCTEOSA-N 1 1 328.412 3.847 20 5 EHBDMO CC(C)[N@@H+](C)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000523863821 1028676564 /nfs/dbraw/zinc/67/65/64/1028676564.db2.gz CMMQOLVKLVOXDL-UHFFFAOYSA-N 1 1 341.411 3.578 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000347376207 1028805154 /nfs/dbraw/zinc/80/51/54/1028805154.db2.gz ZXLMWYKYWMGKIP-HFQYIWAZSA-N 1 1 326.400 3.601 20 5 EHBDMO Cc1ccccc1N1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000487513864 1028810341 /nfs/dbraw/zinc/81/03/41/1028810341.db2.gz LMDLGEYFWKCLEM-MRXNPFEDSA-N 1 1 325.412 3.786 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cc2ccccc2o1 ZINC000472280265 1028816418 /nfs/dbraw/zinc/81/64/18/1028816418.db2.gz SJNIGDSHAFOAJV-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000472280265 1028816436 /nfs/dbraw/zinc/81/64/36/1028816436.db2.gz SJNIGDSHAFOAJV-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000524424535 1029180812 /nfs/dbraw/zinc/18/08/12/1029180812.db2.gz RWSGLMHGORRIAT-UHFFFAOYSA-N 1 1 334.803 3.802 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCCc4c(O)cccc43)nc2c1 ZINC000192359799 1029646149 /nfs/dbraw/zinc/64/61/49/1029646149.db2.gz PVPNHMXNCWZZHL-AWEZNQCLSA-N 1 1 339.351 3.609 20 5 EHBDMO CC[C@@]1(O)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000428446353 1029668430 /nfs/dbraw/zinc/66/84/30/1029668430.db2.gz JRXQKGJHJCIPBN-QGZVFWFLSA-N 1 1 332.425 3.670 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192480552 1029684571 /nfs/dbraw/zinc/68/45/71/1029684571.db2.gz HDPGSRLYTSFHNX-TZMCWYRMSA-N 1 1 332.429 3.516 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441185395 1029895739 /nfs/dbraw/zinc/89/57/39/1029895739.db2.gz ZRAATVJVHHVDCU-CQSZACIVSA-N 1 1 330.384 3.675 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000447677005 1030411428 /nfs/dbraw/zinc/41/14/28/1030411428.db2.gz SANKDBNYJXDHJG-UHFFFAOYSA-N 1 1 327.384 3.654 20 5 EHBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000343440272 1030900724 /nfs/dbraw/zinc/90/07/24/1030900724.db2.gz JFLAKDJQKYNELE-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC(C)(C)C1 ZINC000483101598 1030956082 /nfs/dbraw/zinc/95/60/82/1030956082.db2.gz HSJBNQRPOAINQG-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[N@@H+]2C2CCCC2)n1 ZINC000923885182 1031346664 /nfs/dbraw/zinc/34/66/64/1031346664.db2.gz ANBLOQNLPDXURP-HNNXBMFYSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[N@H+]2C2CCCC2)n1 ZINC000923885182 1031346677 /nfs/dbraw/zinc/34/66/77/1031346677.db2.gz ANBLOQNLPDXURP-HNNXBMFYSA-N 1 1 328.372 3.643 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071951 1033325035 /nfs/dbraw/zinc/32/50/35/1033325035.db2.gz VNRSXUGSAJGJDY-KQIUPUNMSA-N 1 1 329.425 3.629 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000593589671 1033363666 /nfs/dbraw/zinc/36/36/66/1033363666.db2.gz UNZBZYDCDWJYEJ-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000594497518 1033399687 /nfs/dbraw/zinc/39/96/87/1033399687.db2.gz CTYIGAYUEXHJTP-LSDHHAIUSA-N 1 1 330.771 3.959 20 5 EHBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000594647356 1033471822 /nfs/dbraw/zinc/47/18/22/1033471822.db2.gz VNVDJVDWXRYPJN-QGZVFWFLSA-N 1 1 345.446 3.602 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000594614735 1033477201 /nfs/dbraw/zinc/47/72/01/1033477201.db2.gz JWMLRAZKXKHOLW-GFCCVEGCSA-N 1 1 332.425 3.669 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594977984 1033580943 /nfs/dbraw/zinc/58/09/43/1033580943.db2.gz PGAQYJMMUXDPCX-DBWMJRBXSA-N 1 1 329.444 3.605 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC000594977984 1033580957 /nfs/dbraw/zinc/58/09/57/1033580957.db2.gz PGAQYJMMUXDPCX-DBWMJRBXSA-N 1 1 329.444 3.605 20 5 EHBDMO Cc1c(C[NH2+]Cc2cccc(F)c2OC(F)F)cccc1[N+](=O)[O-] ZINC000594937333 1033586414 /nfs/dbraw/zinc/58/64/14/1033586414.db2.gz HNNBCFDEZBAXQB-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](COC)Cc1ccccc1 ZINC000472344372 1033598047 /nfs/dbraw/zinc/59/80/47/1033598047.db2.gz ATQQUNDXOAIEIX-HXUWFJFHSA-N 1 1 342.439 3.717 20 5 EHBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014750 1033606884 /nfs/dbraw/zinc/60/68/84/1033606884.db2.gz HXFCFAPLELLJLG-NSHDSACASA-N 1 1 333.388 3.567 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595005483 1033627981 /nfs/dbraw/zinc/62/79/81/1033627981.db2.gz ZDGANGNKIUIXAA-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](c1ccccc1)[NH+](C)C ZINC000595003263 1033628317 /nfs/dbraw/zinc/62/83/17/1033628317.db2.gz FKWJXWFHEUCCAW-RDTXWAMCSA-N 1 1 343.427 3.557 20 5 EHBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(F)(F)C(C)(C)C ZINC000595106054 1033691668 /nfs/dbraw/zinc/69/16/68/1033691668.db2.gz HFTXFQRHEUQCNE-NSHDSACASA-N 1 1 343.374 3.583 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000595081989 1033695889 /nfs/dbraw/zinc/69/58/89/1033695889.db2.gz VFIJTQQJWQMYCU-QGZVFWFLSA-N 1 1 328.416 3.588 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000595085647 1033697882 /nfs/dbraw/zinc/69/78/82/1033697882.db2.gz SPLNLFYTVABTAP-PIGZYNQJSA-N 1 1 328.368 3.647 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CC[N@H+]2C2CCCC2)ccc2cnccc21 ZINC000599164787 1033779911 /nfs/dbraw/zinc/77/99/11/1033779911.db2.gz MQIAOQLDVRSXJF-HNNXBMFYSA-N 1 1 326.400 3.572 20 5 EHBDMO COCCCC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595469501 1033822902 /nfs/dbraw/zinc/82/29/02/1033822902.db2.gz PBOCCHPIHPDCND-OAHLLOKOSA-N 1 1 333.388 3.539 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)no1 ZINC000608836700 1033909047 /nfs/dbraw/zinc/90/90/47/1033909047.db2.gz FYAUQKQZXICIEY-UHFFFAOYSA-N 1 1 329.381 3.910 20 5 EHBDMO COc1ccc(OCC[N@@H+]2CC[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000595702326 1033953030 /nfs/dbraw/zinc/95/30/30/1033953030.db2.gz ISSOQIWGMKQJIM-INIZCTEOSA-N 1 1 346.358 3.568 20 5 EHBDMO COc1ccc(OCC[N@H+]2CC[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000595702326 1033953041 /nfs/dbraw/zinc/95/30/41/1033953041.db2.gz ISSOQIWGMKQJIM-INIZCTEOSA-N 1 1 346.358 3.568 20 5 EHBDMO O=C(CC[N@H+]1CC[C@H]1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595705742 1033955473 /nfs/dbraw/zinc/95/54/73/1033955473.db2.gz VUBJVJSDQZMPEV-KRWDZBQOSA-N 1 1 343.358 3.510 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855152 1033980559 /nfs/dbraw/zinc/98/05/59/1033980559.db2.gz KBBUYBQMLBOHNP-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855152 1033980566 /nfs/dbraw/zinc/98/05/66/1033980566.db2.gz KBBUYBQMLBOHNP-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000603868400 1033994765 /nfs/dbraw/zinc/99/47/65/1033994765.db2.gz LHPRXFQRZJDXCB-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CC1(C)C ZINC000595909474 1034025116 /nfs/dbraw/zinc/02/51/16/1034025116.db2.gz OLRVGBRNXHMSRK-WCQYABFASA-N 1 1 330.388 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c(Cl)c1 ZINC000595910273 1034029746 /nfs/dbraw/zinc/02/97/46/1034029746.db2.gz OEOWFIQVIOQIMU-CALCHBBNSA-N 1 1 336.819 3.641 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1F ZINC000599596493 1034033659 /nfs/dbraw/zinc/03/36/59/1034033659.db2.gz BVSJIPDRTKOIHL-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4COC[C@@H]4C3)s2)cc1 ZINC000597229664 1034611054 /nfs/dbraw/zinc/61/10/54/1034611054.db2.gz ICPRMVOVVVCWCA-GJZGRUSLSA-N 1 1 344.436 3.792 20 5 EHBDMO CCc1ccc([C@@H](NCCC2(C[NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593321498 1034645339 /nfs/dbraw/zinc/64/53/39/1034645339.db2.gz XVNBZDBEHFIFPO-SFHVURJKSA-N 1 1 343.427 3.558 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000534530850 1034650408 /nfs/dbraw/zinc/65/04/08/1034650408.db2.gz READCXYWCOGFOB-GOSISDBHSA-N 1 1 334.379 3.742 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C1CCCCC1 ZINC000411164576 1034809524 /nfs/dbraw/zinc/80/95/24/1034809524.db2.gz IAWZTSZGITVWDP-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+](C[C@H]3CCOC3)C3CC3)o2)c1 ZINC000129993614 1034992227 /nfs/dbraw/zinc/99/22/27/1034992227.db2.gz WBIMACZECRSUEB-CQSZACIVSA-N 1 1 342.395 3.856 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2ccc3cncn3c2)c2cc([N+](=O)[O-])ccc21 ZINC000414200623 1036025323 /nfs/dbraw/zinc/02/53/23/1036025323.db2.gz ZZPJZBGQCBASDN-SFHVURJKSA-N 1 1 336.395 3.755 20 5 EHBDMO C[N@@H+](CCc1nccs1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180179085 1036059273 /nfs/dbraw/zinc/05/92/73/1036059273.db2.gz SNRIXSYFQGRPML-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000541389098 1036248241 /nfs/dbraw/zinc/24/82/41/1036248241.db2.gz NGVODROOSTVPPR-QGZVFWFLSA-N 1 1 326.396 3.901 20 5 EHBDMO C[C@H]1C[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000589210586 1036313039 /nfs/dbraw/zinc/31/30/39/1036313039.db2.gz CGYVGCACTHSESY-KBPBESRZSA-N 1 1 346.452 3.916 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000589499625 1036440017 /nfs/dbraw/zinc/44/00/17/1036440017.db2.gz YEBPNRKWPCKTSL-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000589499625 1036440026 /nfs/dbraw/zinc/44/00/26/1036440026.db2.gz YEBPNRKWPCKTSL-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO O=[N+]([O-])c1sccc1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000609132775 1036467483 /nfs/dbraw/zinc/46/74/83/1036467483.db2.gz QFNJWBMXHRBTTE-OAHLLOKOSA-N 1 1 331.441 3.633 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000541773771 1036646017 /nfs/dbraw/zinc/64/60/17/1036646017.db2.gz MHEXTPJTPDWKTP-HNAYVOBHSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000541773771 1036646036 /nfs/dbraw/zinc/64/60/36/1036646036.db2.gz MHEXTPJTPDWKTP-HNAYVOBHSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647942 1036659708 /nfs/dbraw/zinc/65/97/08/1036659708.db2.gz NOKSMWBHBKJRLS-ZIAGYGMSSA-N 1 1 349.431 3.502 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000310892211 1036715641 /nfs/dbraw/zinc/71/56/41/1036715641.db2.gz KXYIFINVRKEYLD-LJQANCHMSA-N 1 1 340.427 3.622 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000376448368 1036890247 /nfs/dbraw/zinc/89/02/47/1036890247.db2.gz MNAMAXKBEJQBJW-PXAZEXFGSA-N 1 1 346.456 3.734 20 5 EHBDMO Cc1ccc(C[N@H+](CCO)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000542130939 1037089733 /nfs/dbraw/zinc/08/97/33/1037089733.db2.gz AJGJNOHDKLEVRR-UHFFFAOYSA-N 1 1 334.803 3.551 20 5 EHBDMO Cc1ccc(C[N@@H+](CCO)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000542130939 1037089745 /nfs/dbraw/zinc/08/97/45/1037089745.db2.gz AJGJNOHDKLEVRR-UHFFFAOYSA-N 1 1 334.803 3.551 20 5 EHBDMO C[NH+](C)C[C@@H](Cc1ccccc1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522967 1037089931 /nfs/dbraw/zinc/08/99/31/1037089931.db2.gz OCYDFFYHBAYBCI-MRXNPFEDSA-N 1 1 347.846 3.511 20 5 EHBDMO Cc1cccc2[nH]c(C[NH2+]Cc3ccc([N+](=O)[O-])c(Cl)c3)nc21 ZINC000761526082 1037109197 /nfs/dbraw/zinc/10/91/97/1037109197.db2.gz GXAPXUOEWFRRHC-UHFFFAOYSA-N 1 1 330.775 3.723 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C2CCC2)C1 ZINC000591061787 1037221803 /nfs/dbraw/zinc/22/18/03/1037221803.db2.gz IJRZIFUAFMCBLT-DOMZBBRYSA-N 1 1 342.399 3.828 20 5 EHBDMO Cc1ccnc(NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000348350805 1037293910 /nfs/dbraw/zinc/29/39/10/1037293910.db2.gz OYMMHRXSAFRNBT-OAHLLOKOSA-N 1 1 328.416 3.621 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000541007165 1037363388 /nfs/dbraw/zinc/36/33/88/1037363388.db2.gz LSCMUDQQLLNDGI-UHFFFAOYSA-N 1 1 334.464 3.555 20 5 EHBDMO Cc1cc2ncc([C@@H](C)[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])c(C)n2n1 ZINC000271834734 1037431470 /nfs/dbraw/zinc/43/14/70/1037431470.db2.gz VALVTDXIFSZFNC-QWHCGFSZSA-N 1 1 339.399 3.666 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000591498938 1037449077 /nfs/dbraw/zinc/44/90/77/1037449077.db2.gz QNKKEUBHNFWILZ-AGUYFDCRSA-N 1 1 342.399 3.602 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462834520 1037458386 /nfs/dbraw/zinc/45/83/86/1037458386.db2.gz PXPNMDQCGTUQIK-HWKANZROSA-N 1 1 336.391 3.861 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462834520 1037458405 /nfs/dbraw/zinc/45/84/05/1037458405.db2.gz PXPNMDQCGTUQIK-HWKANZROSA-N 1 1 336.391 3.861 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCCC[C@@H]1C ZINC000462925658 1037554919 /nfs/dbraw/zinc/55/49/19/1037554919.db2.gz CMUKFZHEYVCLEP-RYUDHWBXSA-N 1 1 343.374 3.871 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C)CC1 ZINC000249836045 1037611806 /nfs/dbraw/zinc/61/18/06/1037611806.db2.gz RXSDBQYYTWVLNO-CHWSQXEVSA-N 1 1 330.388 3.828 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000463034343 1037692097 /nfs/dbraw/zinc/69/20/97/1037692097.db2.gz FDAWHMYEHAFEON-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000051181755 1037744719 /nfs/dbraw/zinc/74/47/19/1037744719.db2.gz NHHBPCCSGIPNHQ-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO CC[C@@]1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000443849837 1037772297 /nfs/dbraw/zinc/77/22/97/1037772297.db2.gz FCAVBEOPDXGLGB-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000443849837 1037772318 /nfs/dbraw/zinc/77/23/18/1037772318.db2.gz FCAVBEOPDXGLGB-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000532610182 1037887830 /nfs/dbraw/zinc/88/78/30/1037887830.db2.gz OVCJUTVTORIJSU-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000532610182 1037887840 /nfs/dbraw/zinc/88/78/40/1037887840.db2.gz OVCJUTVTORIJSU-SNVBAGLBSA-N 1 1 343.214 3.791 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416956 1038133801 /nfs/dbraw/zinc/13/38/01/1038133801.db2.gz LTIQHKJPUSWSSO-LLVKDONJSA-N 1 1 347.278 3.931 20 5 EHBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000461640658 1038545720 /nfs/dbraw/zinc/54/57/20/1038545720.db2.gz FZNUSTLGHAMEFM-LBPRGKRZSA-N 1 1 349.456 3.660 20 5 EHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461945034 1038676495 /nfs/dbraw/zinc/67/64/95/1038676495.db2.gz BODFIWQXKKHINU-NEPJUHHUSA-N 1 1 343.349 3.595 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccc(F)cc1 ZINC000041888282 1038788262 /nfs/dbraw/zinc/78/82/62/1038788262.db2.gz OOMXSHFCWBMUAQ-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585154 1038913347 /nfs/dbraw/zinc/91/33/47/1038913347.db2.gz GHVULNVRYMBPBZ-STQMWFEESA-N 1 1 330.388 3.513 20 5 EHBDMO COC(=O)c1csc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000552275260 1039146804 /nfs/dbraw/zinc/14/68/04/1039146804.db2.gz PNLCMCUPRXDAGX-WDEREUQCSA-N 1 1 334.397 3.855 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478029286 1039148904 /nfs/dbraw/zinc/14/89/04/1039148904.db2.gz ONTXEPKLMHIHLT-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000310088336 1039308341 /nfs/dbraw/zinc/30/83/41/1039308341.db2.gz PGYYOFYOGWMALW-QGZVFWFLSA-N 1 1 325.412 3.919 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H](C4CC4)C3)s2)cc1 ZINC000485686074 1039423518 /nfs/dbraw/zinc/42/35/18/1039423518.db2.gz RNRFIWFGDWMQCK-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H](C4CC4)C3)s2)cc1 ZINC000485686074 1039423524 /nfs/dbraw/zinc/42/35/24/1039423524.db2.gz RNRFIWFGDWMQCK-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485714336 1039456207 /nfs/dbraw/zinc/45/62/07/1039456207.db2.gz FQJZEKJCAXYRGR-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485734155 1039480262 /nfs/dbraw/zinc/48/02/62/1039480262.db2.gz BYYSSGHRQXQTIC-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[NH+]1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236921124 1039766834 /nfs/dbraw/zinc/76/68/34/1039766834.db2.gz XNGXQSDWGHPNBQ-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1C ZINC000042133398 1039872494 /nfs/dbraw/zinc/87/24/94/1039872494.db2.gz RKOPZXYEEALDLC-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO C[N@@H+](CCSc1ncc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000432920518 1040180739 /nfs/dbraw/zinc/18/07/39/1040180739.db2.gz YIZYJDKOJPCYRK-UHFFFAOYSA-N 1 1 337.832 3.867 20 5 EHBDMO COC1(C(F)(F)F)CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000418094055 1040573910 /nfs/dbraw/zinc/57/39/10/1040573910.db2.gz RFIVRFIDFSFLQT-GQCTYLIASA-N 1 1 344.333 3.651 20 5 EHBDMO Cc1nc(C)c(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000600155859 1040746212 /nfs/dbraw/zinc/74/62/12/1040746212.db2.gz JJKLMAZYFSRZDJ-UHFFFAOYSA-N 1 1 329.278 3.508 20 5 EHBDMO COc1cccc(OCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000490799470 1040747475 /nfs/dbraw/zinc/74/74/75/1040747475.db2.gz DSAUNMVYXKTBJR-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000600197036 1040813160 /nfs/dbraw/zinc/81/31/60/1040813160.db2.gz QDSCQURWABUJNA-RHSMWYFYSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001167752534 1040848899 /nfs/dbraw/zinc/84/88/99/1040848899.db2.gz VROPJDQSQSWJRH-ZDUSSCGKSA-N 1 1 346.406 3.959 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)c1ccccc1 ZINC000491130568 1040938183 /nfs/dbraw/zinc/93/81/83/1040938183.db2.gz ACPRTENRSADODX-AWEZNQCLSA-N 1 1 332.375 3.944 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)c1ccccc1 ZINC000491130568 1040938198 /nfs/dbraw/zinc/93/81/98/1040938198.db2.gz ACPRTENRSADODX-AWEZNQCLSA-N 1 1 332.375 3.944 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCSC1 ZINC000433186046 1041021895 /nfs/dbraw/zinc/02/18/95/1041021895.db2.gz HNAOTKKRZVJLMC-CQSZACIVSA-N 1 1 344.864 3.592 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCSC1 ZINC000433186046 1041021913 /nfs/dbraw/zinc/02/19/13/1041021913.db2.gz HNAOTKKRZVJLMC-CQSZACIVSA-N 1 1 344.864 3.592 20 5 EHBDMO Cc1[nH+]c(N)ccc1CNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC001167785771 1042450844 /nfs/dbraw/zinc/45/08/44/1042450844.db2.gz DECISKXLCAVCIF-UHFFFAOYSA-N 1 1 326.278 3.511 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000569481325 1043005517 /nfs/dbraw/zinc/00/55/17/1043005517.db2.gz CWDUFETWSRFAOS-MRXNPFEDSA-N 1 1 341.411 3.767 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000585756371 1043025501 /nfs/dbraw/zinc/02/55/01/1043025501.db2.gz GZTONAHSDYSATH-JXFKEZNVSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C)[C@@H](Cc2ccccc2)C1 ZINC000585756371 1043025503 /nfs/dbraw/zinc/02/55/03/1043025503.db2.gz GZTONAHSDYSATH-JXFKEZNVSA-N 1 1 339.439 3.515 20 5 EHBDMO CC[C@]1(C)CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344220447 1043455049 /nfs/dbraw/zinc/45/50/49/1043455049.db2.gz QPMWGMOFQPASDK-YVEFUNNKSA-N 1 1 330.388 3.828 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3Cc3ccccc3)nc2c1 ZINC000344698888 1044302130 /nfs/dbraw/zinc/30/21/30/1044302130.db2.gz IWGBGDOFWMHQHL-HNNXBMFYSA-N 1 1 336.395 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1 ZINC000326686162 1128430112 /nfs/dbraw/zinc/43/01/12/1128430112.db2.gz IUXMHICALQSZCN-IPMKNSEASA-N 1 1 332.444 3.543 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428832 1128486287 /nfs/dbraw/zinc/48/62/87/1128486287.db2.gz OSHFTHORABYXHH-GDBMZVCRSA-N 1 1 326.400 3.546 20 5 EHBDMO Cc1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000301545490 1128495402 /nfs/dbraw/zinc/49/54/02/1128495402.db2.gz OSLFSWVMLAQOJF-WBVHZDCISA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301602406 1128518676 /nfs/dbraw/zinc/51/86/76/1128518676.db2.gz WHTMXMGDPLJALI-NVXWUHKLSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000172619119 1128736513 /nfs/dbraw/zinc/73/65/13/1128736513.db2.gz JHKLFYKYDKZEEI-DOTOQJQBSA-N 1 1 347.462 3.943 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000303044237 1121118632 /nfs/dbraw/zinc/11/86/32/1121118632.db2.gz WWLMIWJDMPZCER-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145108 1121125526 /nfs/dbraw/zinc/12/55/26/1121125526.db2.gz SYHRRDHGJLWWOI-CQSZACIVSA-N 1 1 326.400 3.680 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000193454852 1121318471 /nfs/dbraw/zinc/31/84/71/1121318471.db2.gz VIVDZQFUMHBLJW-YVEFUNNKSA-N 1 1 346.456 3.734 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC1=CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272498702 1121664719 /nfs/dbraw/zinc/66/47/19/1121664719.db2.gz GIDBBHRMQLFKHD-GOSISDBHSA-N 1 1 340.427 3.898 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Oc2ccc(F)cc2F)CC1 ZINC000193876003 1121723472 /nfs/dbraw/zinc/72/34/72/1121723472.db2.gz GOZGFIYJEVZDGN-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000311667872 1129033841 /nfs/dbraw/zinc/03/38/41/1129033841.db2.gz XXRDLFGDAXRQLS-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CCCC3)C2)c2ccncc21 ZINC000301172535 1122242204 /nfs/dbraw/zinc/24/22/04/1122242204.db2.gz FBVFNPCQFCRFIX-ZDUSSCGKSA-N 1 1 326.400 3.572 20 5 EHBDMO C[N@H+](CCOc1ccccc1Cl)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916973776 1122426743 /nfs/dbraw/zinc/42/67/43/1122426743.db2.gz XAQROUVFDHYJJL-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916973776 1122426746 /nfs/dbraw/zinc/42/67/46/1122426746.db2.gz XAQROUVFDHYJJL-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CCOc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000154287069 1122503882 /nfs/dbraw/zinc/50/38/82/1122503882.db2.gz TVEHBBBAJLAMOC-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)n1 ZINC000154287069 1122503886 /nfs/dbraw/zinc/50/38/86/1122503886.db2.gz TVEHBBBAJLAMOC-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394433 1122596134 /nfs/dbraw/zinc/59/61/34/1122596134.db2.gz LYNXKZWHWHWQPB-QGZVFWFLSA-N 1 1 326.352 3.506 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000255314091 1129068205 /nfs/dbraw/zinc/06/82/05/1129068205.db2.gz ZZZQJZDQMSEYMZ-BKSIFSGMSA-N 1 1 342.395 3.882 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000255314091 1129068211 /nfs/dbraw/zinc/06/82/11/1129068211.db2.gz ZZZQJZDQMSEYMZ-BKSIFSGMSA-N 1 1 342.395 3.882 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000556130203 1122832387 /nfs/dbraw/zinc/83/23/87/1122832387.db2.gz KDCIWZQDGQJNCM-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO C[C@@H](CNc1cccc(F)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000919963680 1123248588 /nfs/dbraw/zinc/24/85/88/1123248588.db2.gz SLQLWQXCSMGWPT-ZDUSSCGKSA-N 1 1 329.375 3.593 20 5 EHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001843 1123710693 /nfs/dbraw/zinc/71/06/93/1123710693.db2.gz DSIHTARBBOQNJP-DYVFJYSZSA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1C(F)(F)F ZINC000369968321 1129225225 /nfs/dbraw/zinc/22/52/25/1129225225.db2.gz YUEBOHNZJPHRLF-RYUDHWBXSA-N 1 1 329.322 3.652 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[N@@H+](C)C1CC1 ZINC000301883780 1129265539 /nfs/dbraw/zinc/26/55/39/1129265539.db2.gz YGTOFLGYYAISGN-ZDUSSCGKSA-N 1 1 326.400 3.551 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027065 1129376416 /nfs/dbraw/zinc/37/64/16/1129376416.db2.gz YSYQPZBNUGZPQI-STQMWFEESA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000117343321 1129435061 /nfs/dbraw/zinc/43/50/61/1129435061.db2.gz MXDCOVBUOBUQGU-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000499960013 1129592420 /nfs/dbraw/zinc/59/24/20/1129592420.db2.gz ZMYDHGWXDFWYEY-MEBBXXQBSA-N 1 1 338.766 3.772 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000922880985 1129703625 /nfs/dbraw/zinc/70/36/25/1129703625.db2.gz YNGHJQUHNAHSKZ-AWEZNQCLSA-N 1 1 349.337 3.758 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429033019 1129714451 /nfs/dbraw/zinc/71/44/51/1129714451.db2.gz YZWPIRXXCCQZSJ-QBWPOKONSA-N 1 1 331.460 3.626 20 5 EHBDMO Cc1ccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000073986971 1129879783 /nfs/dbraw/zinc/87/97/83/1129879783.db2.gz KZQNYENKCOOYRD-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccc([C@@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000073986971 1129879786 /nfs/dbraw/zinc/87/97/86/1129879786.db2.gz KZQNYENKCOOYRD-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)Cc2cccc(Cl)c2)cc1 ZINC000134289872 1129989942 /nfs/dbraw/zinc/98/99/42/1129989942.db2.gz OYIQWMNWWBEPMR-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO CCCC(=O)NC[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538853 1130233239 /nfs/dbraw/zinc/23/32/39/1130233239.db2.gz ZFPVKUUNPBDOFW-HZPDHXFCSA-N 1 1 347.459 3.593 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000175188054 1130411800 /nfs/dbraw/zinc/41/18/00/1130411800.db2.gz QJCFHAQFKLBEIC-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000733302483 1131019223 /nfs/dbraw/zinc/01/92/23/1131019223.db2.gz XHQQQXLEQLNRGO-LBPRGKRZSA-N 1 1 334.445 3.881 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738241925 1131465836 /nfs/dbraw/zinc/46/58/36/1131465836.db2.gz VASOVEKMWDWZRQ-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO CCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000740881781 1131553048 /nfs/dbraw/zinc/55/30/48/1131553048.db2.gz CWSQXBYFLXWXKI-USXIJHARSA-N 1 1 336.407 3.759 20 5 EHBDMO CC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(=O)OC(C)(C)C ZINC001172898412 1131883195 /nfs/dbraw/zinc/88/31/95/1131883195.db2.gz AMKLGMXQWXAYPU-RDJZCZTQSA-N 1 1 348.443 3.552 20 5 EHBDMO COC(C)(C)[C@@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916390 1131903938 /nfs/dbraw/zinc/90/39/38/1131903938.db2.gz RLUIHQJUOXOBOH-WMZOPIPTSA-N 1 1 332.444 3.732 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000743386509 1131907878 /nfs/dbraw/zinc/90/78/78/1131907878.db2.gz IXPAVGQUQFQKJR-SFHVURJKSA-N 1 1 328.416 3.928 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000743404698 1131917167 /nfs/dbraw/zinc/91/71/67/1131917167.db2.gz BQKOOTGWSMCVFX-SFHVURJKSA-N 1 1 343.431 3.713 20 5 EHBDMO COC(=O)[C@H]1CCCC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860263 1132582953 /nfs/dbraw/zinc/58/29/53/1132582953.db2.gz VYKFJNJSGUQUPC-YJBOKZPZSA-N 1 1 346.427 3.539 20 5 EHBDMO CCCCCC[C@](CC)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)C(=O)OCC ZINC001169006291 1132630226 /nfs/dbraw/zinc/63/02/26/1132630226.db2.gz GQLAKJPMLXMJQU-BQFCYCMXSA-N 1 1 342.480 3.704 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040029 1132638141 /nfs/dbraw/zinc/63/81/41/1132638141.db2.gz XCAHBRMZIXAPMC-YPMHNXCESA-N 1 1 328.334 3.509 20 5 EHBDMO CC[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC001169090076 1132660177 /nfs/dbraw/zinc/66/01/77/1132660177.db2.gz DYUSBGWJUHRQQB-KRWDZBQOSA-N 1 1 345.468 3.753 20 5 EHBDMO CCC1(CC)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC001175898880 1132792281 /nfs/dbraw/zinc/79/22/81/1132792281.db2.gz XKYRTBQGIKZHGW-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO CO[C@@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001169666275 1132813797 /nfs/dbraw/zinc/81/37/97/1132813797.db2.gz JMEVLRAYYSLEQZ-SFHVURJKSA-N 1 1 332.375 3.596 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804360385 1133064157 /nfs/dbraw/zinc/06/41/57/1133064157.db2.gz ILFAGDHELHBPAL-UHFFFAOYSA-N 1 1 325.840 3.805 20 5 EHBDMO CC(C)C[C@@H](C[NH+]1CCCC1)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001181933748 1133553189 /nfs/dbraw/zinc/55/31/89/1133553189.db2.gz OOJPQZMXJGFWEZ-HNNXBMFYSA-N 1 1 339.867 3.848 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1c(Cl)cc([N+](=O)[O-])cc1Cl)CC2 ZINC000772140665 1133647465 /nfs/dbraw/zinc/64/74/65/1133647465.db2.gz COZPUAMCDLHADP-UHFFFAOYSA-N 1 1 344.242 3.966 20 5 EHBDMO O=C(Nc1cc2cccnc2c2ncccc12)[C@@H]1CCC[N@H+]1CC1CC1 ZINC001182558715 1133697012 /nfs/dbraw/zinc/69/70/12/1133697012.db2.gz ZGHBIIOTNMGEQY-SFHVURJKSA-N 1 1 346.434 3.596 20 5 EHBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120055 1134081030 /nfs/dbraw/zinc/08/10/30/1134081030.db2.gz PQAPPXSIVUFZQG-TZMCWYRMSA-N 1 1 346.408 3.593 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886600 1134099970 /nfs/dbraw/zinc/09/99/70/1134099970.db2.gz WGAZCGAXJHFDSH-CJNGLKHVSA-N 1 1 341.367 3.881 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000788481271 1134130030 /nfs/dbraw/zinc/13/00/30/1134130030.db2.gz HFPCAGTVIXUVBJ-KRWDZBQOSA-N 1 1 343.402 3.835 20 5 EHBDMO CC1(C)CCC[N@@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC001186267469 1134190705 /nfs/dbraw/zinc/19/07/05/1134190705.db2.gz RFMZYEGXRXLPAQ-UHFFFAOYSA-N 1 1 328.416 3.677 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c2ccccc21 ZINC001186873537 1134264586 /nfs/dbraw/zinc/26/45/86/1134264586.db2.gz YFNDBCKTUNACBK-JKSUJKDBSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](CC3CCCCC3)CC2)c(F)c1 ZINC001190456577 1134703955 /nfs/dbraw/zinc/70/39/55/1134703955.db2.gz BGRLFOXHDKTYLQ-UHFFFAOYSA-N 1 1 349.450 3.822 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2Cc3cccc(C)c3C2)c([N+](=O)[O-])c1 ZINC001170328696 1134749357 /nfs/dbraw/zinc/74/93/57/1134749357.db2.gz LMKCUEZSAQWWST-AWEZNQCLSA-N 1 1 326.396 3.859 20 5 EHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443601 1134867801 /nfs/dbraw/zinc/86/78/01/1134867801.db2.gz CQSRDUZQAXIRIM-KXBFYZLASA-N 1 1 326.396 3.852 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2CCC(C)C)c([N+](=O)[O-])c1 ZINC001192157619 1134972106 /nfs/dbraw/zinc/97/21/06/1134972106.db2.gz HSPPPPCLWWYKRV-OAHLLOKOSA-N 1 1 336.432 3.883 20 5 EHBDMO Nc1ccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000804386698 1135052039 /nfs/dbraw/zinc/05/20/39/1135052039.db2.gz HFXUPWYHSHQWTH-MRXNPFEDSA-N 1 1 340.427 3.501 20 5 EHBDMO Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504171 1135093532 /nfs/dbraw/zinc/09/35/32/1135093532.db2.gz NMBHZFQLZVWSGQ-WDEREUQCSA-N 1 1 342.237 3.560 20 5 EHBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc(N)cc1[N+](=O)[O-] ZINC000804620747 1135143826 /nfs/dbraw/zinc/14/38/26/1135143826.db2.gz UJYWJDXANQMESV-GOSISDBHSA-N 1 1 342.443 3.746 20 5 EHBDMO Cc1cc(C)c2c(c1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC001193526056 1135152369 /nfs/dbraw/zinc/15/23/69/1135152369.db2.gz HEKVSHSSYYVLSG-UHFFFAOYSA-N 1 1 326.396 3.649 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250331 1135399367 /nfs/dbraw/zinc/39/93/67/1135399367.db2.gz MBUCTEKVNBDKTA-BBRMVZONSA-N 1 1 348.443 3.703 20 5 EHBDMO Cc1c(C[N@@H+]2CC[C@@H](C)[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495922 1135434115 /nfs/dbraw/zinc/43/41/15/1135434115.db2.gz AZTAXIBMQFYEQG-CZUORRHYSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCCC[C@@H](C)C1 ZINC000775732800 1135587622 /nfs/dbraw/zinc/58/76/22/1135587622.db2.gz WEUDHKFDKQGLAR-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCCC[C@@H](C)C1 ZINC000775732800 1135587625 /nfs/dbraw/zinc/58/76/25/1135587625.db2.gz WEUDHKFDKQGLAR-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001197203120 1135659250 /nfs/dbraw/zinc/65/92/50/1135659250.db2.gz RNMMTTNYWJOCTP-CQSZACIVSA-N 1 1 333.388 3.905 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H](CO)C(C)(C)C ZINC000809966023 1135904314 /nfs/dbraw/zinc/90/43/14/1135904314.db2.gz UCTCXOAEQXPYSX-GFCCVEGCSA-N 1 1 335.231 3.740 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1cccc(CO)c1 ZINC000811478954 1136096896 /nfs/dbraw/zinc/09/68/96/1136096896.db2.gz TVWYUBGLASCERS-UHFFFAOYSA-N 1 1 341.194 3.684 20 5 EHBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275029 1136129232 /nfs/dbraw/zinc/12/92/32/1136129232.db2.gz FOMIBXORJSPDOV-HZPDHXFCSA-N 1 1 332.425 3.699 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274372 1136129428 /nfs/dbraw/zinc/12/94/28/1136129428.db2.gz HFTLOTDYQPDFFQ-PIGZYNQJSA-N 1 1 336.338 3.599 20 5 EHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277951 1136130722 /nfs/dbraw/zinc/13/07/22/1136130722.db2.gz RCXCWRVQXBIEEE-OALUTQOASA-N 1 1 326.396 3.774 20 5 EHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277954 1136131058 /nfs/dbraw/zinc/13/10/58/1136131058.db2.gz RCXCWRVQXBIEEE-RTBURBONSA-N 1 1 326.396 3.774 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCCO1 ZINC000338924310 1136180503 /nfs/dbraw/zinc/18/05/03/1136180503.db2.gz HCHNXCVGBPOZOT-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585344 1136442488 /nfs/dbraw/zinc/44/24/88/1136442488.db2.gz WASMTHCBEOFIGG-FZKQIMNGSA-N 1 1 348.830 3.845 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588192 1136445963 /nfs/dbraw/zinc/44/59/63/1136445963.db2.gz MDZFVILGWLIJNP-ZNZDAUKMSA-N 1 1 344.386 3.850 20 5 EHBDMO CCc1ccc([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640859 1136487897 /nfs/dbraw/zinc/48/78/97/1136487897.db2.gz VCSRRZJLDAJTLW-QUCCMNQESA-N 1 1 340.423 3.680 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839900 1136895792 /nfs/dbraw/zinc/89/57/92/1136895792.db2.gz UENAJHQRQGOMMZ-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035858 1136934212 /nfs/dbraw/zinc/93/42/12/1136934212.db2.gz LVVHUJVNYVJDLT-GJZGRUSLSA-N 1 1 327.384 3.513 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707002 1137239184 /nfs/dbraw/zinc/23/91/84/1137239184.db2.gz SBKSBRWXHGQUMZ-HNNXBMFYSA-N 1 1 343.431 3.569 20 5 EHBDMO C[C@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1F ZINC000846013161 1137325996 /nfs/dbraw/zinc/32/59/96/1137325996.db2.gz KOEKBMHOFLKMOY-MGPLVRAMSA-N 1 1 338.766 3.599 20 5 EHBDMO CCC[C@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866564101 1137365049 /nfs/dbraw/zinc/36/50/49/1137365049.db2.gz VVTGGEUYLPQVCZ-AWEZNQCLSA-N 1 1 338.358 3.897 20 5 EHBDMO CC[C@]1(CO)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100396 1137483110 /nfs/dbraw/zinc/48/31/10/1137483110.db2.gz YSTMNSZSNCYSHO-HNNXBMFYSA-N 1 1 346.349 3.598 20 5 EHBDMO CC[C@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100396 1137483111 /nfs/dbraw/zinc/48/31/11/1137483111.db2.gz YSTMNSZSNCYSHO-HNNXBMFYSA-N 1 1 346.349 3.598 20 5 EHBDMO COCCOc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872025283 1137565691 /nfs/dbraw/zinc/56/56/91/1137565691.db2.gz JRSDYQJSGVOGRX-ZDUSSCGKSA-N 1 1 348.374 3.610 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nccnc2C)cc1[N+](=O)[O-] ZINC000872132410 1137573187 /nfs/dbraw/zinc/57/31/87/1137573187.db2.gz FUVGTGFHTSFFNE-AAEUAGOBSA-N 1 1 330.388 3.504 20 5 EHBDMO CC[N@H+](C)Cc1cccc(CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000873043912 1137588745 /nfs/dbraw/zinc/58/87/45/1137588745.db2.gz WLSPFXCARDRRLS-UHFFFAOYSA-N 1 1 327.428 3.645 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000873043912 1137588746 /nfs/dbraw/zinc/58/87/46/1137588746.db2.gz WLSPFXCARDRRLS-UHFFFAOYSA-N 1 1 327.428 3.645 20 5 EHBDMO CCC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878055940 1137700856 /nfs/dbraw/zinc/70/08/56/1137700856.db2.gz SDJOXOFSMTWBFM-UHFFFAOYSA-N 1 1 336.779 3.673 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]2CCCC[C@H]12 ZINC000878398808 1137714254 /nfs/dbraw/zinc/71/42/54/1137714254.db2.gz DMVRHLXQHOMSCM-NFAWXSAZSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399661 1137714406 /nfs/dbraw/zinc/71/44/06/1137714406.db2.gz PNGCDXXNPJEVBO-UGSOOPFHSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(C)([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)c1cccs1 ZINC000878420397 1137715232 /nfs/dbraw/zinc/71/52/32/1137715232.db2.gz PSAYNMOIOUUZBF-UHFFFAOYSA-N 1 1 344.396 3.731 20 5 EHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476033 1137717345 /nfs/dbraw/zinc/71/73/45/1137717345.db2.gz VJXRXJWQEBZFJR-OCCSQVGLSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3[C@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681206 1137755119 /nfs/dbraw/zinc/75/51/19/1137755119.db2.gz MLLAQDDASMJZCY-JZIBPQBNSA-N 1 1 342.399 3.758 20 5 EHBDMO COc1cccc2c1OCCC[C@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000883328312 1137855108 /nfs/dbraw/zinc/85/51/08/1137855108.db2.gz PHRHADWNPMZMKI-CYBMUJFWSA-N 1 1 334.397 3.668 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1OC ZINC000885927810 1138025666 /nfs/dbraw/zinc/02/56/66/1138025666.db2.gz YRMWCFBQGIYVTA-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885999935 1138031257 /nfs/dbraw/zinc/03/12/57/1138031257.db2.gz QBYSRTQAOYRUEW-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885999935 1138031259 /nfs/dbraw/zinc/03/12/59/1138031259.db2.gz QBYSRTQAOYRUEW-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000886114349 1138048208 /nfs/dbraw/zinc/04/82/08/1138048208.db2.gz NCBBOJDYYWECLX-JTQLQIEISA-N 1 1 341.289 3.739 20 5 EHBDMO CCOc1cccc2cc([C@@H](C)[NH2+]Cc3cccnc3[N+](=O)[O-])oc21 ZINC000886127853 1138049991 /nfs/dbraw/zinc/04/99/91/1138049991.db2.gz VFUJYKDDWBKUHN-GFCCVEGCSA-N 1 1 341.367 3.986 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])C(C)(C)C)cc1 ZINC000886209601 1138059484 /nfs/dbraw/zinc/05/94/84/1138059484.db2.gz PQIAKPUGHYDJPX-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCCC1 ZINC000073158370 1138111541 /nfs/dbraw/zinc/11/15/41/1138111541.db2.gz ICAFXODBHMMUOO-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000091413232 1138219431 /nfs/dbraw/zinc/21/94/31/1138219431.db2.gz SUQSJWCHIWQBAE-DIFFPNOSSA-N 1 1 336.338 3.911 20 5 EHBDMO Cc1cccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000336916604 1138427252 /nfs/dbraw/zinc/42/72/52/1138427252.db2.gz CKHQNVVUNBMGIY-OAHLLOKOSA-N 1 1 340.427 3.820 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000130909310 1138483637 /nfs/dbraw/zinc/48/36/37/1138483637.db2.gz UORRYHQCHVQFPW-OAHLLOKOSA-N 1 1 346.383 3.680 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)o1 ZINC000130909310 1138483638 /nfs/dbraw/zinc/48/36/38/1138483638.db2.gz UORRYHQCHVQFPW-OAHLLOKOSA-N 1 1 346.383 3.680 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337481897 1138581860 /nfs/dbraw/zinc/58/18/60/1138581860.db2.gz WGSLTBMDLOFFQO-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000338334614 1138838372 /nfs/dbraw/zinc/83/83/72/1138838372.db2.gz ZHMTWTYHQABGNT-UHFFFAOYSA-N 1 1 344.418 3.713 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607350 1139144140 /nfs/dbraw/zinc/14/41/40/1139144140.db2.gz YQPOBXYELWYWTR-JKSUJKDBSA-N 1 1 349.475 3.765 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281903 1139824336 /nfs/dbraw/zinc/82/43/36/1139824336.db2.gz BOLIXRGAGDXEAI-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281903 1139824346 /nfs/dbraw/zinc/82/43/46/1139824346.db2.gz BOLIXRGAGDXEAI-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO COC(=O)c1ccc(F)c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182119299 1139952271 /nfs/dbraw/zinc/95/22/71/1139952271.db2.gz RRJXSNOUFHRLFC-GFCCVEGCSA-N 1 1 346.358 3.680 20 5 EHBDMO Cc1nc(C[C@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744514 1139989837 /nfs/dbraw/zinc/98/98/37/1139989837.db2.gz BWLNLPPWYBNUAD-UKRRQHHQSA-N 1 1 344.415 3.610 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000269635593 1141129978 /nfs/dbraw/zinc/12/99/78/1141129978.db2.gz HJBHHNZIJWSCTR-IAGOWNOFSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000269635593 1141129980 /nfs/dbraw/zinc/12/99/80/1141129980.db2.gz HJBHHNZIJWSCTR-IAGOWNOFSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684239 1141135155 /nfs/dbraw/zinc/13/51/55/1141135155.db2.gz SHZCKIMIUIZJOO-QZTJIDSGSA-N 1 1 330.359 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1C(F)(F)F ZINC000270115625 1141181543 /nfs/dbraw/zinc/18/15/43/1141181543.db2.gz FQBLZPJCSCXVRW-JTQLQIEISA-N 1 1 340.305 3.721 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]1c1ccccc1 ZINC000348541161 1141548396 /nfs/dbraw/zinc/54/83/96/1141548396.db2.gz QQLHZEYAMTZNLR-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836521 1141592808 /nfs/dbraw/zinc/59/28/08/1141592808.db2.gz CTTFELHQISFOJS-INIZCTEOSA-N 1 1 347.459 3.599 20 5 EHBDMO COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349059079 1141630918 /nfs/dbraw/zinc/63/09/18/1141630918.db2.gz BFCNHDZQEILWAF-VBKFSLOCSA-N 1 1 341.411 3.542 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 ZINC000037775543 213165309 /nfs/dbraw/zinc/16/53/09/213165309.db2.gz PEZBCBXCQGTVDX-VIFPVBQESA-N 1 1 325.162 3.801 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000430207560 1014927789 /nfs/dbraw/zinc/92/77/89/1014927789.db2.gz MOTBYGKVJSUYGG-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000430207560 1014927799 /nfs/dbraw/zinc/92/77/99/1014927799.db2.gz MOTBYGKVJSUYGG-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215074 1015005952 /nfs/dbraw/zinc/00/59/52/1015005952.db2.gz HNVKSADAKNJLIP-ZDUSSCGKSA-N 1 1 349.456 3.994 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000430212315 1015006128 /nfs/dbraw/zinc/00/61/28/1015006128.db2.gz MASAEVPEBTUUBY-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000430212315 1015006142 /nfs/dbraw/zinc/00/61/42/1015006142.db2.gz MASAEVPEBTUUBY-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO CSc1ccc([C@H](CNCc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000339591223 1015091967 /nfs/dbraw/zinc/09/19/67/1015091967.db2.gz ZBLLICCHTYDZMI-SFHVURJKSA-N 1 1 345.468 3.709 20 5 EHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccc(O)c1 ZINC000471165707 1015183186 /nfs/dbraw/zinc/18/31/86/1015183186.db2.gz PXCYFRHWPPPERE-CQSZACIVSA-N 1 1 330.384 3.762 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000430242784 1015204631 /nfs/dbraw/zinc/20/46/31/1015204631.db2.gz SZCLYDFJPMYMFT-UHFFFAOYSA-N 1 1 342.395 3.721 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000430242784 1015204638 /nfs/dbraw/zinc/20/46/38/1015204638.db2.gz SZCLYDFJPMYMFT-UHFFFAOYSA-N 1 1 342.395 3.721 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@H](C)c1ccccc1 ZINC000066854382 1015778704 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1 334.441 3.820 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000189737445 1016699207 /nfs/dbraw/zinc/69/92/07/1016699207.db2.gz JBDSUJGBJGPVEV-QGZVFWFLSA-N 1 1 334.441 3.820 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835054 1032330841 /nfs/dbraw/zinc/33/08/41/1032330841.db2.gz ZGSGKAUHUBYGMZ-SJORKVTESA-N 1 1 333.476 3.922 20 5 EHBDMO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000584410000 1032442805 /nfs/dbraw/zinc/44/28/05/1032442805.db2.gz DVELGCDUSROAAN-OAHLLOKOSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cc(CO)cc([N+](=O)[O-])c2)cc1 ZINC000592987201 1032659506 /nfs/dbraw/zinc/65/95/06/1032659506.db2.gz WVGJLIYLYFYLQI-CQSZACIVSA-N 1 1 326.396 3.738 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000340978245 1017239093 /nfs/dbraw/zinc/23/90/93/1017239093.db2.gz UNRCCNJTKZAQSX-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000340978245 1017239104 /nfs/dbraw/zinc/23/91/04/1017239104.db2.gz UNRCCNJTKZAQSX-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)o1 ZINC000377237747 1017513227 /nfs/dbraw/zinc/51/32/27/1017513227.db2.gz JFZQRUOEUOTLIW-CABCVRRESA-N 1 1 342.395 3.713 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2cccnc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281277 1017608215 /nfs/dbraw/zinc/60/82/15/1017608215.db2.gz AHSLAZZDVOFQIO-DOMZBBRYSA-N 1 1 332.429 3.546 20 5 EHBDMO COCc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])ccc1F ZINC000892885756 1017649778 /nfs/dbraw/zinc/64/97/78/1017649778.db2.gz JYAGTMKUWUOTEX-UHFFFAOYSA-N 1 1 338.766 3.824 20 5 EHBDMO C[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761244956 1032733357 /nfs/dbraw/zinc/73/33/57/1032733357.db2.gz ZMQAUIWUHPSSMJ-UHFFFAOYSA-N 1 1 334.759 3.609 20 5 EHBDMO C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761244956 1032733372 /nfs/dbraw/zinc/73/33/72/1032733372.db2.gz ZMQAUIWUHPSSMJ-UHFFFAOYSA-N 1 1 334.759 3.609 20 5 EHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000052559549 1018999653 /nfs/dbraw/zinc/99/96/53/1018999653.db2.gz WDECQLFFWZDRQS-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO CCCCNC(=O)[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718429 1019737951 /nfs/dbraw/zinc/73/79/51/1019737951.db2.gz LAWUPBSGLNPYMT-HOTGVXAUSA-N 1 1 347.459 3.593 20 5 EHBDMO C[C@]1(O)CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000280181131 1020171401 /nfs/dbraw/zinc/17/14/01/1020171401.db2.gz SWFLTCBTFGBSMI-NRFANRHFSA-N 1 1 337.419 3.683 20 5 EHBDMO C[C@H]1CC[C@H]([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922881 1020243477 /nfs/dbraw/zinc/24/34/77/1020243477.db2.gz GDFGLRSNFKFCJM-GJZGRUSLSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@@H]1COC[C@H](c2ccccc2)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038369 1020674293 /nfs/dbraw/zinc/67/42/93/1020674293.db2.gz JFAJFLWKWHLHFY-DNVCBOLYSA-N 1 1 326.396 3.599 20 5 EHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000510416143 1020814375 /nfs/dbraw/zinc/81/43/75/1020814375.db2.gz SAJHBANFLOXJDI-ZDUSSCGKSA-N 1 1 348.374 3.993 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2[N+](=O)[O-])cc1 ZINC000507441012 1021254958 /nfs/dbraw/zinc/25/49/58/1021254958.db2.gz LIVPMRDOEGXSTR-HNNXBMFYSA-N 1 1 344.436 3.621 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@H](O)C3)cc2[N+](=O)[O-])cc1 ZINC000507441012 1021254963 /nfs/dbraw/zinc/25/49/63/1021254963.db2.gz LIVPMRDOEGXSTR-HNNXBMFYSA-N 1 1 344.436 3.621 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(c2ccccc2)CC1 ZINC000518582799 1021349473 /nfs/dbraw/zinc/34/94/73/1021349473.db2.gz XCMDCXZVEIAVMD-INIZCTEOSA-N 1 1 325.412 3.868 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477441002 1021689814 /nfs/dbraw/zinc/68/98/14/1021689814.db2.gz UECRGPUSHLTDGJ-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+](C)C(C)C)n1 ZINC000178173219 1021926785 /nfs/dbraw/zinc/92/67/85/1021926785.db2.gz JFFCZMPLTSBBBL-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCCc4sccc43)nc2c1 ZINC000602611333 1033025966 /nfs/dbraw/zinc/02/59/66/1033025966.db2.gz MULYRYHCUUJMFW-GFCCVEGCSA-N 1 1 329.381 3.965 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441353163 1022170651 /nfs/dbraw/zinc/17/06/51/1022170651.db2.gz GKKYYPSNKGKUJH-OAHLLOKOSA-N 1 1 325.840 3.554 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000441419765 1022290393 /nfs/dbraw/zinc/29/03/93/1022290393.db2.gz UIRQLMQUNMNMCR-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187579971 1022356170 /nfs/dbraw/zinc/35/61/70/1022356170.db2.gz NTHYTJTUZOGIFI-CXAGYDPISA-N 1 1 328.416 3.616 20 5 EHBDMO CC(C)([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000175984441 1022359840 /nfs/dbraw/zinc/35/98/40/1022359840.db2.gz NIQHGWWVCYTMPP-UHFFFAOYSA-N 1 1 344.802 3.921 20 5 EHBDMO C[N@@H+](CCCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000471819103 1022397878 /nfs/dbraw/zinc/39/78/78/1022397878.db2.gz BMDGEKPKJLSGDQ-UHFFFAOYSA-N 1 1 348.374 3.731 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000517552664 1022439431 /nfs/dbraw/zinc/43/94/31/1022439431.db2.gz VRQJLKYNZCHZEI-MRXNPFEDSA-N 1 1 333.476 3.928 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000441429211 1022533865 /nfs/dbraw/zinc/53/38/65/1022533865.db2.gz NQMMMCVNPUAKIZ-HNNXBMFYSA-N 1 1 344.411 3.545 20 5 EHBDMO COc1cc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184233622 1022589724 /nfs/dbraw/zinc/58/97/24/1022589724.db2.gz JOCTYIWNKJCBKK-BBRMVZONSA-N 1 1 340.420 3.603 20 5 EHBDMO COc1cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184233622 1022589734 /nfs/dbraw/zinc/58/97/34/1022589734.db2.gz JOCTYIWNKJCBKK-BBRMVZONSA-N 1 1 340.420 3.603 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000184238326 1022607444 /nfs/dbraw/zinc/60/74/44/1022607444.db2.gz STUGILVDBIETCO-LBPRGKRZSA-N 1 1 348.374 3.511 20 5 EHBDMO CC(C)CCOc1ccc([C@@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000341662918 1022916843 /nfs/dbraw/zinc/91/68/43/1022916843.db2.gz YPSRULGWPKGDQC-CQSZACIVSA-N 1 1 346.431 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@@H]4CCCC[C@@H]43)nc2c1 ZINC000610619594 1023011255 /nfs/dbraw/zinc/01/12/55/1023011255.db2.gz JAAPWJNVWHQAPU-DZGCQCFKSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@@H]4CCCC[C@@H]43)nc2c1 ZINC000610619594 1023011269 /nfs/dbraw/zinc/01/12/69/1023011269.db2.gz JAAPWJNVWHQAPU-DZGCQCFKSA-N 1 1 333.413 3.596 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1ccccc1)[C@@H]1CCCC1(C)C ZINC000426809714 1023060470 /nfs/dbraw/zinc/06/04/70/1023060470.db2.gz FRBKJEPUGVGQFY-QGZVFWFLSA-N 1 1 342.443 3.909 20 5 EHBDMO COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[C@H]1C ZINC000510793484 1023170706 /nfs/dbraw/zinc/17/07/06/1023170706.db2.gz YKZXDIKRJRZSLY-BDJLRTHQSA-N 1 1 328.359 3.510 20 5 EHBDMO COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[C@H]1C ZINC000510793484 1023170712 /nfs/dbraw/zinc/17/07/12/1023170712.db2.gz YKZXDIKRJRZSLY-BDJLRTHQSA-N 1 1 328.359 3.510 20 5 EHBDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000536417721 1023239959 /nfs/dbraw/zinc/23/99/59/1023239959.db2.gz XYVZCDZIYCUYPL-ZDUSSCGKSA-N 1 1 334.441 3.976 20 5 EHBDMO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000341794680 1023328202 /nfs/dbraw/zinc/32/82/02/1023328202.db2.gz COHZTHCCHMSEAS-LBPRGKRZSA-N 1 1 334.445 3.680 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000058976213 1033149699 /nfs/dbraw/zinc/14/96/99/1033149699.db2.gz BZJFNHGQTLEDHP-IBGZPJMESA-N 1 1 340.423 3.853 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000535799468 1023646652 /nfs/dbraw/zinc/64/66/52/1023646652.db2.gz QDNHRWUFFNRLCY-GJZGRUSLSA-N 1 1 342.443 3.863 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCCC[C@H]1CCO ZINC000342055165 1023806984 /nfs/dbraw/zinc/80/69/84/1023806984.db2.gz YXYCIDMTOBYPLY-INIZCTEOSA-N 1 1 336.432 3.509 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000602825200 1033193020 /nfs/dbraw/zinc/19/30/20/1033193020.db2.gz RGXIRRDYZJGMBF-BCDXTJNWSA-N 1 1 340.427 3.510 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574770777 1024294031 /nfs/dbraw/zinc/29/40/31/1024294031.db2.gz MFGROXVITNKHMT-MRXNPFEDSA-N 1 1 327.384 3.556 20 5 EHBDMO C[C@H]([N@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1)C(C)(C)C ZINC000346037183 1024297822 /nfs/dbraw/zinc/29/78/22/1024297822.db2.gz XNVRQTTWEDRHOC-AWEZNQCLSA-N 1 1 330.432 3.765 20 5 EHBDMO C[C@H]([N@@H+](Cc1c([N+](=O)[O-])ncn1C)Cc1ccccc1)C(C)(C)C ZINC000346037183 1024297834 /nfs/dbraw/zinc/29/78/34/1024297834.db2.gz XNVRQTTWEDRHOC-AWEZNQCLSA-N 1 1 330.432 3.765 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493037 /nfs/dbraw/zinc/49/30/37/1024493037.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493083 /nfs/dbraw/zinc/49/30/83/1024493083.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493087 /nfs/dbraw/zinc/49/30/87/1024493087.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 1 1 333.476 3.880 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948061 1025135499 /nfs/dbraw/zinc/13/54/99/1025135499.db2.gz QHTVJEGMJLQFPD-HZPDHXFCSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948061 1025135509 /nfs/dbraw/zinc/13/55/09/1025135509.db2.gz QHTVJEGMJLQFPD-HZPDHXFCSA-N 1 1 333.476 3.928 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C1CCCC1 ZINC000425440808 1025285573 /nfs/dbraw/zinc/28/55/73/1025285573.db2.gz CFJDDMVXZVKDGE-AWEZNQCLSA-N 1 1 328.416 3.834 20 5 EHBDMO C[C@@H]1CSCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425446070 1025307467 /nfs/dbraw/zinc/30/74/67/1025307467.db2.gz OPXURFOVKCNGQR-JTQLQIEISA-N 1 1 345.262 3.542 20 5 EHBDMO C[C@@H]1CSCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425446070 1025307479 /nfs/dbraw/zinc/30/74/79/1025307479.db2.gz OPXURFOVKCNGQR-JTQLQIEISA-N 1 1 345.262 3.542 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515549597 1025342779 /nfs/dbraw/zinc/34/27/79/1025342779.db2.gz FWKODALYVNAGBP-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3nccs3)C2)c(Cl)c1 ZINC000934332847 1025484583 /nfs/dbraw/zinc/48/45/83/1025484583.db2.gz MDKXFJSKDUIWGR-LLVKDONJSA-N 1 1 337.832 3.769 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896176 1025650024 /nfs/dbraw/zinc/65/00/24/1025650024.db2.gz BEHOEPNUEIXAFU-INIZCTEOSA-N 1 1 340.427 3.507 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195314 1025662829 /nfs/dbraw/zinc/66/28/29/1025662829.db2.gz JQBOFFQFEQVNIO-XJKSGUPXSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195314 1025662837 /nfs/dbraw/zinc/66/28/37/1025662837.db2.gz JQBOFFQFEQVNIO-XJKSGUPXSA-N 1 1 327.384 3.582 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425544177 1025703973 /nfs/dbraw/zinc/70/39/73/1025703973.db2.gz BTSWTBKYIUCRHH-KBXCAEBGSA-N 1 1 330.428 3.937 20 5 EHBDMO CCc1cc(CCC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)on1 ZINC000451543208 1026090810 /nfs/dbraw/zinc/09/08/10/1026090810.db2.gz BIEBIXJSJRVTDP-MRXNPFEDSA-N 1 1 343.427 3.957 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896940304 1026129573 /nfs/dbraw/zinc/12/95/73/1026129573.db2.gz XSYVMIPEDNFQAJ-NTEUORMPSA-N 1 1 338.411 3.588 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896940304 1026129575 /nfs/dbraw/zinc/12/95/75/1026129575.db2.gz XSYVMIPEDNFQAJ-NTEUORMPSA-N 1 1 338.411 3.588 20 5 EHBDMO C[C@H](C[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccc(F)cc1 ZINC000516220845 1026130350 /nfs/dbraw/zinc/13/03/50/1026130350.db2.gz BYPAAXUXVAFWEB-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000530663483 1026177811 /nfs/dbraw/zinc/17/78/11/1026177811.db2.gz OWBOTJYPFXFRAD-LJQANCHMSA-N 1 1 325.412 3.696 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1 ZINC000530663481 1026178081 /nfs/dbraw/zinc/17/80/81/1026178081.db2.gz OWBOTJYPFXFRAD-IBGZPJMESA-N 1 1 325.412 3.696 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2cccs2)on1 ZINC000511120016 1026205086 /nfs/dbraw/zinc/20/50/86/1026205086.db2.gz GUSWATXGEAKDGV-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2cccs2)on1 ZINC000511120016 1026205093 /nfs/dbraw/zinc/20/50/93/1026205093.db2.gz GUSWATXGEAKDGV-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000137512856 1026369512 /nfs/dbraw/zinc/36/95/12/1026369512.db2.gz KNTSUMGVDXLVHI-GJZGRUSLSA-N 1 1 326.400 3.546 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C2CC2)O1 ZINC000475282912 1026441666 /nfs/dbraw/zinc/44/16/66/1026441666.db2.gz VCOUGDBAKAQXCD-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C2CC2)O1 ZINC000475282912 1026441672 /nfs/dbraw/zinc/44/16/72/1026441672.db2.gz VCOUGDBAKAQXCD-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)C2)cc1OC ZINC001167602808 1027008905 /nfs/dbraw/zinc/00/89/05/1027008905.db2.gz QFMDWKXLGQLWAC-UONOGXRCSA-N 1 1 336.432 3.870 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531587377 1027077086 /nfs/dbraw/zinc/07/70/86/1027077086.db2.gz BLPDUFXNSJORRC-KXBFYZLASA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531587377 1027077089 /nfs/dbraw/zinc/07/70/89/1027077089.db2.gz BLPDUFXNSJORRC-KXBFYZLASA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413172859 1027212586 /nfs/dbraw/zinc/21/25/86/1027212586.db2.gz GCZXUORFIXRFPA-UKRRQHHQSA-N 1 1 344.390 3.594 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000277845606 1027250059 /nfs/dbraw/zinc/25/00/59/1027250059.db2.gz SMMASRNHWLXDDK-ZOWXZIJZSA-N 1 1 346.349 3.599 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000078336384 1027681819 /nfs/dbraw/zinc/68/18/19/1027681819.db2.gz HEUWFOXVZFNUNW-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429055 1027859295 /nfs/dbraw/zinc/85/92/95/1027859295.db2.gz BCMKPZMBCNLTSC-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429055 1027859313 /nfs/dbraw/zinc/85/93/13/1027859313.db2.gz BCMKPZMBCNLTSC-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174411 1027912241 /nfs/dbraw/zinc/91/22/41/1027912241.db2.gz KBGUSJPUKPPFAH-CQSZACIVSA-N 1 1 334.322 3.526 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174411 1027912256 /nfs/dbraw/zinc/91/22/56/1027912256.db2.gz KBGUSJPUKPPFAH-CQSZACIVSA-N 1 1 334.322 3.526 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174576 1027912692 /nfs/dbraw/zinc/91/26/92/1027912692.db2.gz IUNWSAUQCFZRMA-CJNGLKHVSA-N 1 1 330.359 3.948 20 5 EHBDMO CCc1ccc([C@@H](N[C@@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407727 1028073645 /nfs/dbraw/zinc/07/36/45/1028073645.db2.gz ZFDRGSCLYMENOR-BEFAXECRSA-N 1 1 343.427 3.523 20 5 EHBDMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496888 1028085805 /nfs/dbraw/zinc/08/58/05/1028085805.db2.gz TUFRHUSGOXDCPR-DOTOQJQBSA-N 1 1 344.390 3.766 20 5 EHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636457 1028087298 /nfs/dbraw/zinc/08/72/98/1028087298.db2.gz DIKBJSFOCJYLQY-AWEZNQCLSA-N 1 1 338.411 3.843 20 5 EHBDMO C[C@H](N[C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144925 1028206991 /nfs/dbraw/zinc/20/69/91/1028206991.db2.gz IITODWJQSXXXPY-YJLNNSPDSA-N 1 1 325.412 3.739 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](C(C)C)C1 ZINC000444749215 1028237203 /nfs/dbraw/zinc/23/72/03/1028237203.db2.gz QOPYCIOTSDTLHZ-HNNXBMFYSA-N 1 1 333.432 3.600 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](CN)C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263494 1028300511 /nfs/dbraw/zinc/30/05/11/1028300511.db2.gz ONIYCTQSCNLKDS-BBRMVZONSA-N 1 1 335.448 3.552 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000523449326 1028343341 /nfs/dbraw/zinc/34/33/41/1028343341.db2.gz FQBZTLIPAHCQKL-MRXNPFEDSA-N 1 1 342.370 3.829 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000523449326 1028343359 /nfs/dbraw/zinc/34/33/59/1028343359.db2.gz FQBZTLIPAHCQKL-MRXNPFEDSA-N 1 1 342.370 3.829 20 5 EHBDMO CCc1ccc([C@H](N[C@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456740 1028449163 /nfs/dbraw/zinc/44/91/63/1028449163.db2.gz OEPGIVILPAXUCI-FZKQIMNGSA-N 1 1 331.416 3.557 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC000523790737 1028606205 /nfs/dbraw/zinc/60/62/05/1028606205.db2.gz XHMRWTWFJFHRRD-SFHVURJKSA-N 1 1 344.436 3.764 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895987 1029043077 /nfs/dbraw/zinc/04/30/77/1029043077.db2.gz WQJPLFVKAOLWEM-CVEARBPZSA-N 1 1 349.475 3.765 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000532970069 1029119708 /nfs/dbraw/zinc/11/97/08/1029119708.db2.gz UKWAFLRJDVOPSI-CQSZACIVSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000524757214 1029488949 /nfs/dbraw/zinc/48/89/49/1029488949.db2.gz PLEHPLUSESAAIB-BEFAXECRSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000524757214 1029488955 /nfs/dbraw/zinc/48/89/55/1029488955.db2.gz PLEHPLUSESAAIB-BEFAXECRSA-N 1 1 326.396 3.865 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122506 1029694904 /nfs/dbraw/zinc/69/49/04/1029694904.db2.gz IIDXBUDFIRTVRO-ZDUSSCGKSA-N 1 1 349.456 3.994 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000282059897 1029721253 /nfs/dbraw/zinc/72/12/53/1029721253.db2.gz MOUVGIPNKBJTIM-MRXNPFEDSA-N 1 1 340.427 3.507 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc(F)cc1[N+](=O)[O-] ZINC000525357042 1029809148 /nfs/dbraw/zinc/80/91/48/1029809148.db2.gz CVDDRSUYKHGXJL-OAHLLOKOSA-N 1 1 343.402 3.835 20 5 EHBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525409446 1029840407 /nfs/dbraw/zinc/84/04/07/1029840407.db2.gz ZWWZRGJZHAADCE-OLMNPRSZSA-N 1 1 348.443 3.629 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CC1 ZINC000159425115 1030197628 /nfs/dbraw/zinc/19/76/28/1030197628.db2.gz PIXLQCCWHHSVPZ-UHFFFAOYSA-N 1 1 327.222 3.978 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367741 1030183486 /nfs/dbraw/zinc/18/34/86/1030183486.db2.gz MKRZPQMBHNLCGY-QRFRQXIXSA-N 1 1 344.455 3.809 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCCO1 ZINC000482286606 1030307621 /nfs/dbraw/zinc/30/76/21/1030307621.db2.gz HAWNXVDHYGHUJC-HNNXBMFYSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000472297619 1030380013 /nfs/dbraw/zinc/38/00/13/1030380013.db2.gz WBIXLBSAGRSCPS-CYBMUJFWSA-N 1 1 329.400 3.913 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691256 1030588028 /nfs/dbraw/zinc/58/80/28/1030588028.db2.gz GHNMILYFGPUNRQ-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243073 1030732091 /nfs/dbraw/zinc/73/20/91/1030732091.db2.gz MTEQUISHTPKSTK-OAHLLOKOSA-N 1 1 330.359 3.732 20 5 EHBDMO COc1ccc(OCC[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073330 1030939641 /nfs/dbraw/zinc/93/96/41/1030939641.db2.gz XVXJDYUZOQPIGB-LIRRHRJNSA-N 1 1 342.395 3.675 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC(C)(C)C1 ZINC000483097481 1030951326 /nfs/dbraw/zinc/95/13/26/1030951326.db2.gz MNSQXKFZQVDAMP-GFCCVEGCSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000343480813 1031064432 /nfs/dbraw/zinc/06/44/32/1031064432.db2.gz ZWIBCAIETKYGFA-CQSZACIVSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cn1 ZINC000902853063 1031132468 /nfs/dbraw/zinc/13/24/68/1031132468.db2.gz IHBFVOPLTNARLJ-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1F ZINC000278525705 1031228705 /nfs/dbraw/zinc/22/87/05/1031228705.db2.gz TVSIDTZVTMKXKV-LLVKDONJSA-N 1 1 333.319 3.801 20 5 EHBDMO Cc1cccc(C[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000428718112 1031381217 /nfs/dbraw/zinc/38/12/17/1031381217.db2.gz GFDRHKSNAHYBFB-UHFFFAOYSA-N 1 1 342.395 3.710 20 5 EHBDMO Cc1cccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000428718112 1031381229 /nfs/dbraw/zinc/38/12/29/1031381229.db2.gz GFDRHKSNAHYBFB-UHFFFAOYSA-N 1 1 342.395 3.710 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026223915 1031388086 /nfs/dbraw/zinc/38/80/86/1031388086.db2.gz CSLFYIAGTYRYGO-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343627830 1031701971 /nfs/dbraw/zinc/70/19/71/1031701971.db2.gz UUDQAYMRTQHKOB-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343627830 1031701980 /nfs/dbraw/zinc/70/19/80/1031701980.db2.gz UUDQAYMRTQHKOB-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737964 1031703842 /nfs/dbraw/zinc/70/38/42/1031703842.db2.gz HERGFMCDWSRMQA-JHJVBQTASA-N 1 1 330.388 3.511 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000584247917 1032017031 /nfs/dbraw/zinc/01/70/31/1032017031.db2.gz RVJGHPVDMBYFEB-INIZCTEOSA-N 1 1 330.432 3.834 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071953 1033324326 /nfs/dbraw/zinc/32/43/26/1033324326.db2.gz VNRSXUGSAJGJDY-MFBWXBCUSA-N 1 1 329.425 3.629 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1F ZINC000593610717 1033442135 /nfs/dbraw/zinc/44/21/35/1033442135.db2.gz AFTQYQKUBCQEHQ-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000594614741 1033477759 /nfs/dbraw/zinc/47/77/59/1033477759.db2.gz JWMLRAZKXKHOLW-LBPRGKRZSA-N 1 1 332.425 3.669 20 5 EHBDMO COCc1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000179241348 1033492528 /nfs/dbraw/zinc/49/25/28/1033492528.db2.gz UOLOINGDDOHJLW-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO COCc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000179241348 1033492533 /nfs/dbraw/zinc/49/25/33/1033492533.db2.gz UOLOINGDDOHJLW-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292783 1033556309 /nfs/dbraw/zinc/55/63/09/1033556309.db2.gz NEMYBXOUWMBCEA-RDJZCZTQSA-N 1 1 346.456 3.570 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCc2c1cccc2O ZINC000595013879 1033606750 /nfs/dbraw/zinc/60/67/50/1033606750.db2.gz USDHYGMOIIUNDW-ZBEGNZNMSA-N 1 1 328.368 3.647 20 5 EHBDMO C[N@@H+]1CCCC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068691 1033709221 /nfs/dbraw/zinc/70/92/21/1033709221.db2.gz CJHMXCIVKJMZTQ-KDOFPFPSSA-N 1 1 331.460 3.639 20 5 EHBDMO C[N@H+]1CCCC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068691 1033709238 /nfs/dbraw/zinc/70/92/38/1033709238.db2.gz CJHMXCIVKJMZTQ-KDOFPFPSSA-N 1 1 331.460 3.639 20 5 EHBDMO CCc1ccc([C@@H]2CCC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2)cc1 ZINC000595481786 1033807732 /nfs/dbraw/zinc/80/77/32/1033807732.db2.gz AVXGCRKHHIQODY-MRXNPFEDSA-N 1 1 329.400 3.833 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593714846 1033821111 /nfs/dbraw/zinc/82/11/11/1033821111.db2.gz CISZPBQBTKJFCB-VXNCWWDNSA-N 1 1 342.395 3.749 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1COc2ccccc2O1 ZINC000603838771 1033950857 /nfs/dbraw/zinc/95/08/57/1033950857.db2.gz HWYGQQXPKVOZCW-INIZCTEOSA-N 1 1 342.395 3.565 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000603859569 1033985373 /nfs/dbraw/zinc/98/53/73/1033985373.db2.gz CHFJCKHRSGXOMX-GASCZTMLSA-N 1 1 342.443 3.923 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2(C)C)c1[N+](=O)[O-] ZINC000599630711 1034055861 /nfs/dbraw/zinc/05/58/61/1034055861.db2.gz UWUDZXQGHKNUBJ-CQSZACIVSA-N 1 1 333.363 3.798 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012698 1034135033 /nfs/dbraw/zinc/13/50/33/1034135033.db2.gz SWEIBASRFWZULU-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596307889 1034162789 /nfs/dbraw/zinc/16/27/89/1034162789.db2.gz QDUZMCHGAHCXLB-CYBMUJFWSA-N 1 1 333.432 3.720 20 5 EHBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccccc1 ZINC000534133314 1034176534 /nfs/dbraw/zinc/17/65/34/1034176534.db2.gz FEFCJTOFZYSFLD-INIZCTEOSA-N 1 1 343.427 3.620 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOc2ccc(O)cc2C1 ZINC000597232759 1034613067 /nfs/dbraw/zinc/61/30/67/1034613067.db2.gz WWWXWLHJKCQHDP-ZROIWOOFSA-N 1 1 340.379 3.598 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOc2ccc(O)cc2C1 ZINC000597232759 1034613073 /nfs/dbraw/zinc/61/30/73/1034613073.db2.gz WWWXWLHJKCQHDP-ZROIWOOFSA-N 1 1 340.379 3.598 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2(CCOCC2)[C@H]1C ZINC000612540180 1035044177 /nfs/dbraw/zinc/04/41/77/1035044177.db2.gz CBNNNOBZJPTFAT-OAHLLOKOSA-N 1 1 348.443 3.773 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])cc1F ZINC000463484350 1035551204 /nfs/dbraw/zinc/55/12/04/1035551204.db2.gz MCOFMUVYKJWUHH-UHFFFAOYSA-N 1 1 336.338 3.556 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](O)C1CC1 ZINC000589197907 1036303282 /nfs/dbraw/zinc/30/32/82/1036303282.db2.gz APKPXVZOYXLAPY-MRXNPFEDSA-N 1 1 332.425 3.526 20 5 EHBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCCCC1 ZINC000030971742 1036330628 /nfs/dbraw/zinc/33/06/28/1036330628.db2.gz VLDXBWTZHBWVLH-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](C)c2cccs2)c1 ZINC000589496328 1036440604 /nfs/dbraw/zinc/44/06/04/1036440604.db2.gz NSWFPBVGQAAJBM-LLVKDONJSA-N 1 1 334.397 3.636 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)c2cccs2)c1 ZINC000589496328 1036440608 /nfs/dbraw/zinc/44/06/08/1036440608.db2.gz NSWFPBVGQAAJBM-LLVKDONJSA-N 1 1 334.397 3.636 20 5 EHBDMO O=[N+]([O-])c1sccc1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000609132774 1036468809 /nfs/dbraw/zinc/46/88/09/1036468809.db2.gz QFNJWBMXHRBTTE-HNNXBMFYSA-N 1 1 331.441 3.633 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000589519799 1036487537 /nfs/dbraw/zinc/48/75/37/1036487537.db2.gz ANUWUELLRUGZPY-FUIJVIPGSA-N 1 1 346.818 3.795 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000170914139 1036494908 /nfs/dbraw/zinc/49/49/08/1036494908.db2.gz IOZADILFLUJVGL-AWEZNQCLSA-N 1 1 329.400 3.914 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1CO ZINC000191179488 1036696847 /nfs/dbraw/zinc/69/68/47/1036696847.db2.gz JEGGOZVALSRULW-BLLLJJGKSA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCCC[C@@H]2CCO)c1 ZINC000590180599 1036790149 /nfs/dbraw/zinc/79/01/49/1036790149.db2.gz LDQPXJAIFDMYAI-CYBMUJFWSA-N 1 1 346.349 3.741 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@H](C)C1 ZINC000443663759 1036978306 /nfs/dbraw/zinc/97/83/06/1036978306.db2.gz YVLVVXCRERNYMZ-KBPBESRZSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000462461799 1036992904 /nfs/dbraw/zinc/99/29/04/1036992904.db2.gz FKMLQZBYFGYBQT-OAHLLOKOSA-N 1 1 345.468 3.578 20 5 EHBDMO C[C@H](c1ccsc1)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000462461799 1036992915 /nfs/dbraw/zinc/99/29/15/1036992915.db2.gz FKMLQZBYFGYBQT-OAHLLOKOSA-N 1 1 345.468 3.578 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(Cl)cc1 ZINC000007266167 1037022870 /nfs/dbraw/zinc/02/28/70/1037022870.db2.gz XPNAAZZVALNCBV-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000007266167 1037022885 /nfs/dbraw/zinc/02/28/85/1037022885.db2.gz XPNAAZZVALNCBV-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO Cn1cc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C)cn1 ZINC000542053367 1037033190 /nfs/dbraw/zinc/03/31/90/1037033190.db2.gz NUBIWXZQMOKSLL-OAHLLOKOSA-N 1 1 336.823 3.859 20 5 EHBDMO C[C@@H](NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135631 1037087252 /nfs/dbraw/zinc/08/72/52/1037087252.db2.gz AJQSHDVZEQQYCE-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H](NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135631 1037087274 /nfs/dbraw/zinc/08/72/74/1037087274.db2.gz AJQSHDVZEQQYCE-VQIMIIECSA-N 1 1 339.439 3.595 20 5 EHBDMO CCOc1cccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000180695461 1037088564 /nfs/dbraw/zinc/08/85/64/1037088564.db2.gz ZZTSMQMNPMOAJW-GFCCVEGCSA-N 1 1 341.367 3.986 20 5 EHBDMO Cc1ccc(-c2noc([C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206328 1037125660 /nfs/dbraw/zinc/12/56/60/1037125660.db2.gz WFRXGZGNSDPHSO-FRRDWIJNSA-N 1 1 330.388 3.887 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000532518772 1037559143 /nfs/dbraw/zinc/55/91/43/1037559143.db2.gz UWNOFEHWLFBNRQ-LSDHHAIUSA-N 1 1 341.411 3.657 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198795 1037944627 /nfs/dbraw/zinc/94/46/27/1037944627.db2.gz VEMHYIQHBODJLP-QGZVFWFLSA-N 1 1 332.400 3.616 20 5 EHBDMO CC[N@H+](CCSC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592529401 1038029772 /nfs/dbraw/zinc/02/97/72/1038029772.db2.gz ONDDKXFSOLKGQI-UHFFFAOYSA-N 1 1 337.470 3.903 20 5 EHBDMO CC[N@@H+](CCSC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592529401 1038029791 /nfs/dbraw/zinc/02/97/91/1038029791.db2.gz ONDDKXFSOLKGQI-UHFFFAOYSA-N 1 1 337.470 3.903 20 5 EHBDMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665181 1038500182 /nfs/dbraw/zinc/50/01/82/1038500182.db2.gz MXTWDYUMFMDDLD-HOCLYGCPSA-N 1 1 326.400 3.546 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301453 1039086697 /nfs/dbraw/zinc/08/66/97/1039086697.db2.gz SDTQVNIZJGDDFK-OAHLLOKOSA-N 1 1 346.408 3.860 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301453 1039086716 /nfs/dbraw/zinc/08/67/16/1039086716.db2.gz SDTQVNIZJGDDFK-OAHLLOKOSA-N 1 1 346.408 3.860 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000488687399 1039333772 /nfs/dbraw/zinc/33/37/72/1039333772.db2.gz ZPGZNLJVKWKDFJ-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@H]1COc2ccccc2O1 ZINC000485769517 1039523464 /nfs/dbraw/zinc/52/34/64/1039523464.db2.gz YIKNZJGCPMBQNF-ZBFHGGJFSA-N 1 1 342.395 3.736 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000485769514 1039524105 /nfs/dbraw/zinc/52/41/05/1039524105.db2.gz YIKNZJGCPMBQNF-GDBMZVCRSA-N 1 1 342.395 3.736 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298581 1039814672 /nfs/dbraw/zinc/81/46/72/1039814672.db2.gz WZEQYKDAVIBUKV-RYUDHWBXSA-N 1 1 341.839 3.943 20 5 EHBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)CCO2 ZINC000614100925 1040119109 /nfs/dbraw/zinc/11/91/09/1040119109.db2.gz DEHQFIWOEJXUAJ-KRWDZBQOSA-N 1 1 346.358 3.746 20 5 EHBDMO C[C@@H]1C[C@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@H+]1Cc1ccccc1 ZINC000511649214 1040400586 /nfs/dbraw/zinc/40/05/86/1040400586.db2.gz WCRKZIVYPNTJCS-WBVHZDCISA-N 1 1 340.427 3.702 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000490355376 1040523732 /nfs/dbraw/zinc/52/37/32/1040523732.db2.gz RVLZOBDLRYCXMO-KUHUBIRLSA-N 1 1 326.396 3.902 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(C)COC1 ZINC000600189641 1040798911 /nfs/dbraw/zinc/79/89/11/1040798911.db2.gz IIWAHLFKFZNEKZ-UHFFFAOYSA-N 1 1 332.425 3.792 20 5 EHBDMO CCCN1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155871 1040938205 /nfs/dbraw/zinc/93/82/05/1040938205.db2.gz ZRXMXAKKYSYUOP-SFHVURJKSA-N 1 1 331.460 3.781 20 5 EHBDMO COCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433192870 1041039842 /nfs/dbraw/zinc/03/98/42/1041039842.db2.gz NIPYQCVJOWFMTD-CQSZACIVSA-N 1 1 344.864 3.592 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000014929917 1042656391 /nfs/dbraw/zinc/65/63/91/1042656391.db2.gz SCMZBBKALMQFLX-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO Cc1ccccc1[C@@H](C)[N@H+](Cc1c([N+](=O)[O-])ncn1C)CC(C)C ZINC000342067409 1042801542 /nfs/dbraw/zinc/80/15/42/1042801542.db2.gz SITALTKDSACGOS-OAHLLOKOSA-N 1 1 330.432 3.856 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898518 1043598942 /nfs/dbraw/zinc/59/89/42/1043598942.db2.gz YMKUBPLKMLTKQD-KDOFPFPSSA-N 1 1 328.416 3.926 20 5 EHBDMO CCCCn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(C)n1 ZINC000344326325 1043655634 /nfs/dbraw/zinc/65/56/34/1043655634.db2.gz IZTMBQLWZSBCMI-UHFFFAOYSA-N 1 1 336.823 3.843 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c1 ZINC000444792673 1127529639 /nfs/dbraw/zinc/52/96/39/1127529639.db2.gz FDTGEDXBUFABNB-MRXNPFEDSA-N 1 1 334.807 3.672 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H](O)C34CCCC4)o2)c1 ZINC000552316937 1127749155 /nfs/dbraw/zinc/74/91/55/1127749155.db2.gz UQFHBRARUIUHOQ-GOSISDBHSA-N 1 1 342.395 3.734 20 5 EHBDMO COC[C@@H]1CC[N@@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000552314401 1127749188 /nfs/dbraw/zinc/74/91/88/1127749188.db2.gz OOWVRRJLOQOWPC-KRWDZBQOSA-N 1 1 341.411 3.583 20 5 EHBDMO COC[C@@H]1CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000552314401 1127749190 /nfs/dbraw/zinc/74/91/90/1127749190.db2.gz OOWVRRJLOQOWPC-KRWDZBQOSA-N 1 1 341.411 3.583 20 5 EHBDMO Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])cc3C)CC2)[nH+]c1 ZINC000301478403 1128467651 /nfs/dbraw/zinc/46/76/51/1128467651.db2.gz QFBFNHVDGAWNNK-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO Cc1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301545487 1128495802 /nfs/dbraw/zinc/49/58/02/1128495802.db2.gz OSLFSWVMLAQOJF-DOTOQJQBSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C)[C@@H](C)C1 ZINC000123078930 1128562672 /nfs/dbraw/zinc/56/26/72/1128562672.db2.gz XWJJRVJVCAPJGK-AVGNSLFASA-N 1 1 330.388 3.684 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000338739710 1128803814 /nfs/dbraw/zinc/80/38/14/1128803814.db2.gz CVQMOFLISNROHZ-OAHLLOKOSA-N 1 1 343.349 3.536 20 5 EHBDMO Cc1ccnc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000301685434 1128915071 /nfs/dbraw/zinc/91/50/71/1128915071.db2.gz VKBVJBFHRMFPRX-MRXNPFEDSA-N 1 1 346.475 3.779 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)c2c(F)cccc2F)C2CC2)c1 ZINC000153273226 1120933599 /nfs/dbraw/zinc/93/35/99/1120933599.db2.gz NUNMYXXLCUQYKX-KRWDZBQOSA-N 1 1 348.349 3.571 20 5 EHBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000763112298 1121684863 /nfs/dbraw/zinc/68/48/63/1121684863.db2.gz GYCRZCIMKLGZRC-UHFFFAOYSA-N 1 1 345.399 3.644 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609234598 1121858965 /nfs/dbraw/zinc/85/89/65/1121858965.db2.gz XHXKVTAMOJODDN-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609234598 1121858973 /nfs/dbraw/zinc/85/89/73/1121858973.db2.gz XHXKVTAMOJODDN-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO CC(C)OC(=O)C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000272786591 1122231780 /nfs/dbraw/zinc/23/17/80/1122231780.db2.gz BJVMIPBFAKIBHG-HNNXBMFYSA-N 1 1 348.424 3.829 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154366846 1122583683 /nfs/dbraw/zinc/58/36/83/1122583683.db2.gz JODXWICKXRABEQ-HKUYNNGSSA-N 1 1 328.412 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000498889413 1123103102 /nfs/dbraw/zinc/10/31/02/1123103102.db2.gz BYCMVJRJIRIMLV-UHFFFAOYSA-N 1 1 342.395 3.591 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(Cc2ccccc2)CC1 ZINC000074322116 1123291703 /nfs/dbraw/zinc/29/17/03/1123291703.db2.gz AQEKYWIGZCLROF-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(Cc2ccccc2)CC1 ZINC000074322116 1123291708 /nfs/dbraw/zinc/29/17/08/1123291708.db2.gz AQEKYWIGZCLROF-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO COc1ccccc1OCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350602 1123573335 /nfs/dbraw/zinc/57/33/35/1123573335.db2.gz KDQRZJMRZJIULX-UHFFFAOYSA-N 1 1 344.411 3.893 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672694 1123641578 /nfs/dbraw/zinc/64/15/78/1123641578.db2.gz XXCWCCCRXYAPRV-NVXWUHKLSA-N 1 1 326.396 3.852 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000114468433 1129149178 /nfs/dbraw/zinc/14/91/78/1129149178.db2.gz KQZJQEWFKBTXGV-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000114468433 1129149181 /nfs/dbraw/zinc/14/91/81/1129149181.db2.gz KQZJQEWFKBTXGV-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000180842852 1124087896 /nfs/dbraw/zinc/08/78/96/1124087896.db2.gz YRBBPGRTLSUWMZ-ZDUSSCGKSA-N 1 1 340.358 3.770 20 5 EHBDMO CC(C)c1ccc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000526306376 1129200929 /nfs/dbraw/zinc/20/09/29/1129200929.db2.gz DYNWAJZUDLEOMY-UHFFFAOYSA-N 1 1 347.459 3.665 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000301878815 1129252109 /nfs/dbraw/zinc/25/21/09/1129252109.db2.gz ORELWPSNDJSXRK-GDBMZVCRSA-N 1 1 332.791 3.501 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920387 1129365797 /nfs/dbraw/zinc/36/57/97/1129365797.db2.gz DUNUAIVXJGJKQZ-NEPJUHHUSA-N 1 1 343.374 3.729 20 5 EHBDMO CCc1ccc([C@@H](NCCCC[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403882 1129464190 /nfs/dbraw/zinc/46/41/90/1129464190.db2.gz FIBGCEGNJREGCX-IBGZPJMESA-N 1 1 345.443 3.771 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(C)cc1OC ZINC000543427804 1129482273 /nfs/dbraw/zinc/48/22/73/1129482273.db2.gz UDWCRCHUSUTSDF-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO Cc1nn(C)c(Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1[N+](=O)[O-] ZINC000301986042 1129486171 /nfs/dbraw/zinc/48/61/71/1129486171.db2.gz JVGQTNLMHQHSLD-CYBMUJFWSA-N 1 1 343.431 3.755 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155214249 1129619526 /nfs/dbraw/zinc/61/95/26/1129619526.db2.gz HNVBDBSFRRNCRH-KRWDZBQOSA-N 1 1 326.396 3.635 20 5 EHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302061815 1129765969 /nfs/dbraw/zinc/76/59/69/1129765969.db2.gz UCGFKJRVXKVLCK-STQMWFEESA-N 1 1 348.403 3.568 20 5 EHBDMO Cc1cc(N[C@@H]2CCC[C@@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302087607 1129767337 /nfs/dbraw/zinc/76/73/37/1129767337.db2.gz OAHDQMBRHPHEQD-ZIAGYGMSSA-N 1 1 328.416 3.736 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000302777197 1129791309 /nfs/dbraw/zinc/79/13/09/1129791309.db2.gz FYQJSVMMDNVBLF-ZDUSSCGKSA-N 1 1 347.365 3.756 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000766027953 1129839701 /nfs/dbraw/zinc/83/97/01/1129839701.db2.gz QHZJTLKXTKLMFU-UHFFFAOYSA-N 1 1 344.440 3.918 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303532713 1129852678 /nfs/dbraw/zinc/85/26/78/1129852678.db2.gz GEDUDFAOOCLTPT-DNVCBOLYSA-N 1 1 343.427 3.744 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000303584877 1129857335 /nfs/dbraw/zinc/85/73/35/1129857335.db2.gz FVMHXMNALOUFJY-HNNXBMFYSA-N 1 1 333.432 3.682 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000133587754 1129953918 /nfs/dbraw/zinc/95/39/18/1129953918.db2.gz NDFLOTNZLVAZKD-FZMZJTMJSA-N 1 1 343.349 3.534 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000059406177 1129986734 /nfs/dbraw/zinc/98/67/34/1129986734.db2.gz PNHFREHVKXGXAH-IBGZPJMESA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)c1 ZINC000059406177 1129986738 /nfs/dbraw/zinc/98/67/38/1129986738.db2.gz PNHFREHVKXGXAH-IBGZPJMESA-N 1 1 344.386 3.915 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1c1cccn1C ZINC000175125217 1130408674 /nfs/dbraw/zinc/40/86/74/1130408674.db2.gz QFIJOCJXGNEEKL-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000175125217 1130408677 /nfs/dbraw/zinc/40/86/77/1130408677.db2.gz QFIJOCJXGNEEKL-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892951 1130858202 /nfs/dbraw/zinc/85/82/02/1130858202.db2.gz LDMRXZVQNJNGRD-GQIGUUNPSA-N 1 1 340.423 3.988 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000742154510 1131694287 /nfs/dbraw/zinc/69/42/87/1131694287.db2.gz KMEYHTLHRXOUIZ-LSDHHAIUSA-N 1 1 328.416 3.926 20 5 EHBDMO CC[N@@H+](CC(=O)OC(C)(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921779 1131905863 /nfs/dbraw/zinc/90/58/63/1131905863.db2.gz SYTJZYDYWGZZPD-MRXNPFEDSA-N 1 1 348.443 3.506 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H]3CCC[C@H]3C2)c1F ZINC001173178278 1131992270 /nfs/dbraw/zinc/99/22/70/1131992270.db2.gz ACFXDYLKKMQTEN-MJBXVCDLSA-N 1 1 336.407 3.796 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2Cl)COC1 ZINC001173220867 1132004692 /nfs/dbraw/zinc/00/46/92/1132004692.db2.gz HKLDQHGWBSXSAT-CYBMUJFWSA-N 1 1 346.814 3.695 20 5 EHBDMO C[C@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000746076275 1132360984 /nfs/dbraw/zinc/36/09/84/1132360984.db2.gz MKVUNIBKTVSVSL-GFCCVEGCSA-N 1 1 340.807 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(Nc2c[nH+]c3ccc(Br)cn23)cc1 ZINC001174477581 1132380987 /nfs/dbraw/zinc/38/09/87/1132380987.db2.gz UWUGTKDGTKWVNT-UHFFFAOYSA-N 1 1 333.145 3.749 20 5 EHBDMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CC1(C)C ZINC001174908309 1132501285 /nfs/dbraw/zinc/50/12/85/1132501285.db2.gz ZHHJKAJXEKURPT-LLVKDONJSA-N 1 1 327.222 3.835 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054565 1132551434 /nfs/dbraw/zinc/55/14/34/1132551434.db2.gz SRISFMQUXGQWFE-VUBDOFJKSA-N 1 1 331.416 3.600 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039027 1132638438 /nfs/dbraw/zinc/63/84/38/1132638438.db2.gz MPANHCCZJQYBLO-YPMHNXCESA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025938 1132640954 /nfs/dbraw/zinc/64/09/54/1132640954.db2.gz KCLKROIDROIISD-IVMMDQJWSA-N 1 1 342.361 3.940 20 5 EHBDMO C[N@H+]1CCC[C@H](CCNc2cc3ccc(Cl)nc3cc2[N+](=O)[O-])C1 ZINC001156385399 1132877090 /nfs/dbraw/zinc/87/70/90/1132877090.db2.gz FWDGPAHGPSUWCB-GFCCVEGCSA-N 1 1 348.834 3.940 20 5 EHBDMO CCC1(CC)C[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000767483065 1133009177 /nfs/dbraw/zinc/00/91/77/1133009177.db2.gz NUDJFGUMKANWDW-UHFFFAOYSA-N 1 1 334.445 3.510 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761573 1133048880 /nfs/dbraw/zinc/04/88/80/1133048880.db2.gz BGMBBGSIXKPNTB-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937201 1133073424 /nfs/dbraw/zinc/07/34/24/1133073424.db2.gz YXRZKEPQVQGTDB-VQTJNVASSA-N 1 1 340.423 3.725 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC001169999456 1133224215 /nfs/dbraw/zinc/22/42/15/1133224215.db2.gz GBLXQPYPHAKDHQ-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO COc1c(O)ccc(C[NH+]2CC([C@@H]3CCC[C@H](C)C3)C2)c1[N+](=O)[O-] ZINC001183446437 1133806816 /nfs/dbraw/zinc/80/68/16/1133806816.db2.gz ZSCLUKOEYBCVIR-QWHCGFSZSA-N 1 1 334.416 3.567 20 5 EHBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126338 1133810798 /nfs/dbraw/zinc/81/07/98/1133810798.db2.gz PLEBESVGBBUXCQ-QKYXUNIQSA-N 1 1 340.423 3.815 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000746667669 1133987914 /nfs/dbraw/zinc/98/79/14/1133987914.db2.gz ZVXRSWFEJTYKPH-GFCCVEGCSA-N 1 1 326.824 3.764 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671277 1133989097 /nfs/dbraw/zinc/98/90/97/1133989097.db2.gz CBGLDUXAIQHNRI-OAHLLOKOSA-N 1 1 325.840 3.554 20 5 EHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000775060038 1134273079 /nfs/dbraw/zinc/27/30/79/1134273079.db2.gz FSMQOYGZFUHCSW-OAHLLOKOSA-N 1 1 341.367 3.801 20 5 EHBDMO CCOc1cc(NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187063691 1134291268 /nfs/dbraw/zinc/29/12/68/1134291268.db2.gz LXQTVXPCBATOPX-MRXNPFEDSA-N 1 1 333.432 3.812 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000790637698 1134444876 /nfs/dbraw/zinc/44/48/76/1134444876.db2.gz XOYCPHLWKXYGDO-UHFFFAOYSA-N 1 1 343.717 3.534 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@H+](CCC1CCC1)CC2 ZINC001170229861 1134724028 /nfs/dbraw/zinc/72/40/28/1134724028.db2.gz AJLIYKUJNVDNOF-UHFFFAOYSA-N 1 1 339.233 3.906 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@@H+](CCC1CCC1)CC2 ZINC001170229861 1134724033 /nfs/dbraw/zinc/72/40/33/1134724033.db2.gz AJLIYKUJNVDNOF-UHFFFAOYSA-N 1 1 339.233 3.906 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)nc1 ZINC001170331378 1134750464 /nfs/dbraw/zinc/75/04/64/1134750464.db2.gz USGAAKUFDUYBQM-OSYLJGHBSA-N 1 1 338.411 3.597 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340090 1134758469 /nfs/dbraw/zinc/75/84/69/1134758469.db2.gz DKJSTUQVEMFDHN-AAEUAGOBSA-N 1 1 346.349 3.809 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214066 1134818674 /nfs/dbraw/zinc/81/86/74/1134818674.db2.gz MAZLJVQMBFBLOU-QZTJIDSGSA-N 1 1 342.443 3.676 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC001191184185 1134820923 /nfs/dbraw/zinc/82/09/23/1134820923.db2.gz VEFYAGDIAVMLPU-BEFAXECRSA-N 1 1 342.443 3.881 20 5 EHBDMO CCC[C@]1(C)CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259243 1134827013 /nfs/dbraw/zinc/82/70/13/1134827013.db2.gz UKFCWSXVAIDMSB-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259243 1134827020 /nfs/dbraw/zinc/82/70/20/1134827020.db2.gz UKFCWSXVAIDMSB-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1ccc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504169 1135093013 /nfs/dbraw/zinc/09/30/13/1135093013.db2.gz NMBHZFQLZVWSGQ-MNOVXSKESA-N 1 1 342.237 3.560 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804556387 1135125653 /nfs/dbraw/zinc/12/56/53/1135125653.db2.gz WCSYYSPQQGTRQY-OAHLLOKOSA-N 1 1 346.475 3.658 20 5 EHBDMO CC(C)C[C@@]1(C)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194536344 1135282978 /nfs/dbraw/zinc/28/29/78/1135282978.db2.gz ZQNQFLSDLOFSEP-GOSISDBHSA-N 1 1 333.432 3.824 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OC(C)C)C1 ZINC001195810965 1135474450 /nfs/dbraw/zinc/47/44/50/1135474450.db2.gz WXEZXUPGEOQAPT-KRWDZBQOSA-N 1 1 336.432 3.771 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OC(C)C)C1 ZINC001195810965 1135474452 /nfs/dbraw/zinc/47/44/52/1135474452.db2.gz WXEZXUPGEOQAPT-KRWDZBQOSA-N 1 1 336.432 3.771 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC001170535865 1135576232 /nfs/dbraw/zinc/57/62/32/1135576232.db2.gz IRTNWEXBWNMDTO-AWEZNQCLSA-N 1 1 330.359 3.602 20 5 EHBDMO C[C@]1(Cc2cccs2)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301959 1135796654 /nfs/dbraw/zinc/79/66/54/1135796654.db2.gz ZCKWGIQDQIPLQM-QZTJIDSGSA-N 1 1 346.452 3.787 20 5 EHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700318 1135869103 /nfs/dbraw/zinc/86/91/03/1135869103.db2.gz CPTYFTGQFHIUPE-GXTWGEPZSA-N 1 1 326.824 3.764 20 5 EHBDMO CCC(CC)[C@H](CNC/C(C)=C/c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC001199170657 1135884526 /nfs/dbraw/zinc/88/45/26/1135884526.db2.gz LZCHRVRIPWXFKP-LSSBLYJVSA-N 1 1 333.476 3.954 20 5 EHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCOC1 ZINC000809935408 1135902053 /nfs/dbraw/zinc/90/20/53/1135902053.db2.gz HDSFDUCTZHTNTG-SNVBAGLBSA-N 1 1 333.215 3.760 20 5 EHBDMO C[N@H+](CCOCC1CC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809953052 1135905799 /nfs/dbraw/zinc/90/57/99/1135905799.db2.gz FIWGLFDJTMIQDQ-UHFFFAOYSA-N 1 1 333.215 3.760 20 5 EHBDMO C[N@@H+](CCOCC1CC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809953052 1135905802 /nfs/dbraw/zinc/90/58/02/1135905802.db2.gz FIWGLFDJTMIQDQ-UHFFFAOYSA-N 1 1 333.215 3.760 20 5 EHBDMO C[C@H]1CC[C@](CO)([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809982045 1135908412 /nfs/dbraw/zinc/90/84/12/1135908412.db2.gz GLAQYVQLRMOKCL-BONVTDFDSA-N 1 1 347.242 3.885 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476106 1136096262 /nfs/dbraw/zinc/09/62/62/1136096262.db2.gz FLYYLAUNFFWELN-LLVKDONJSA-N 1 1 346.258 3.723 20 5 EHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585278 1136442349 /nfs/dbraw/zinc/44/23/49/1136442349.db2.gz SXEMQMUQDHNZJK-AZOIQLNYSA-N 1 1 344.386 3.645 20 5 EHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581323 1136444842 /nfs/dbraw/zinc/44/48/42/1136444842.db2.gz CLIOXAAXPCXIEO-OALUTQOASA-N 1 1 328.412 3.957 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587823 1136447098 /nfs/dbraw/zinc/44/70/98/1136447098.db2.gz OVMJBAXDFKHCDC-KUHUBIRLSA-N 1 1 326.396 3.854 20 5 EHBDMO CC1(C)C[C@@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000852772607 1136484845 /nfs/dbraw/zinc/48/48/45/1136484845.db2.gz NLHUBAQZXQMXHO-GOSISDBHSA-N 1 1 341.367 3.918 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)nc1 ZINC000858011299 1136929967 /nfs/dbraw/zinc/92/99/67/1136929967.db2.gz MFGVLVAIWMXPEW-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)nc1 ZINC000858011299 1136929969 /nfs/dbraw/zinc/92/99/69/1136929969.db2.gz MFGVLVAIWMXPEW-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO C[C@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC001170959460 1137019036 /nfs/dbraw/zinc/01/90/36/1137019036.db2.gz QBXMVNUVQFLSLJ-LLVKDONJSA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC001170959460 1137019038 /nfs/dbraw/zinc/01/90/38/1137019038.db2.gz QBXMVNUVQFLSLJ-LLVKDONJSA-N 1 1 342.823 3.658 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000794620132 1137221309 /nfs/dbraw/zinc/22/13/09/1137221309.db2.gz HXERPRMIJOFHMQ-AWEZNQCLSA-N 1 1 345.399 3.505 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)o1 ZINC000122992417 1137480085 /nfs/dbraw/zinc/48/00/85/1137480085.db2.gz OHCKTKSOHWODMJ-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)o1 ZINC000122992417 1137480086 /nfs/dbraw/zinc/48/00/86/1137480086.db2.gz OHCKTKSOHWODMJ-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740047 1137511118 /nfs/dbraw/zinc/51/11/18/1137511118.db2.gz ARGUWPFDJFFWPP-ZDUSSCGKSA-N 1 1 341.367 3.665 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171804859 1137513419 /nfs/dbraw/zinc/51/34/19/1137513419.db2.gz JMGFYLVOCLVSPE-ZBFHGGJFSA-N 1 1 345.443 3.824 20 5 EHBDMO COc1ncccc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872022719 1137565429 /nfs/dbraw/zinc/56/54/29/1137565429.db2.gz YXHSMUVVPAOLHD-LLVKDONJSA-N 1 1 333.413 3.571 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc2c1OCO2 ZINC000872025082 1137565710 /nfs/dbraw/zinc/56/57/10/1137565710.db2.gz YTNFQOPWDOVPII-LLVKDONJSA-N 1 1 346.408 3.896 20 5 EHBDMO COc1ccncc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872072586 1137569695 /nfs/dbraw/zinc/56/96/95/1137569695.db2.gz IHHRUPZWQYFMDD-LLVKDONJSA-N 1 1 333.413 3.571 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000873183514 1137592934 /nfs/dbraw/zinc/59/29/34/1137592934.db2.gz UFFAVESWPZDVDF-XHDPSFHLSA-N 1 1 333.413 3.754 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674379 1137685362 /nfs/dbraw/zinc/68/53/62/1137685362.db2.gz UZEFZZFBFXQWCS-MJGOQNOKSA-N 1 1 326.396 3.601 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476031 1137717421 /nfs/dbraw/zinc/71/74/21/1137717421.db2.gz VJXRXJWQEBZFJR-GXTWGEPZSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543501 1137719613 /nfs/dbraw/zinc/71/96/13/1137719613.db2.gz DMJQNIVOWYQCIK-ZDUSSCGKSA-N 1 1 344.415 3.903 20 5 EHBDMO CC1=C(C)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1 ZINC000878547063 1137719703 /nfs/dbraw/zinc/71/97/03/1137719703.db2.gz VEGUHWXZXHHONN-UHFFFAOYSA-N 1 1 348.790 3.840 20 5 EHBDMO CC1=C(C)C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1 ZINC000878547063 1137719704 /nfs/dbraw/zinc/71/97/04/1137719704.db2.gz VEGUHWXZXHHONN-UHFFFAOYSA-N 1 1 348.790 3.840 20 5 EHBDMO CC(C)c1cc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)[nH]n1 ZINC000879918308 1137762451 /nfs/dbraw/zinc/76/24/51/1137762451.db2.gz ABSUNHPTQFYEBL-CQSZACIVSA-N 1 1 346.406 3.960 20 5 EHBDMO CC(C)c1cc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)n[nH]1 ZINC000879918308 1137762452 /nfs/dbraw/zinc/76/24/52/1137762452.db2.gz ABSUNHPTQFYEBL-CQSZACIVSA-N 1 1 346.406 3.960 20 5 EHBDMO CC(C)c1cc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)n[nH]1 ZINC000879918308 1137762453 /nfs/dbraw/zinc/76/24/53/1137762453.db2.gz ABSUNHPTQFYEBL-CQSZACIVSA-N 1 1 346.406 3.960 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000130200154 1137834857 /nfs/dbraw/zinc/83/48/57/1137834857.db2.gz OTGXWERYXALWKM-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO CCc1ccc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000883288175 1137852783 /nfs/dbraw/zinc/85/27/83/1137852783.db2.gz URHNVWOMSBOZCT-UHFFFAOYSA-N 1 1 339.189 3.803 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136957041 1138044585 /nfs/dbraw/zinc/04/45/85/1138044585.db2.gz VZOCPIFLSMIVGF-IBGZPJMESA-N 1 1 328.412 3.583 20 5 EHBDMO COc1ccc2oc([C@@H](C)[NH2+]Cc3cccnc3[N+](=O)[O-])c(C)c2c1 ZINC000886129846 1138049996 /nfs/dbraw/zinc/04/99/96/1138049996.db2.gz PFBWUPVCNNNUAI-GFCCVEGCSA-N 1 1 341.367 3.904 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2ncccn2)C1 ZINC000886685950 1138115054 /nfs/dbraw/zinc/11/50/54/1138115054.db2.gz HGJWUBWRTKQUAU-LSDHHAIUSA-N 1 1 326.400 3.634 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000075864316 1138129050 /nfs/dbraw/zinc/12/90/50/1138129050.db2.gz IGBQYBOENWCBDO-GOSISDBHSA-N 1 1 326.396 3.634 20 5 EHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCCO2 ZINC000089512631 1138200510 /nfs/dbraw/zinc/20/05/10/1138200510.db2.gz UPJXEMQJPXRESY-INIZCTEOSA-N 1 1 328.368 3.607 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089912547 1138207281 /nfs/dbraw/zinc/20/72/81/1138207281.db2.gz SVSFCAIPVPMOBO-GFCCVEGCSA-N 1 1 335.429 3.823 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCOC1 ZINC000093839720 1138241601 /nfs/dbraw/zinc/24/16/01/1138241601.db2.gz VXPGGHCOQSQFQD-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO C[NH+](C)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)ccc1Cl ZINC000337261881 1138512191 /nfs/dbraw/zinc/51/21/91/1138512191.db2.gz XWSFVCIJFWIRSD-UHFFFAOYSA-N 1 1 339.804 3.624 20 5 EHBDMO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000509522260 1139252858 /nfs/dbraw/zinc/25/28/58/1139252858.db2.gz CFWZOWOYOYHBCV-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000509522260 1139252860 /nfs/dbraw/zinc/25/28/60/1139252860.db2.gz CFWZOWOYOYHBCV-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1c(CN[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722943 1140166765 /nfs/dbraw/zinc/16/67/65/1140166765.db2.gz DVMCVPBQPOBQTI-DOTOQJQBSA-N 1 1 331.460 3.646 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cs1 ZINC000267468770 1140794758 /nfs/dbraw/zinc/79/47/58/1140794758.db2.gz WPHUEEAETYBLSX-OLZOCXBDSA-N 1 1 338.454 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cs1 ZINC000267468770 1140794764 /nfs/dbraw/zinc/79/47/64/1140794764.db2.gz WPHUEEAETYBLSX-OLZOCXBDSA-N 1 1 338.454 3.806 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348527561 1141545733 /nfs/dbraw/zinc/54/57/33/1141545733.db2.gz TWHSHQNAUOMCAU-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO C[C@@H]1CN(c2ccc3ccc4ccc(Cl)nc4c3n2)[C@@H](C)C[N@H+]1C ZINC001164643636 719204843 /nfs/dbraw/zinc/20/48/43/719204843.db2.gz ZVADVIGMJFPKTK-OLZOCXBDSA-N 1 1 340.858 3.965 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000274508123 1014155083 /nfs/dbraw/zinc/15/50/83/1014155083.db2.gz WHIOCJJKQDXMDJ-UHFFFAOYSA-N 1 1 346.814 3.732 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000198594778 1125488629 /nfs/dbraw/zinc/48/86/29/1125488629.db2.gz HPQZQNBZKJZKPH-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000610215933 1015021696 /nfs/dbraw/zinc/02/16/96/1015021696.db2.gz NPHSVKFQDSCWPR-UHFFFAOYSA-N 1 1 348.443 3.775 20 5 EHBDMO CCn1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000154258867 1015326882 /nfs/dbraw/zinc/32/68/82/1015326882.db2.gz VPLFEHBGZLJKON-UHFFFAOYSA-N 1 1 328.416 3.593 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000154258867 1015326894 /nfs/dbraw/zinc/32/68/94/1015326894.db2.gz VPLFEHBGZLJKON-UHFFFAOYSA-N 1 1 328.416 3.593 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CO)C3)s2)cc1 ZINC000154589688 1015619844 /nfs/dbraw/zinc/61/98/44/1015619844.db2.gz LPKYKVMQWBASNC-ZDUSSCGKSA-N 1 1 332.425 3.528 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3cn[nH]c3C2)c2ccccc2)c1 ZINC000359895402 1015910653 /nfs/dbraw/zinc/91/06/53/1015910653.db2.gz GWIYINRSQQWNND-FXAWDEMLSA-N 1 1 348.406 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC001167123458 1016186176 /nfs/dbraw/zinc/18/61/76/1016186176.db2.gz UJDDKXKYFKSXMQ-GOSISDBHSA-N 1 1 344.386 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC001167123459 1016186306 /nfs/dbraw/zinc/18/63/06/1016186306.db2.gz UJDDKXKYFKSXMQ-SFHVURJKSA-N 1 1 344.386 3.820 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000066696033 1016416068 /nfs/dbraw/zinc/41/60/68/1016416068.db2.gz VFAZRXWREOZDBQ-OAHLLOKOSA-N 1 1 332.425 3.838 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000066696033 1016416076 /nfs/dbraw/zinc/41/60/76/1016416076.db2.gz VFAZRXWREOZDBQ-OAHLLOKOSA-N 1 1 332.425 3.838 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700917 1016789321 /nfs/dbraw/zinc/78/93/21/1016789321.db2.gz RYZCYCWYQFVSDN-CVEARBPZSA-N 1 1 349.475 3.909 20 5 EHBDMO C[C@H]([NH2+]Cc1ccn(C)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536830564 1032310687 /nfs/dbraw/zinc/31/06/87/1032310687.db2.gz CJEMGHPRRJXLPV-LBPRGKRZSA-N 1 1 342.424 3.908 20 5 EHBDMO COc1ccc(C(C)C)cc1C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000593969913 1032646101 /nfs/dbraw/zinc/64/61/01/1032646101.db2.gz GLWQQQYMOPRVIZ-UHFFFAOYSA-N 1 1 341.411 3.680 20 5 EHBDMO COc1ccc(C(C)C)cc1C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000593969913 1032646115 /nfs/dbraw/zinc/64/61/15/1032646115.db2.gz GLWQQQYMOPRVIZ-UHFFFAOYSA-N 1 1 341.411 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc4ccccn34)C2)cc1 ZINC000449501112 1032681005 /nfs/dbraw/zinc/68/10/05/1032681005.db2.gz OWKMUKZDFSLCQP-INIZCTEOSA-N 1 1 336.395 3.622 20 5 EHBDMO CCCn1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505386 1032689725 /nfs/dbraw/zinc/68/97/25/1032689725.db2.gz XGDAWPCRAJUYET-KRWDZBQOSA-N 1 1 328.416 3.581 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952389 1017352577 /nfs/dbraw/zinc/35/25/77/1017352577.db2.gz QQRGAABWCLIUQZ-GXTWGEPZSA-N 1 1 331.441 3.553 20 5 EHBDMO CC1(C)C[NH2+]CC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414971506 1017360624 /nfs/dbraw/zinc/36/06/24/1017360624.db2.gz LMDNKLJDHKTPKS-KRWDZBQOSA-N 1 1 345.468 3.801 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000449509979 1032696937 /nfs/dbraw/zinc/69/69/37/1032696937.db2.gz WZTLOCVPCRFTSB-MLGOLLRUSA-N 1 1 347.440 3.575 20 5 EHBDMO COc1cccc(N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111392 1018973566 /nfs/dbraw/zinc/97/35/66/1018973566.db2.gz DFSMWKCWEXNGRC-ZBFHGGJFSA-N 1 1 341.411 3.678 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075197 1019000017 /nfs/dbraw/zinc/00/00/17/1019000017.db2.gz XGALUINHRBIZIA-SMDDNHRTSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1[C@H](C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000419379861 1019008341 /nfs/dbraw/zinc/00/83/41/1019008341.db2.gz XEZWWNMHLYQYCG-MCIONIFRSA-N 1 1 329.400 3.769 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000322407059 1019086772 /nfs/dbraw/zinc/08/67/72/1019086772.db2.gz XMEBHTCUMLYYBG-RYUDHWBXSA-N 1 1 329.322 3.652 20 5 EHBDMO C[C@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439052 1032845617 /nfs/dbraw/zinc/84/56/17/1032845617.db2.gz YTLRXHSYSYLSJH-QWRGUYRKSA-N 1 1 337.807 3.724 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000610451454 1019805857 /nfs/dbraw/zinc/80/58/57/1019805857.db2.gz ASZBTRRAQCIFJD-OAHLLOKOSA-N 1 1 345.468 3.753 20 5 EHBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610161178 1020060373 /nfs/dbraw/zinc/06/03/73/1020060373.db2.gz KWMJZGGUIYFUGT-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610161178 1020060384 /nfs/dbraw/zinc/06/03/84/1020060384.db2.gz KWMJZGGUIYFUGT-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000345241379 1020087617 /nfs/dbraw/zinc/08/76/17/1020087617.db2.gz LQYLUYXRANMXCA-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC[C@H](O)CC1 ZINC000276059732 1020536439 /nfs/dbraw/zinc/53/64/39/1020536439.db2.gz SJBYRPNQBMCHBV-KOMQPUFPSA-N 1 1 330.384 3.590 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2c2nc3c([nH]2)CCCC3)cc1 ZINC000276109116 1020651623 /nfs/dbraw/zinc/65/16/23/1020651623.db2.gz WWVZVRDBTPSRDC-SFHVURJKSA-N 1 1 340.427 3.576 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413092219 1020679682 /nfs/dbraw/zinc/67/96/82/1020679682.db2.gz KUTCCMWTHRSAAQ-LLVKDONJSA-N 1 1 346.353 3.541 20 5 EHBDMO COc1cccc2c1CC[C@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602568706 1032980832 /nfs/dbraw/zinc/98/08/32/1032980832.db2.gz KZMGTISIHZUQCD-CQSZACIVSA-N 1 1 339.351 3.522 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1OC)Cc1ccccc1[N+](=O)[O-] ZINC000051180356 1021590279 /nfs/dbraw/zinc/59/02/79/1021590279.db2.gz QSVSBFDQWFMDBO-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1 ZINC000477440635 1021689580 /nfs/dbraw/zinc/68/95/80/1021689580.db2.gz SQQHRLRPCJIHCL-INIZCTEOSA-N 1 1 326.352 3.661 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)c1 ZINC000477440635 1021689585 /nfs/dbraw/zinc/68/95/85/1021689585.db2.gz SQQHRLRPCJIHCL-INIZCTEOSA-N 1 1 326.352 3.661 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c[nH]nc2-c2cccs2)c(Cl)c1 ZINC000341555061 1022306441 /nfs/dbraw/zinc/30/64/41/1022306441.db2.gz ZRELBJCQKGKSHJ-UHFFFAOYSA-N 1 1 348.815 3.990 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@]4(CCOC4)C3)o2)c1 ZINC000449688682 1033071803 /nfs/dbraw/zinc/07/18/03/1033071803.db2.gz WKOBRUBIWVMPCR-IBGZPJMESA-N 1 1 342.395 3.857 20 5 EHBDMO COc1cc(C[NH2+][C@@H](c2ncccc2C)C(C)C)c([N+](=O)[O-])cc1F ZINC000184260236 1022661863 /nfs/dbraw/zinc/66/18/63/1022661863.db2.gz UKMHPFXGFZPCEC-QGZVFWFLSA-N 1 1 347.390 3.933 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1cccc(O)c1 ZINC000178376397 1023132753 /nfs/dbraw/zinc/13/27/53/1023132753.db2.gz PTONWCDCIXORGK-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO CCOc1cc(C[N@H+](Cc2ccccn2)C2CC2)ccc1[N+](=O)[O-] ZINC000276933073 1023412492 /nfs/dbraw/zinc/41/24/92/1023412492.db2.gz RHQYCWZTIVTCNM-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2ccccn2)C2CC2)ccc1[N+](=O)[O-] ZINC000276933073 1023412495 /nfs/dbraw/zinc/41/24/95/1023412495.db2.gz RHQYCWZTIVTCNM-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccns1 ZINC000926303502 1023574951 /nfs/dbraw/zinc/57/49/51/1023574951.db2.gz MGGCQBRCLIXSSF-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176399 1024201818 /nfs/dbraw/zinc/20/18/18/1024201818.db2.gz PBOYEFHPLSBSDC-TVQRCGJNSA-N 1 1 329.322 3.508 20 5 EHBDMO CCn1ccnc1[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000280966409 1024465608 /nfs/dbraw/zinc/46/56/08/1024465608.db2.gz KCEPDCOTBSLRCM-QGZVFWFLSA-N 1 1 328.416 3.581 20 5 EHBDMO CC[C@H]([NH2+]Cc1nc2cccnc2s1)c1cccc([N+](=O)[O-])c1 ZINC000342280310 1024698437 /nfs/dbraw/zinc/69/84/37/1024698437.db2.gz HIMJLCWDCJVAHC-ZDUSSCGKSA-N 1 1 328.397 3.840 20 5 EHBDMO Cn1cc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 ZINC000119692779 1024864070 /nfs/dbraw/zinc/86/40/70/1024864070.db2.gz BAGYTBCCCNBHKI-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 ZINC000119692779 1024864081 /nfs/dbraw/zinc/86/40/81/1024864081.db2.gz BAGYTBCCCNBHKI-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]([C@@H]4CCCO4)C3)o2)cc1 ZINC000895843872 1024891266 /nfs/dbraw/zinc/89/12/66/1024891266.db2.gz JESKMVLCRAJWGS-QAPCUYQASA-N 1 1 342.395 3.856 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2cc(F)c(OC)cc21 ZINC000281327107 1024902671 /nfs/dbraw/zinc/90/26/71/1024902671.db2.gz SYLFBYYDJQKANO-INIZCTEOSA-N 1 1 346.358 3.528 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]C2(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000427967478 1024914097 /nfs/dbraw/zinc/91/40/97/1024914097.db2.gz RPCFZPVPISVRNU-AWEZNQCLSA-N 1 1 339.395 3.725 20 5 EHBDMO Cc1c([C@H](C)[NH2+]C2(C(=O)Nc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000427972458 1024916119 /nfs/dbraw/zinc/91/61/19/1024916119.db2.gz BACOTBXNOCNCHZ-AWEZNQCLSA-N 1 1 339.395 3.725 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCOC1 ZINC000119708157 1024928229 /nfs/dbraw/zinc/92/82/29/1024928229.db2.gz GKMNAGPRWYLMSM-ZDUSSCGKSA-N 1 1 347.440 3.577 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1nccc2c1cccc2[N+](=O)[O-] ZINC000895987992 1025043898 /nfs/dbraw/zinc/04/38/98/1025043898.db2.gz MDMAUKAIQUSQAE-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000521099629 1025203245 /nfs/dbraw/zinc/20/32/45/1025203245.db2.gz IARIESXULSDYSK-MRXNPFEDSA-N 1 1 348.447 3.679 20 5 EHBDMO COc1ccc(OCCC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511071774 1025218872 /nfs/dbraw/zinc/21/88/72/1025218872.db2.gz HSKIIAWOYVPBIR-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158055614 1025334228 /nfs/dbraw/zinc/33/42/28/1025334228.db2.gz WLACQYAJHGHZNQ-INIZCTEOSA-N 1 1 326.396 3.635 20 5 EHBDMO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000442998380 1025639884 /nfs/dbraw/zinc/63/98/84/1025639884.db2.gz IZQFPNYHRGZZBV-KUHUBIRLSA-N 1 1 345.418 3.823 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NCc2ccc(C)[nH+]c2N2CCCC2)c1 ZINC000611583847 1025738587 /nfs/dbraw/zinc/73/85/87/1025738587.db2.gz FCMVFVHUEVWWDE-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451354533 1025860741 /nfs/dbraw/zinc/86/07/41/1025860741.db2.gz RZDMZDBNCRMFSJ-IAAVTCLWSA-N 1 1 332.444 3.980 20 5 EHBDMO Cc1cccc([C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)c1C ZINC000472220186 1025916379 /nfs/dbraw/zinc/91/63/79/1025916379.db2.gz BNULGDLOLJITSW-SFHVURJKSA-N 1 1 328.416 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCO[C@@H]3CCCCO3)C2)cc1 ZINC000451550478 1026101140 /nfs/dbraw/zinc/10/11/40/1026101140.db2.gz RWDMXBSULQQXDV-PKOBYXMFSA-N 1 1 348.443 3.708 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1 ZINC000451842167 1026317259 /nfs/dbraw/zinc/31/72/59/1026317259.db2.gz QODYKRAFMQJQGA-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1 ZINC000451842167 1026317274 /nfs/dbraw/zinc/31/72/74/1026317274.db2.gz QODYKRAFMQJQGA-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO CCN1CCC([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000125235490 1026334355 /nfs/dbraw/zinc/33/43/55/1026334355.db2.gz NRZVGXDTKSUBPZ-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000125235490 1026334368 /nfs/dbraw/zinc/33/43/68/1026334368.db2.gz NRZVGXDTKSUBPZ-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000158354319 1026360629 /nfs/dbraw/zinc/36/06/29/1026360629.db2.gz FJQZKBPEDATPDF-UHFFFAOYSA-N 1 1 339.395 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(CNc3cccc4cc[nH+]cc43)n2)cc1 ZINC000531522411 1027002894 /nfs/dbraw/zinc/00/28/94/1027002894.db2.gz SDZFUWXAXAOIOQ-UHFFFAOYSA-N 1 1 347.334 3.805 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413179892 1027203616 /nfs/dbraw/zinc/20/36/16/1027203616.db2.gz CTDGMWKASYSXQC-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ncc(C)s2)CC1 ZINC000366755120 1028001580 /nfs/dbraw/zinc/00/15/80/1028001580.db2.gz HIYGMHCQSPZWIC-UHFFFAOYSA-N 1 1 347.440 3.748 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503656012 1028007553 /nfs/dbraw/zinc/00/75/53/1028007553.db2.gz YMIGEBYZTAMROD-AWEZNQCLSA-N 1 1 330.359 3.602 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C ZINC000444677651 1028147540 /nfs/dbraw/zinc/14/75/40/1028147540.db2.gz QAQYSSVWMJBBAW-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444680639 1028152099 /nfs/dbraw/zinc/15/20/99/1028152099.db2.gz QMWXZCFQFTXPFS-UHFFFAOYSA-N 1 1 349.394 3.975 20 5 EHBDMO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444680639 1028152109 /nfs/dbraw/zinc/15/21/09/1028152109.db2.gz QMWXZCFQFTXPFS-UHFFFAOYSA-N 1 1 349.394 3.975 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440542366 1028227179 /nfs/dbraw/zinc/22/71/79/1028227179.db2.gz CFQGRQBNHURYSV-GJYPPUQNSA-N 1 1 330.428 3.764 20 5 EHBDMO CC1(C)C[C@@H](NC[C@@H]([NH3+])c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000423232350 1028298239 /nfs/dbraw/zinc/29/82/39/1028298239.db2.gz BYTXJAFFSWWZLW-QZTJIDSGSA-N 1 1 325.412 3.607 20 5 EHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508516250 1028484060 /nfs/dbraw/zinc/48/40/60/1028484060.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000508516250 1028484099 /nfs/dbraw/zinc/48/40/99/1028484099.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000508516250 1028484105 /nfs/dbraw/zinc/48/41/05/1028484105.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615673 1028486032 /nfs/dbraw/zinc/48/60/32/1028486032.db2.gz ZTVQYZUBZNPVGL-QLFBSQMISA-N 1 1 335.423 3.571 20 5 EHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]CC1 ZINC000414756659 1028572828 /nfs/dbraw/zinc/57/28/28/1028572828.db2.gz VQXQINJIOAJONV-CQSZACIVSA-N 1 1 345.468 3.897 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968708 1028590484 /nfs/dbraw/zinc/59/04/84/1028590484.db2.gz ZJHBSVBAMYGEFM-CQSZACIVSA-N 1 1 348.353 3.614 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCCC[C@H]1C ZINC000052101535 1028812817 /nfs/dbraw/zinc/81/28/17/1028812817.db2.gz KQMWYBSRTFEJKY-KGLIPLIRSA-N 1 1 328.416 3.818 20 5 EHBDMO COc1ccc([C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000421829711 1028818469 /nfs/dbraw/zinc/81/84/69/1028818469.db2.gz AGPMDCNWARUNAM-GOSISDBHSA-N 1 1 330.359 3.983 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895988 1029042572 /nfs/dbraw/zinc/04/25/72/1029042572.db2.gz WQJPLFVKAOLWEM-HOTGVXAUSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504929038 1029075243 /nfs/dbraw/zinc/07/52/43/1029075243.db2.gz GAQNXWDHYTZGFI-HNNXBMFYSA-N 1 1 349.475 3.909 20 5 EHBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000532977475 1029133200 /nfs/dbraw/zinc/13/32/00/1029133200.db2.gz MLYCYPYFMCWMEA-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000532977475 1029133206 /nfs/dbraw/zinc/13/32/06/1029133206.db2.gz MLYCYPYFMCWMEA-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000052158069 1029142511 /nfs/dbraw/zinc/14/25/11/1029142511.db2.gz BWJKUASILJYURE-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCc3c(Cl)cccc3C2)c1 ZINC000525328655 1029795201 /nfs/dbraw/zinc/79/52/01/1029795201.db2.gz IPLCDSYGEBQPIN-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCc3c(Cl)cccc3C2)c1 ZINC000525328655 1029795206 /nfs/dbraw/zinc/79/52/06/1029795206.db2.gz IPLCDSYGEBQPIN-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO C[C@H]([NH2+]Cc1cccc(Br)n1)c1cccc([N+](=O)[O-])c1 ZINC000161734648 1029896789 /nfs/dbraw/zinc/89/67/89/1029896789.db2.gz ZAKHXKZOOXRAHZ-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1C ZINC000537626539 1029904268 /nfs/dbraw/zinc/90/42/68/1029904268.db2.gz WSZYTMWERBGAOR-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1C ZINC000537626539 1029904283 /nfs/dbraw/zinc/90/42/83/1029904283.db2.gz WSZYTMWERBGAOR-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2cnc(C3CC3)o2)c2cc([N+](=O)[O-])ccc21 ZINC000453363160 1030177684 /nfs/dbraw/zinc/17/76/84/1030177684.db2.gz QMDADLTYUDSIIN-MRXNPFEDSA-N 1 1 327.384 3.972 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367727 1030183063 /nfs/dbraw/zinc/18/30/63/1030183063.db2.gz MKRZPQMBHNLCGY-HQRMLTQVSA-N 1 1 344.455 3.809 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000190722088 1030925461 /nfs/dbraw/zinc/92/54/61/1030925461.db2.gz OANBQICHRRVJRW-DZGCQCFKSA-N 1 1 349.431 3.645 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000190722088 1030925475 /nfs/dbraw/zinc/92/54/75/1030925475.db2.gz OANBQICHRRVJRW-DZGCQCFKSA-N 1 1 349.431 3.645 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCC[C@H]1O ZINC000537687566 1030980366 /nfs/dbraw/zinc/98/03/66/1030980366.db2.gz HYTDQOLQYIBJPM-RHSMWYFYSA-N 1 1 346.452 3.916 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245072 1031051490 /nfs/dbraw/zinc/05/14/90/1031051490.db2.gz GVPCKCZBQIEQLU-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H]2CC[N@@H+]2C2CCCC2)n1 ZINC000923885183 1031347215 /nfs/dbraw/zinc/34/72/15/1031347215.db2.gz ANBLOQNLPDXURP-OAHLLOKOSA-N 1 1 328.372 3.643 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H]2CC[N@H+]2C2CCCC2)n1 ZINC000923885183 1031347232 /nfs/dbraw/zinc/34/72/32/1031347232.db2.gz ANBLOQNLPDXURP-OAHLLOKOSA-N 1 1 328.372 3.643 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCO3)o2)c1 ZINC000551586858 1031474791 /nfs/dbraw/zinc/47/47/91/1031474791.db2.gz SOZGVPJBAWIZNS-HKUYNNGSSA-N 1 1 342.395 3.998 20 5 EHBDMO CCN(CC)[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000061015195 1033432847 /nfs/dbraw/zinc/43/28/47/1033432847.db2.gz BGBNBSNFEKEVOL-LJQANCHMSA-N 1 1 327.428 3.768 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293220 1033574979 /nfs/dbraw/zinc/57/49/79/1033574979.db2.gz TUIYLQZGPKCQBV-HIFRSBDPSA-N 1 1 348.472 3.816 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000595042574 1033660698 /nfs/dbraw/zinc/66/06/98/1033660698.db2.gz AMMSCGCNPPPKCZ-YVEFUNNKSA-N 1 1 328.368 3.526 20 5 EHBDMO Cc1noc(C[N@H+](C)CCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000595301370 1033737735 /nfs/dbraw/zinc/73/77/35/1033737735.db2.gz JIDYMURXENWDIA-UHFFFAOYSA-N 1 1 325.368 3.719 20 5 EHBDMO Cc1noc(C[N@@H+](C)CCc2cccc3ccccc32)c1[N+](=O)[O-] ZINC000595301370 1033737752 /nfs/dbraw/zinc/73/77/52/1033737752.db2.gz JIDYMURXENWDIA-UHFFFAOYSA-N 1 1 325.368 3.719 20 5 EHBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCO2 ZINC000089512650 1033763451 /nfs/dbraw/zinc/76/34/51/1033763451.db2.gz VPVCRZKQCHUBFA-MRXNPFEDSA-N 1 1 328.368 3.607 20 5 EHBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595443600 1033808622 /nfs/dbraw/zinc/80/86/22/1033808622.db2.gz WITJBKNBJVTVAA-NSHDSACASA-N 1 1 334.395 3.845 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Oc2cccc(F)c2)CC1 ZINC000599504564 1033964894 /nfs/dbraw/zinc/96/48/94/1033964894.db2.gz CFHISYFSIGSHAR-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])C1 ZINC000603859507 1033984787 /nfs/dbraw/zinc/98/47/87/1033984787.db2.gz FVDLNYXLOGYQFE-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)O1 ZINC000595781906 1033995420 /nfs/dbraw/zinc/99/54/20/1033995420.db2.gz VRBKPIRGENLOOK-MNOVXSKESA-N 1 1 332.322 3.613 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)O1 ZINC000595781906 1033995432 /nfs/dbraw/zinc/99/54/32/1033995432.db2.gz VRBKPIRGENLOOK-MNOVXSKESA-N 1 1 332.322 3.613 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CO)c1ccc(F)cc1F ZINC000595867416 1034012380 /nfs/dbraw/zinc/01/23/80/1034012380.db2.gz MVPSVXFMKDUUEL-GTNSWQLSSA-N 1 1 336.338 3.566 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594356 1034033218 /nfs/dbraw/zinc/03/32/18/1034033218.db2.gz GGPISTBYGQZJIB-JKIFEVAISA-N 1 1 348.443 3.956 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000604012566 1034135292 /nfs/dbraw/zinc/13/52/92/1034135292.db2.gz QDMNZCXPSCWWHS-LJQANCHMSA-N 1 1 326.396 3.983 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[N@H+](C2CCCC2)CC1 ZINC000450346566 1034155708 /nfs/dbraw/zinc/15/57/08/1034155708.db2.gz NPKOXNQSLRRCJM-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000604435950 1034377660 /nfs/dbraw/zinc/37/76/60/1034377660.db2.gz OHAMOWXAWCUCHW-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1cc(C)c([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000179622957 1034517592 /nfs/dbraw/zinc/51/75/92/1034517592.db2.gz JGLZOEJBQIBSBA-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C(F)(F)F)c1 ZINC000364082272 1034536676 /nfs/dbraw/zinc/53/66/76/1034536676.db2.gz FJABFKWGMOSRIJ-MNOVXSKESA-N 1 1 329.322 3.652 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000364082271 1034536997 /nfs/dbraw/zinc/53/69/97/1034536997.db2.gz FJABFKWGMOSRIJ-GHMZBOCLSA-N 1 1 329.322 3.652 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1=CCCOC1 ZINC000597205007 1034607974 /nfs/dbraw/zinc/60/79/74/1034607974.db2.gz BXJVHRIROMYZSM-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO CC1(C)C[C@@H](NCc2ccc(C[NH3+])cc2F)c2cc([N+](=O)[O-])ccc21 ZINC000593320259 1034659622 /nfs/dbraw/zinc/65/96/22/1034659622.db2.gz BTARHFIOIGAARP-GOSISDBHSA-N 1 1 343.402 3.705 20 5 EHBDMO Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000450821280 1034849883 /nfs/dbraw/zinc/84/98/83/1034849883.db2.gz ACPZJJWMMZBZMI-YOGCLGLASA-N 1 1 343.349 3.959 20 5 EHBDMO CCOc1cc(Cn2c[nH+]c3c2C[C@H](C)[C@H](C)C3)ccc1[N+](=O)[O-] ZINC000450997158 1035008629 /nfs/dbraw/zinc/00/86/29/1035008629.db2.gz HZGSGKQWHQYXGR-OLZOCXBDSA-N 1 1 329.400 3.609 20 5 EHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000579902191 1035375396 /nfs/dbraw/zinc/37/53/96/1035375396.db2.gz WJNBEIIZYDWAHX-NSHDSACASA-N 1 1 331.363 3.729 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000571686383 1035590440 /nfs/dbraw/zinc/59/04/40/1035590440.db2.gz HFESNARSVXRHLV-UHFFFAOYSA-N 1 1 339.189 3.625 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000443946458 1035903614 /nfs/dbraw/zinc/90/36/14/1035903614.db2.gz LXOKJWJVWMIDIR-OKILXGFUSA-N 1 1 348.447 3.596 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000589185033 1036296522 /nfs/dbraw/zinc/29/65/22/1036296522.db2.gz QPQWYNXMDLEZPX-QINSGFPZSA-N 1 1 338.411 3.521 20 5 EHBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000492830530 1036344363 /nfs/dbraw/zinc/34/43/63/1036344363.db2.gz NAOIGSCAMXWGLB-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@H](CCOC)C2)ccc1[N+](=O)[O-] ZINC000492867935 1036361456 /nfs/dbraw/zinc/36/14/56/1036361456.db2.gz CFWNVFQCOJKYOP-OAHLLOKOSA-N 1 1 336.432 3.632 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H](CCOC)C2)ccc1[N+](=O)[O-] ZINC000492867934 1036361895 /nfs/dbraw/zinc/36/18/95/1036361895.db2.gz CFWNVFQCOJKYOP-HNNXBMFYSA-N 1 1 336.432 3.632 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2ccccc2)C2CC2)c1 ZINC000589494205 1036438324 /nfs/dbraw/zinc/43/83/24/1036438324.db2.gz JMYZVGFFJQAVSA-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000589494205 1036438334 /nfs/dbraw/zinc/43/83/34/1036438334.db2.gz JMYZVGFFJQAVSA-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730850 1036679507 /nfs/dbraw/zinc/67/95/07/1036679507.db2.gz QXGRHFSAPVHZKC-DYVFJYSZSA-N 1 1 334.416 3.862 20 5 EHBDMO CC[C@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777050 1036769281 /nfs/dbraw/zinc/76/92/81/1036769281.db2.gz OMTNRTNBKAGCSV-RDTXWAMCSA-N 1 1 333.432 3.742 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000376448370 1036887322 /nfs/dbraw/zinc/88/73/22/1036887322.db2.gz MNAMAXKBEJQBJW-SJCJKPOMSA-N 1 1 346.456 3.734 20 5 EHBDMO COc1cccc([C@H](C)[NH+]2CCN(c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000609143783 1036956469 /nfs/dbraw/zinc/95/64/69/1036956469.db2.gz MNARULNWSVRQGT-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccc(Cl)c1 ZINC000007267366 1037026168 /nfs/dbraw/zinc/02/61/68/1037026168.db2.gz MHFBDZPIQBMPEA-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(Cl)c1 ZINC000007267366 1037026186 /nfs/dbraw/zinc/02/61/86/1037026186.db2.gz MHFBDZPIQBMPEA-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135630 1037088587 /nfs/dbraw/zinc/08/85/87/1037088587.db2.gz AJQSHDVZEQQYCE-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H](NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135630 1037088603 /nfs/dbraw/zinc/08/86/03/1037088603.db2.gz AJQSHDVZEQQYCE-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO Cc1ccc(-c2noc([C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206332 1037131646 /nfs/dbraw/zinc/13/16/46/1037131646.db2.gz WFRXGZGNSDPHSO-XQQFMLRXSA-N 1 1 330.388 3.887 20 5 EHBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000590967233 1037144630 /nfs/dbraw/zinc/14/46/30/1037144630.db2.gz SEZAZVYJWSVZFB-BETUJISGSA-N 1 1 326.352 3.551 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000493571965 1037459952 /nfs/dbraw/zinc/45/99/52/1037459952.db2.gz IXTSIEWHSLDEJL-GFCCVEGCSA-N 1 1 326.824 3.764 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC(C)(C)C ZINC000532549549 1037589858 /nfs/dbraw/zinc/58/98/58/1037589858.db2.gz UGDVWDNTVCHCAK-SNVBAGLBSA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC(C)(C)CC1 ZINC000532581713 1037699259 /nfs/dbraw/zinc/69/92/59/1037699259.db2.gz QYQDIWRQEDMOIC-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1ccc(CN2CC[NH+]([C@H](C)c3ccsc3)CC2)cc1[N+](=O)[O-] ZINC000463055554 1037723351 /nfs/dbraw/zinc/72/33/51/1037723351.db2.gz TXVISLJKGASQRQ-OAHLLOKOSA-N 1 1 345.468 3.844 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccco2)s1 ZINC000549407183 1038309793 /nfs/dbraw/zinc/30/97/93/1038309793.db2.gz CSBCCMWBTGMQCM-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000538703352 1038477357 /nfs/dbraw/zinc/47/73/57/1038477357.db2.gz CHGRVUMKJLFKTJ-CQSZACIVSA-N 1 1 342.395 3.867 20 5 EHBDMO C[C@@H]1CCN(C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739852 1038503673 /nfs/dbraw/zinc/50/36/73/1038503673.db2.gz NRWLYCVRFHPQIN-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@@H]1CC[N@H+](C)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739852 1038503682 /nfs/dbraw/zinc/50/36/82/1038503682.db2.gz NRWLYCVRFHPQIN-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739852 1038503694 /nfs/dbraw/zinc/50/36/94/1038503694.db2.gz NRWLYCVRFHPQIN-CQSZACIVSA-N 1 1 345.468 3.849 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000485473037 1039136094 /nfs/dbraw/zinc/13/60/94/1039136094.db2.gz HMALGUOIWVHCKB-PBHICJAKSA-N 1 1 326.396 3.981 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000026854063 1039190365 /nfs/dbraw/zinc/19/03/65/1039190365.db2.gz GDSKISHTZZTMFW-ZDUSSCGKSA-N 1 1 328.368 3.559 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000054669941 1039447816 /nfs/dbraw/zinc/44/78/16/1039447816.db2.gz QORLRXRZTAMMRP-SFHVURJKSA-N 1 1 340.379 3.798 20 5 EHBDMO Cc1cc(C[C@@H](C)[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000417312937 1039670209 /nfs/dbraw/zinc/67/02/09/1039670209.db2.gz UCXDSOJUPVPIEI-KZULUSFZSA-N 1 1 328.416 3.615 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c2cccnc12 ZINC000554834886 1039810330 /nfs/dbraw/zinc/81/03/30/1039810330.db2.gz MMCFFTVNGNWZON-UHFFFAOYSA-N 1 1 339.370 3.957 20 5 EHBDMO COc1ccc([C@H](C)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549809207 1039927409 /nfs/dbraw/zinc/92/74/09/1039927409.db2.gz AHYACSUGECUIJP-OAHLLOKOSA-N 1 1 328.412 3.881 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000489495471 1040040452 /nfs/dbraw/zinc/04/04/52/1040040452.db2.gz JJBPHZUQGQRICA-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428735227 1040113893 /nfs/dbraw/zinc/11/38/93/1040113893.db2.gz PLLPJWNGCBNYON-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428735227 1040113901 /nfs/dbraw/zinc/11/39/01/1040113901.db2.gz PLLPJWNGCBNYON-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000490034290 1040300673 /nfs/dbraw/zinc/30/06/73/1040300673.db2.gz VBXTYPPEPKBEFF-PBHICJAKSA-N 1 1 326.396 3.981 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000490019318 1040310525 /nfs/dbraw/zinc/31/05/25/1040310525.db2.gz JGWSERDMQYZCOK-SFHVURJKSA-N 1 1 325.412 3.714 20 5 EHBDMO CN(C)[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130764 1040365166 /nfs/dbraw/zinc/36/51/66/1040365166.db2.gz OJAKAUPAAHNFTQ-UXHICEINSA-N 1 1 339.439 3.614 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000486772276 1040427501 /nfs/dbraw/zinc/42/75/01/1040427501.db2.gz KPEPJLIIRNVDEB-AWEZNQCLSA-N 1 1 349.431 3.587 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000490309111 1040490940 /nfs/dbraw/zinc/49/09/40/1040490940.db2.gz SMQHYRDCWDFNQD-YYIAUSFCSA-N 1 1 331.460 3.993 20 5 EHBDMO Cc1cscc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000487179521 1040768788 /nfs/dbraw/zinc/76/87/88/1040768788.db2.gz IKSWBGAZPRGVFD-UHFFFAOYSA-N 1 1 328.340 3.856 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1(C)COC1 ZINC000600188266 1040779768 /nfs/dbraw/zinc/77/97/68/1040779768.db2.gz BKOMGVAKDYHMFW-UHFFFAOYSA-N 1 1 332.425 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000600190349 1040799655 /nfs/dbraw/zinc/79/96/55/1040799655.db2.gz OQXGIESABJKDRI-OLZOCXBDSA-N 1 1 344.383 3.666 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](C3CC3)C3CCCC3)o2)cc1 ZINC000107791064 1041972702 /nfs/dbraw/zinc/97/27/02/1041972702.db2.gz CFAVKWAJMBIUQJ-UHFFFAOYSA-N 1 1 328.372 3.552 20 5 EHBDMO CC(C)c1ccccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001167779543 1042142821 /nfs/dbraw/zinc/14/28/21/1042142821.db2.gz UYNRDIASYROEFN-MRXNPFEDSA-N 1 1 340.427 3.800 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032645 1042607391 /nfs/dbraw/zinc/60/73/91/1042607391.db2.gz SPQUPQLHOYTZMS-ZFWWWQNUSA-N 1 1 331.441 3.979 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1C ZINC000090095026 1043367803 /nfs/dbraw/zinc/36/78/03/1043367803.db2.gz WVBSFPKPIMBFMF-ZBFHGGJFSA-N 1 1 340.427 3.576 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+](C3CC3)C3CCCC3)c2)cc1 ZINC000728896140 1043522666 /nfs/dbraw/zinc/52/26/66/1043522666.db2.gz DOSSABADMTYFCS-UHFFFAOYSA-N 1 1 326.400 3.823 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210857 1044162450 /nfs/dbraw/zinc/16/24/50/1044162450.db2.gz FWIQXLHOROAZRZ-IAGOWNOFSA-N 1 1 331.460 3.681 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC4C[C@@H]5CC3C[C@H](C4)C5)nc2c1 ZINC000083169562 1127220399 /nfs/dbraw/zinc/22/03/99/1127220399.db2.gz RVYGYEJJJQVPPU-DOOHLRMFSA-N 1 1 327.384 3.747 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000552137793 1127618392 /nfs/dbraw/zinc/61/83/92/1127618392.db2.gz NAHXLJCRUSDESP-XLCPLWEUSA-N 1 1 332.444 3.729 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564047 1128494693 /nfs/dbraw/zinc/49/46/93/1128494693.db2.gz VRNPDEUWRPYHDB-NVXWUHKLSA-N 1 1 340.427 3.763 20 5 EHBDMO CC[C@H](CSC)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001116650594 1128706132 /nfs/dbraw/zinc/70/61/32/1128706132.db2.gz BJADMFSSINQVTJ-LLVKDONJSA-N 1 1 347.278 3.931 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001116650594 1128706135 /nfs/dbraw/zinc/70/61/35/1128706135.db2.gz BJADMFSSINQVTJ-LLVKDONJSA-N 1 1 347.278 3.931 20 5 EHBDMO Cc1nc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651000 1128847943 /nfs/dbraw/zinc/84/79/43/1128847943.db2.gz JUODLXGCXRDQAN-CXAGYDPISA-N 1 1 346.456 3.855 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC001648832758 1120050617 /nfs/dbraw/zinc/05/06/17/1120050617.db2.gz LDLRYGLFWQZQHJ-ABAIWWIYSA-N 1 1 333.413 3.754 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301067847 1121303486 /nfs/dbraw/zinc/30/34/86/1121303486.db2.gz RIFJBPIMMTXEGV-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO Cc1cnc(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039571 1128977082 /nfs/dbraw/zinc/97/70/82/1128977082.db2.gz DWZQUFWAEDXCEL-DOTOQJQBSA-N 1 1 340.427 3.621 20 5 EHBDMO COc1cc(NCCC[N@@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000301718609 1128980478 /nfs/dbraw/zinc/98/04/78/1128980478.db2.gz DKLRJPJQKQHGRB-UHFFFAOYSA-N 1 1 347.390 3.677 20 5 EHBDMO C[C@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1C ZINC000122683561 1121522712 /nfs/dbraw/zinc/52/27/12/1121522712.db2.gz ZBHGKOVUIYECET-KBPBESRZSA-N 1 1 329.400 3.770 20 5 EHBDMO O=c1[nH]c2ccccc2cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153291073 1121641411 /nfs/dbraw/zinc/64/14/11/1121641411.db2.gz WATBHEHMJAQIDJ-UHFFFAOYSA-N 1 1 349.390 3.601 20 5 EHBDMO CC(C)CC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272561350 1121702098 /nfs/dbraw/zinc/70/20/98/1121702098.db2.gz UCNMGUYQBFMDFV-KRWDZBQOSA-N 1 1 342.443 3.834 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373303 1122586580 /nfs/dbraw/zinc/58/65/80/1122586580.db2.gz RYXQVYFTNQFPSG-VMDGZTHMSA-N 1 1 344.386 3.850 20 5 EHBDMO COc1ccc(C[NH2+]Cc2nc3ccc(F)cc3s2)cc1[N+](=O)[O-] ZINC000428846015 1129098882 /nfs/dbraw/zinc/09/88/82/1129098882.db2.gz OKLYWLZOSQUHGJ-UHFFFAOYSA-N 1 1 347.371 3.642 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800298 1123664412 /nfs/dbraw/zinc/66/44/12/1123664412.db2.gz AARZVUOZDYHWAU-SFHVURJKSA-N 1 1 344.436 3.764 20 5 EHBDMO CCCCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000734829519 1131282900 /nfs/dbraw/zinc/28/29/00/1131282900.db2.gz QFSSEELTZHBECZ-UHFFFAOYSA-N 1 1 331.420 3.711 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCOc2ccccc21 ZINC000619846217 1125416224 /nfs/dbraw/zinc/41/62/24/1125416224.db2.gz FANHWGMBHCWYSN-MRXNPFEDSA-N 1 1 326.396 3.635 20 5 EHBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687112 1129180819 /nfs/dbraw/zinc/18/08/19/1129180819.db2.gz SBJSPKZBTVGACV-CXOKCQFOSA-N 1 1 346.427 3.663 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301861151 1129228735 /nfs/dbraw/zinc/22/87/35/1129228735.db2.gz KVYVAYVJWSTQGX-OAHLLOKOSA-N 1 1 326.400 3.551 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301886396 1129265551 /nfs/dbraw/zinc/26/55/51/1129265551.db2.gz QDLXAORJQGXZPF-OAHLLOKOSA-N 1 1 340.427 3.801 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000067472096 1129277284 /nfs/dbraw/zinc/27/72/84/1129277284.db2.gz UNIDWUMMLPSRED-GHMZBOCLSA-N 1 1 349.337 3.551 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247736 1129371382 /nfs/dbraw/zinc/37/13/82/1129371382.db2.gz HYTRUVCPMJZSAN-UONOGXRCSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000086187639 1129423839 /nfs/dbraw/zinc/42/38/39/1129423839.db2.gz YDYSHVRRMGCQRB-CYBMUJFWSA-N 1 1 337.383 3.965 20 5 EHBDMO CCC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494515 1129492192 /nfs/dbraw/zinc/49/21/92/1129492192.db2.gz DFTCOBWYXOJIAK-CABCVRRESA-N 1 1 333.432 3.742 20 5 EHBDMO CCCC(C)(C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000555070247 1129529129 /nfs/dbraw/zinc/52/91/29/1129529129.db2.gz ACKGPPFPIGKFQN-UHFFFAOYSA-N 1 1 336.461 3.934 20 5 EHBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092073639 1129531975 /nfs/dbraw/zinc/53/19/75/1129531975.db2.gz SBJSPKZBTVGACV-FSNWXROXSA-N 1 1 346.427 3.663 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000327948572 1129539986 /nfs/dbraw/zinc/53/99/86/1129539986.db2.gz BLZQUFXLEHCQSE-RCCFBDPRSA-N 1 1 348.443 3.509 20 5 EHBDMO COCc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000154258362 1129543828 /nfs/dbraw/zinc/54/38/28/1129543828.db2.gz UAKCPSVCPGCUJU-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802856 1129590484 /nfs/dbraw/zinc/59/04/84/1129590484.db2.gz YFWXURGDCNIZEK-MLGOLLRUSA-N 1 1 346.818 3.576 20 5 EHBDMO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000922671698 1129621247 /nfs/dbraw/zinc/62/12/47/1129621247.db2.gz RXNYDDKVRZKVTN-LBPRGKRZSA-N 1 1 346.358 3.760 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])nc1 ZINC000390849043 1129638372 /nfs/dbraw/zinc/63/83/72/1129638372.db2.gz HVQFYKDTGNBKTI-KRWDZBQOSA-N 1 1 340.427 3.702 20 5 EHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304727 1129660047 /nfs/dbraw/zinc/66/00/47/1129660047.db2.gz UJLAKCPTEFGDAT-CABCVRRESA-N 1 1 333.432 3.742 20 5 EHBDMO COc1cc(N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081754 1129767316 /nfs/dbraw/zinc/76/73/16/1129767316.db2.gz YATLHLGMSTZHQX-CVEARBPZSA-N 1 1 347.459 3.694 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000302268906 1129774809 /nfs/dbraw/zinc/77/48/09/1129774809.db2.gz GPNOAGSTHSFZQL-YGRLFVJLSA-N 1 1 344.242 3.822 20 5 EHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000227525030 1129911886 /nfs/dbraw/zinc/91/18/86/1129911886.db2.gz SUDWGEYMFBSNFY-ZNMIVQPWSA-N 1 1 342.443 3.921 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)c2C1 ZINC000171306699 1130044162 /nfs/dbraw/zinc/04/41/62/1130044162.db2.gz KKIDJDPAWCKYIU-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3)c2C1 ZINC000171306699 1130044168 /nfs/dbraw/zinc/04/41/68/1130044168.db2.gz KKIDJDPAWCKYIU-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CCCC[N@@H+]2CC)cc1[N+](=O)[O-] ZINC000245503907 1130224545 /nfs/dbraw/zinc/22/45/45/1130224545.db2.gz JAKUJWWHJAJSBM-ZBFHGGJFSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000245503907 1130224549 /nfs/dbraw/zinc/22/45/49/1130224549.db2.gz JAKUJWWHJAJSBM-ZBFHGGJFSA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000245528189 1130230706 /nfs/dbraw/zinc/23/07/06/1130230706.db2.gz QJIXSGDGBJIGTC-HOTGVXAUSA-N 1 1 342.443 3.652 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174200813 1130340688 /nfs/dbraw/zinc/34/06/88/1130340688.db2.gz AXDGODWIZOQRKZ-KRWDZBQOSA-N 1 1 330.388 3.657 20 5 EHBDMO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885978 1131554421 /nfs/dbraw/zinc/55/44/21/1131554421.db2.gz BJZQEJJGDOTRNS-LSDHHAIUSA-N 1 1 326.824 3.884 20 5 EHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1(C)C ZINC000740885978 1131554425 /nfs/dbraw/zinc/55/44/25/1131554425.db2.gz BJZQEJJGDOTRNS-LSDHHAIUSA-N 1 1 326.824 3.884 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](c3ccncc3)C1)CC2 ZINC001172911305 1131917872 /nfs/dbraw/zinc/91/78/72/1131917872.db2.gz SECGJTKBRZQOTF-OALUTQOASA-N 1 1 337.423 3.727 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2ccc(F)cc2)C1 ZINC001173227265 1132006621 /nfs/dbraw/zinc/00/66/21/1132006621.db2.gz PAWLSDDAARZWTF-LIRRHRJNSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC001173232283 1132008879 /nfs/dbraw/zinc/00/88/79/1132008879.db2.gz AGTAKDGXOQJYAH-KUHUBIRLSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C(=O)c2ccccc2)C1 ZINC001173233809 1132010409 /nfs/dbraw/zinc/01/04/09/1132010409.db2.gz YYWJXLCQEINBSN-YJBOKZPZSA-N 1 1 338.407 3.731 20 5 EHBDMO CCCCn1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)n1 ZINC000773407775 1132477179 /nfs/dbraw/zinc/47/71/79/1132477179.db2.gz CWQAOPDCMVSSQD-UHFFFAOYSA-N 1 1 336.823 3.843 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054563 1132551087 /nfs/dbraw/zinc/55/10/87/1132551087.db2.gz SRISFMQUXGQWFE-NMONBKHDSA-N 1 1 331.416 3.600 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)cc1[N+](=O)[O-] ZINC001169110767 1132671062 /nfs/dbraw/zinc/67/10/62/1132671062.db2.gz DMBMXXBGEGEWAC-OAHLLOKOSA-N 1 1 333.413 3.609 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766840 1133049794 /nfs/dbraw/zinc/04/97/94/1133049794.db2.gz XXEMFNDEPUFUHT-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1F ZINC000768199343 1133106065 /nfs/dbraw/zinc/10/60/65/1133106065.db2.gz HEWGQNBZEWLRCY-ALCCZGGFSA-N 1 1 330.359 3.888 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768541871 1133153928 /nfs/dbraw/zinc/15/39/28/1133153928.db2.gz MDRNVWLBYFHXIU-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000769483877 1133289319 /nfs/dbraw/zinc/28/93/19/1133289319.db2.gz QQJFNTVGECPOTR-IBGZPJMESA-N 1 1 328.412 3.767 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000769446282 1133292905 /nfs/dbraw/zinc/29/29/05/1133292905.db2.gz LUIADKGRZAHMBF-GFCCVEGCSA-N 1 1 336.775 3.729 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000774832436 1134038860 /nfs/dbraw/zinc/03/88/60/1134038860.db2.gz PNYJIGGAOAVUOX-JTQLQIEISA-N 1 1 334.759 3.828 20 5 EHBDMO Cc1ccccc1C[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000746710448 1134051398 /nfs/dbraw/zinc/05/13/98/1134051398.db2.gz FBLYENATWFBCPB-UHFFFAOYSA-N 1 1 336.395 3.875 20 5 EHBDMO Cc1cn2cc(Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)ccc2[nH+]1 ZINC001185438411 1134086184 /nfs/dbraw/zinc/08/61/84/1134086184.db2.gz HILGODHBNXFOLJ-UHFFFAOYSA-N 1 1 337.261 3.708 20 5 EHBDMO CC[C@H]1CN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001186070003 1134164755 /nfs/dbraw/zinc/16/47/55/1134164755.db2.gz MEBJYLAZTLMMTA-HNNXBMFYSA-N 1 1 331.441 3.757 20 5 EHBDMO CCOc1cc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001187081318 1134296790 /nfs/dbraw/zinc/29/67/90/1134296790.db2.gz JYHZBSPREAUCQG-OAHLLOKOSA-N 1 1 333.432 3.812 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C2CC2)C2CCC(C)CC2)c1 ZINC001190398836 1134690907 /nfs/dbraw/zinc/69/09/07/1134690907.db2.gz DBQAVPIZIITTLB-UHFFFAOYSA-N 1 1 346.427 3.925 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353611 1134754470 /nfs/dbraw/zinc/75/44/70/1134754470.db2.gz ZYEKHHYYLHORFU-DOMZBBRYSA-N 1 1 347.440 3.828 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353611 1134754474 /nfs/dbraw/zinc/75/44/74/1134754474.db2.gz ZYEKHHYYLHORFU-DOMZBBRYSA-N 1 1 347.440 3.828 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170347090 1134760042 /nfs/dbraw/zinc/76/00/42/1134760042.db2.gz QCDNSUIFYCCBNI-HNNXBMFYSA-N 1 1 340.423 3.983 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000747207156 1135162813 /nfs/dbraw/zinc/16/28/13/1135162813.db2.gz HKTIEOOOSIYCRN-CYBMUJFWSA-N 1 1 339.411 3.809 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCN(c2cccc(F)c2F)CC1 ZINC001194525022 1135280860 /nfs/dbraw/zinc/28/08/60/1135280860.db2.gz HHOJDWBXKIMOKL-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCN(c2cccc(F)c2F)CC1 ZINC001194525022 1135280865 /nfs/dbraw/zinc/28/08/65/1135280865.db2.gz HHOJDWBXKIMOKL-UHFFFAOYSA-N 1 1 347.365 3.585 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cc2cccc(F)c2F)CC1 ZINC001195074444 1135365177 /nfs/dbraw/zinc/36/51/77/1135365177.db2.gz JQWJWOQKMTYIBW-UHFFFAOYSA-N 1 1 347.365 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1 ZINC001195315922 1135412809 /nfs/dbraw/zinc/41/28/09/1135412809.db2.gz VHGMJUWODKBFQC-OAHLLOKOSA-N 1 1 326.849 3.966 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC[C@@H]2C2CCC2)c1 ZINC001195315922 1135412811 /nfs/dbraw/zinc/41/28/11/1135412811.db2.gz VHGMJUWODKBFQC-OAHLLOKOSA-N 1 1 326.849 3.966 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613091 1135589429 /nfs/dbraw/zinc/58/94/29/1135589429.db2.gz HTUWVHRXYYYZRL-NQHOJNORSA-N 1 1 332.400 3.560 20 5 EHBDMO CC(C)c1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810836981 1136011485 /nfs/dbraw/zinc/01/14/85/1136011485.db2.gz JQJQZJOYOGOLAM-LSDHHAIUSA-N 1 1 332.400 3.502 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473922 1136095899 /nfs/dbraw/zinc/09/58/99/1136095899.db2.gz QTAJEAPOBLEXLW-NSHDSACASA-N 1 1 346.258 3.723 20 5 EHBDMO C[C@H]1CCCN(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473922 1136095903 /nfs/dbraw/zinc/09/59/03/1136095903.db2.gz QTAJEAPOBLEXLW-NSHDSACASA-N 1 1 346.258 3.723 20 5 EHBDMO CC[C@H](C)[N@@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811477081 1136096164 /nfs/dbraw/zinc/09/61/64/1136096164.db2.gz DKXMSMVWPGSGIR-JTQLQIEISA-N 1 1 334.247 3.722 20 5 EHBDMO C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254067 1136104717 /nfs/dbraw/zinc/10/47/17/1136104717.db2.gz QYEVCQLEMUGIGX-ZWKOTPCHSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254067 1136104718 /nfs/dbraw/zinc/10/47/18/1136104718.db2.gz QYEVCQLEMUGIGX-ZWKOTPCHSA-N 1 1 345.830 3.783 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274958 1136129238 /nfs/dbraw/zinc/12/92/38/1136129238.db2.gz DYSRNZCYUMMEPZ-SJCJKPOMSA-N 1 1 334.803 3.975 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279849 1136133799 /nfs/dbraw/zinc/13/37/99/1136133799.db2.gz ZELIPEADOGLSBY-DNVCBOLYSA-N 1 1 328.412 3.938 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(C)c([N+](=O)[O-])cc2F)cn1 ZINC000812455292 1136210707 /nfs/dbraw/zinc/21/07/07/1136210707.db2.gz GVYHLLDNPYXYEB-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190382 1136341383 /nfs/dbraw/zinc/34/13/83/1136341383.db2.gz OADQQRRUZPCSFL-IUODEOHRSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000852066245 1136430913 /nfs/dbraw/zinc/43/09/13/1136430913.db2.gz MXBDBMKSLIXGSA-SCLBCKFNSA-N 1 1 332.375 3.678 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585019 1136442296 /nfs/dbraw/zinc/44/22/96/1136442296.db2.gz QXZCMFQLLSPSJU-XAUMDUMWSA-N 1 1 340.423 3.815 20 5 EHBDMO CCC[N@H+](Cc1ccc(F)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579114 1136444355 /nfs/dbraw/zinc/44/43/55/1136444355.db2.gz JSVSBMABOUKHCD-SFHVURJKSA-N 1 1 332.375 3.680 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586085 1136445523 /nfs/dbraw/zinc/44/55/23/1136445523.db2.gz JLVZGAKNDBVMJS-ICSRJNTNSA-N 1 1 342.439 3.971 20 5 EHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588697 1136453101 /nfs/dbraw/zinc/45/31/01/1136453101.db2.gz NXTNMRJAGUIMAG-QUCCMNQESA-N 1 1 342.439 3.890 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@@H](c1ccccc1)C1(CO)CCC1 ZINC000814666770 1136491954 /nfs/dbraw/zinc/49/19/54/1136491954.db2.gz HWYSHHFJGDQVES-SFHVURJKSA-N 1 1 344.386 3.727 20 5 EHBDMO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000339000369 1136825200 /nfs/dbraw/zinc/82/52/00/1136825200.db2.gz LRNAODBBBOLARG-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1cc([NH+]2CCCC2)ccc1NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819397702 1136935995 /nfs/dbraw/zinc/93/59/95/1136935995.db2.gz MJOHKSKADNCYQM-LJQANCHMSA-N 1 1 341.411 3.649 20 5 EHBDMO Cc1c(CN(C)Cc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000859214173 1137008267 /nfs/dbraw/zinc/00/82/67/1137008267.db2.gz NMHCZIKHOMAAFL-UHFFFAOYSA-N 1 1 327.428 3.597 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1F ZINC000859641213 1137024102 /nfs/dbraw/zinc/02/41/02/1137024102.db2.gz DZBVKHKXWSFDRG-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@](C)(O)c1ccccc1 ZINC000822516310 1137063885 /nfs/dbraw/zinc/06/38/85/1137063885.db2.gz KGRXZPJUEDXXFO-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000825214890 1137169118 /nfs/dbraw/zinc/16/91/18/1137169118.db2.gz ABTKUSHICKWATE-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO CCn1cc(C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C(C)C)cn1 ZINC000844418076 1137218997 /nfs/dbraw/zinc/21/89/97/1137218997.db2.gz QFOLJOVJIUPEDF-UHFFFAOYSA-N 1 1 336.823 3.875 20 5 EHBDMO CCn1cc(C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C(C)C)cn1 ZINC000844418076 1137218998 /nfs/dbraw/zinc/21/89/98/1137218998.db2.gz QFOLJOVJIUPEDF-UHFFFAOYSA-N 1 1 336.823 3.875 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccnn2CC2CCC2)c1 ZINC000865490510 1137288437 /nfs/dbraw/zinc/28/84/37/1137288437.db2.gz XTPNIQUFOZAWDV-UHFFFAOYSA-N 1 1 334.807 3.535 20 5 EHBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000845529343 1137297006 /nfs/dbraw/zinc/29/70/06/1137297006.db2.gz VDKKICISSZFQBZ-JTQLQIEISA-N 1 1 338.770 3.505 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCCC1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000866542339 1137363361 /nfs/dbraw/zinc/36/33/61/1137363361.db2.gz YVABNPJUXFAANJ-QGZVFWFLSA-N 1 1 328.416 3.588 20 5 EHBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001171741353 1137511184 /nfs/dbraw/zinc/51/11/84/1137511184.db2.gz NMLIPYJQUVXDPC-HNNXBMFYSA-N 1 1 326.396 3.635 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000872047683 1137567723 /nfs/dbraw/zinc/56/77/23/1137567723.db2.gz COJRLOYNOCUDQC-IINYFYTJSA-N 1 1 332.429 3.768 20 5 EHBDMO CC(=O)N(C)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872087132 1137570607 /nfs/dbraw/zinc/57/06/07/1137570607.db2.gz GFPQVBZIZADRPX-LBPRGKRZSA-N 1 1 345.374 3.567 20 5 EHBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1 ZINC000873185458 1137593050 /nfs/dbraw/zinc/59/30/50/1137593050.db2.gz VIJSXSVVMDVYQM-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO CC[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878183166 1137706168 /nfs/dbraw/zinc/70/61/68/1137706168.db2.gz CSHMOSWWOUFWTQ-JTQLQIEISA-N 1 1 336.779 3.530 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878187146 1137706228 /nfs/dbraw/zinc/70/62/28/1137706228.db2.gz QVBSNZFPSUBVIU-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000131431886 1137853047 /nfs/dbraw/zinc/85/30/47/1137853047.db2.gz DDPHCAVNEOHVFH-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO CC(C)[N@H+](C)Cc1cccc(CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000131431886 1137853048 /nfs/dbraw/zinc/85/30/48/1137853048.db2.gz DDPHCAVNEOHVFH-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO CC(C)[N@@H+](C)Cc1cccc(CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000131431886 1137853049 /nfs/dbraw/zinc/85/30/49/1137853049.db2.gz DDPHCAVNEOHVFH-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2ccc(F)c(F)c2)CC1 ZINC000885988325 1138030560 /nfs/dbraw/zinc/03/05/60/1138030560.db2.gz ICNILHHOWMFURD-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075866244 1138128928 /nfs/dbraw/zinc/12/89/28/1138128928.db2.gz QUJKZRWZOPFAAZ-KRWDZBQOSA-N 1 1 326.396 3.634 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2(CCC2)C1 ZINC000123520498 1138271070 /nfs/dbraw/zinc/27/10/70/1138271070.db2.gz GLQGHIJUJPCACI-GFCCVEGCSA-N 1 1 328.372 3.582 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000124728969 1138293577 /nfs/dbraw/zinc/29/35/77/1138293577.db2.gz RGDXIMALXZBQFY-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336980791 1138440826 /nfs/dbraw/zinc/44/08/26/1138440826.db2.gz FEGGKQSZIGRLIE-ZDUSSCGKSA-N 1 1 345.374 3.756 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178793887 1139718120 /nfs/dbraw/zinc/71/81/20/1139718120.db2.gz MLYVLIAIEDFPKY-NPMABZOXSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000178793887 1139718124 /nfs/dbraw/zinc/71/81/24/1139718124.db2.gz MLYVLIAIEDFPKY-NPMABZOXSA-N 1 1 332.425 3.525 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182380039 1139968709 /nfs/dbraw/zinc/96/87/09/1139968709.db2.gz CPGKUJKWKVCZIE-OAHLLOKOSA-N 1 1 334.807 3.925 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182380039 1139968713 /nfs/dbraw/zinc/96/87/13/1139968713.db2.gz CPGKUJKWKVCZIE-OAHLLOKOSA-N 1 1 334.807 3.925 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865690 1140174610 /nfs/dbraw/zinc/17/46/10/1140174610.db2.gz GIMJCOKFJFJNJP-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(C)(O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000187505351 1140258165 /nfs/dbraw/zinc/25/81/65/1140258165.db2.gz XSWHZSBYQJNJFT-UHFFFAOYSA-N 1 1 334.803 3.765 20 5 EHBDMO CCCn1ccnc1CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000191491736 1140466923 /nfs/dbraw/zinc/46/69/23/1140466923.db2.gz KAWVFQXLVKNGHY-UHFFFAOYSA-N 1 1 330.432 3.574 20 5 EHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1cc(N)ccc1[N+](=O)[O-] ZINC000192779334 1140550196 /nfs/dbraw/zinc/55/01/96/1140550196.db2.gz APAXZDFMFUUBRW-UHFFFAOYSA-N 1 1 328.416 3.629 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000268932988 1141028225 /nfs/dbraw/zinc/02/82/25/1141028225.db2.gz SXLITDRXOCVWKR-LBPRGKRZSA-N 1 1 346.431 3.714 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634843 1141130041 /nfs/dbraw/zinc/13/00/41/1141130041.db2.gz AFDRQEPHEWTHAP-APPDUMDISA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634843 1141130045 /nfs/dbraw/zinc/13/00/45/1141130045.db2.gz AFDRQEPHEWTHAP-APPDUMDISA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891851 1141280564 /nfs/dbraw/zinc/28/05/64/1141280564.db2.gz PGJQAJVQSXMVLO-GXTWGEPZSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891851 1141280568 /nfs/dbraw/zinc/28/05/68/1141280568.db2.gz PGJQAJVQSXMVLO-GXTWGEPZSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000270891851 1141280572 /nfs/dbraw/zinc/28/05/72/1141280572.db2.gz PGJQAJVQSXMVLO-GXTWGEPZSA-N 1 1 341.415 3.531 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CCO)c1ccccc1 ZINC000271623929 1141407589 /nfs/dbraw/zinc/40/75/89/1141407589.db2.gz DMHGFYPKKRNYCI-SFHVURJKSA-N 1 1 344.411 3.595 20 5 EHBDMO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271624261 1141408003 /nfs/dbraw/zinc/40/80/03/1141408003.db2.gz NHWYGWRNWVUHHK-LSDHHAIUSA-N 1 1 341.411 3.889 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1OC ZINC000348631336 1141557532 /nfs/dbraw/zinc/55/75/32/1141557532.db2.gz CNMZIVJLNKXOFQ-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430222796 1015092890 /nfs/dbraw/zinc/09/28/90/1015092890.db2.gz TVMDVHMAHSCFOV-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000536677802 1032120332 /nfs/dbraw/zinc/12/03/32/1032120332.db2.gz KNHPXYQMUJJOMN-UHFFFAOYSA-N 1 1 328.368 3.992 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000533511377 1015850413 /nfs/dbraw/zinc/85/04/13/1015850413.db2.gz FADKVYRIQZXYOJ-OLMMMNRUSA-N 1 1 331.460 3.993 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941315 1016159966 /nfs/dbraw/zinc/15/99/66/1016159966.db2.gz ZFYSHGAABDHQLO-OLZOCXBDSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246944284 1016193477 /nfs/dbraw/zinc/19/34/77/1016193477.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246944284 1016193481 /nfs/dbraw/zinc/19/34/81/1016193481.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246944284 1016193487 /nfs/dbraw/zinc/19/34/87/1016193487.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 1 1 329.444 3.605 20 5 EHBDMO Cc1cc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ncc1[N+](=O)[O-] ZINC000074744955 1032217266 /nfs/dbraw/zinc/21/72/66/1032217266.db2.gz FFQMNQASMHBQOT-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CCN(C3CCC3)CC1)CCC2 ZINC000278745108 1032279488 /nfs/dbraw/zinc/27/94/88/1032279488.db2.gz NOEGGZYHTVRXHR-IBGZPJMESA-N 1 1 329.444 3.579 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000278763414 1032441436 /nfs/dbraw/zinc/44/14/36/1032441436.db2.gz MUCJJGZGGBNDFE-SECBINFHSA-N 1 1 336.285 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000278763414 1032441441 /nfs/dbraw/zinc/44/14/41/1032441441.db2.gz MUCJJGZGGBNDFE-SECBINFHSA-N 1 1 336.285 3.517 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccnn1C1CCCC1 ZINC000449313903 1032448205 /nfs/dbraw/zinc/44/82/05/1032448205.db2.gz PZYJGJPLGRLGKC-UHFFFAOYSA-N 1 1 328.416 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCSC4(CCCCC4)C3)nc2c1 ZINC000547853096 1017087336 /nfs/dbraw/zinc/08/73/36/1017087336.db2.gz MYIIMJGRNZJJAN-UHFFFAOYSA-N 1 1 346.456 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCSC4(CCCCC4)C3)nc2c1 ZINC000547853096 1017087345 /nfs/dbraw/zinc/08/73/45/1017087345.db2.gz MYIIMJGRNZJJAN-UHFFFAOYSA-N 1 1 346.456 3.723 20 5 EHBDMO CCN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]CC1 ZINC000414720662 1017153936 /nfs/dbraw/zinc/15/39/36/1017153936.db2.gz ZIZSWXQVIAAIDN-HNNXBMFYSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892729822 1017241554 /nfs/dbraw/zinc/24/15/54/1017241554.db2.gz CBQVLHWCORKEHC-GFCCVEGCSA-N 1 1 348.834 3.574 20 5 EHBDMO O=C(C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000177393335 1017652622 /nfs/dbraw/zinc/65/26/22/1017652622.db2.gz GFBXIYVOIASWIN-CQSZACIVSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000177393335 1017652627 /nfs/dbraw/zinc/65/26/27/1017652627.db2.gz GFBXIYVOIASWIN-CQSZACIVSA-N 1 1 330.409 3.894 20 5 EHBDMO Cc1ncc2c(n1)CCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892948791 1017912165 /nfs/dbraw/zinc/91/21/65/1017912165.db2.gz AQDTYALISJGKIX-AWEZNQCLSA-N 1 1 332.791 3.514 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072748 1032764025 /nfs/dbraw/zinc/76/40/25/1032764025.db2.gz KEAMYLBHTGPGTP-OAHLLOKOSA-N 1 1 328.416 3.821 20 5 EHBDMO COc1ccc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000052306340 1018919580 /nfs/dbraw/zinc/91/95/80/1018919580.db2.gz ZRACKHSBRFUIOU-UHFFFAOYSA-N 1 1 340.379 3.598 20 5 EHBDMO COc1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000052306340 1018919596 /nfs/dbraw/zinc/91/95/96/1018919596.db2.gz ZRACKHSBRFUIOU-UHFFFAOYSA-N 1 1 340.379 3.598 20 5 EHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410599 1018934014 /nfs/dbraw/zinc/93/40/14/1018934014.db2.gz VJCAACNBIZWXAK-ZYHUDNBSSA-N 1 1 344.358 3.825 20 5 EHBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])nc1 ZINC000398038051 1018957791 /nfs/dbraw/zinc/95/77/91/1018957791.db2.gz QQMKBLFHUZSJRT-QGZVFWFLSA-N 1 1 328.416 3.558 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637259 1019010541 /nfs/dbraw/zinc/01/05/41/1019010541.db2.gz SHBRLPZFBRZXLD-LPHOPBHVSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000379637259 1019010557 /nfs/dbraw/zinc/01/05/57/1019010557.db2.gz SHBRLPZFBRZXLD-LPHOPBHVSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275625 1019495448 /nfs/dbraw/zinc/49/54/48/1019495448.db2.gz HYSAHOFXEUBUCS-KBXCAEBGSA-N 1 1 339.395 3.616 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513275625 1019495456 /nfs/dbraw/zinc/49/54/56/1019495456.db2.gz HYSAHOFXEUBUCS-KBXCAEBGSA-N 1 1 339.395 3.616 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CCCC[N@H+]2C2CC2)ccc2ncccc21 ZINC000433803703 1019647383 /nfs/dbraw/zinc/64/73/83/1019647383.db2.gz NGLOZNNAGBBSQN-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1occc1C[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157797395 1020463107 /nfs/dbraw/zinc/46/31/07/1020463107.db2.gz QIKINNPMXVQZKT-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1occc1C[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157797395 1020463110 /nfs/dbraw/zinc/46/31/10/1020463110.db2.gz QIKINNPMXVQZKT-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO C[N@@H+](CCC1CCOCC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602470391 1032906304 /nfs/dbraw/zinc/90/63/04/1032906304.db2.gz DSXHIZLNAZQQIA-UHFFFAOYSA-N 1 1 346.349 3.862 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1Cc2ccccc2C1 ZINC000511670556 1020757983 /nfs/dbraw/zinc/75/79/83/1020757983.db2.gz JDOCQZPQIVVATB-UHFFFAOYSA-N 1 1 348.349 3.795 20 5 EHBDMO CC(=O)Nc1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135226723 1020919406 /nfs/dbraw/zinc/91/94/06/1020919406.db2.gz LPIVVWBJLUUSLD-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CC(=O)Nc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135226723 1020919411 /nfs/dbraw/zinc/91/94/11/1020919411.db2.gz LPIVVWBJLUUSLD-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015300613 1021659427 /nfs/dbraw/zinc/65/94/27/1021659427.db2.gz FXTWRKNUBLTVNO-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015300613 1021659435 /nfs/dbraw/zinc/65/94/35/1021659435.db2.gz FXTWRKNUBLTVNO-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNCC[C@H]2CCC[NH2+]2)s1 ZINC000414900838 1021719711 /nfs/dbraw/zinc/71/97/11/1021719711.db2.gz FBDMTAFRICLSMA-CYBMUJFWSA-N 1 1 331.441 3.555 20 5 EHBDMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000015312402 1021881238 /nfs/dbraw/zinc/88/12/38/1021881238.db2.gz SYZRITZPRADBMK-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000015312402 1021881254 /nfs/dbraw/zinc/88/12/54/1021881254.db2.gz SYZRITZPRADBMK-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1cccc2c1CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000426577722 1021972220 /nfs/dbraw/zinc/97/22/20/1021972220.db2.gz DKGSESKSACQYLQ-UHFFFAOYSA-N 1 1 326.396 3.513 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H](CCO)CC1 ZINC000602693291 1033074016 /nfs/dbraw/zinc/07/40/16/1033074016.db2.gz FJXRZFUUQHYYNG-GFCCVEGCSA-N 1 1 346.349 3.598 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)c1 ZINC000438563097 1022793139 /nfs/dbraw/zinc/79/31/39/1022793139.db2.gz SAFXHYSZZXACHI-LENZSSGSSA-N 1 1 340.427 3.749 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)o1 ZINC000510677329 1022874315 /nfs/dbraw/zinc/87/43/15/1022874315.db2.gz BVADQUVWMHZBIY-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)o1 ZINC000510677329 1022874330 /nfs/dbraw/zinc/87/43/30/1022874330.db2.gz BVADQUVWMHZBIY-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000008320673 1022948123 /nfs/dbraw/zinc/94/81/23/1022948123.db2.gz UEQFAQQQCORARX-HNNXBMFYSA-N 1 1 345.424 3.740 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1c1cccs1 ZINC000008320673 1022948136 /nfs/dbraw/zinc/94/81/36/1022948136.db2.gz UEQFAQQQCORARX-HNNXBMFYSA-N 1 1 345.424 3.740 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000509573910 1023071346 /nfs/dbraw/zinc/07/13/46/1023071346.db2.gz WBFUMSOYDPMNPZ-OAHLLOKOSA-N 1 1 349.475 3.594 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)N1CCC[C@@H](C)C1 ZINC000509573910 1023071353 /nfs/dbraw/zinc/07/13/53/1023071353.db2.gz WBFUMSOYDPMNPZ-OAHLLOKOSA-N 1 1 349.475 3.594 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000602742679 1033107292 /nfs/dbraw/zinc/10/72/92/1033107292.db2.gz NAIOBMAREYVQFB-RKDXNWHRSA-N 1 1 328.212 3.654 20 5 EHBDMO CC[N@H+](Cc1ccccc1C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000507117621 1023138184 /nfs/dbraw/zinc/13/81/84/1023138184.db2.gz VGQQYCIAYIWZFW-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000507117621 1023138191 /nfs/dbraw/zinc/13/81/91/1023138191.db2.gz VGQQYCIAYIWZFW-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO Cc1c(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000507256800 1023213861 /nfs/dbraw/zinc/21/38/61/1023213861.db2.gz LSXQUUSYZKGNSZ-IBGZPJMESA-N 1 1 326.396 3.649 20 5 EHBDMO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000602801233 1033175873 /nfs/dbraw/zinc/17/58/73/1033175873.db2.gz MGWGBUCKSLQZDK-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176400 1024202082 /nfs/dbraw/zinc/20/20/82/1024202082.db2.gz PBOYEFHPLSBSDC-ZANVPECISA-N 1 1 329.322 3.508 20 5 EHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500303 1024242818 /nfs/dbraw/zinc/24/28/18/1024242818.db2.gz SMICETROQZKRJV-GWCFXTLKSA-N 1 1 327.222 3.978 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC[C@H]2C2CC2)s1 ZINC000538735735 1024497324 /nfs/dbraw/zinc/49/73/24/1024497324.db2.gz YDZFCNFNFZISFA-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC[C@H]2C2CC2)s1 ZINC000538735735 1024497329 /nfs/dbraw/zinc/49/73/29/1024497329.db2.gz YDZFCNFNFZISFA-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1 ZINC000281138932 1024690422 /nfs/dbraw/zinc/69/04/22/1024690422.db2.gz DPLVFOPDLZKCAY-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1 ZINC000281138932 1024690432 /nfs/dbraw/zinc/69/04/32/1024690432.db2.gz DPLVFOPDLZKCAY-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO CCCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000611568323 1024750731 /nfs/dbraw/zinc/75/07/31/1024750731.db2.gz WKNYTIXVOIEURR-UHFFFAOYSA-N 1 1 348.422 3.931 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507913350 1024762859 /nfs/dbraw/zinc/76/28/59/1024762859.db2.gz KJZRAOYTBLRWRJ-OAHLLOKOSA-N 1 1 343.402 3.613 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]([C@@H]4CCCO4)C3)o2)c1 ZINC000895842269 1024888559 /nfs/dbraw/zinc/88/85/59/1024888559.db2.gz CXSNEHVLSPXVNY-YJBOKZPZSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1cc(NCCCC[N@H+]2CCCC[C@@H]2C)c(F)cc1[N+](=O)[O-] ZINC000508264021 1024993932 /nfs/dbraw/zinc/99/39/32/1024993932.db2.gz JVWPBTYMNAZZNO-ZDUSSCGKSA-N 1 1 339.411 3.809 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H](OC)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551275504 1025238670 /nfs/dbraw/zinc/23/86/70/1025238670.db2.gz UNLGLAKUKGGSBJ-RTBURBONSA-N 1 1 344.411 3.854 20 5 EHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccco1 ZINC000602924159 1033270929 /nfs/dbraw/zinc/27/09/29/1033270929.db2.gz BGZYHAAZRWLHFN-KRWDZBQOSA-N 1 1 343.383 3.600 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195308 1025662401 /nfs/dbraw/zinc/66/24/01/1025662401.db2.gz JQBOFFQFEQVNIO-CZUORRHYSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195308 1025662404 /nfs/dbraw/zinc/66/24/04/1025662404.db2.gz JQBOFFQFEQVNIO-CZUORRHYSA-N 1 1 327.384 3.582 20 5 EHBDMO CC[NH+](CC)[C@@H](CNCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000521819156 1025707264 /nfs/dbraw/zinc/70/72/64/1025707264.db2.gz UHKHHWMBKMTBLC-HXUWFJFHSA-N 1 1 341.455 3.638 20 5 EHBDMO CC(C)[N@@H+](CCCO[C@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000338234136 1025982794 /nfs/dbraw/zinc/98/27/94/1025982794.db2.gz WECKRRXDQZXXCZ-SFHVURJKSA-N 1 1 336.432 3.739 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccc(F)cc2o1 ZINC000511110409 1026077240 /nfs/dbraw/zinc/07/72/40/1026077240.db2.gz YJPMUDKGLBYWTJ-UHFFFAOYSA-N 1 1 329.331 3.550 20 5 EHBDMO CCOC(=O)CCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544905 1026091410 /nfs/dbraw/zinc/09/14/10/1026091410.db2.gz GEDVJZGBYYYQFD-MRXNPFEDSA-N 1 1 334.416 3.508 20 5 EHBDMO CC(C)(C)c1noc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451560757 1026113099 /nfs/dbraw/zinc/11/30/99/1026113099.db2.gz IGXPCUIDYUCDEB-CQSZACIVSA-N 1 1 344.415 3.655 20 5 EHBDMO CC(C)(C)c1noc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451560757 1026113113 /nfs/dbraw/zinc/11/31/13/1026113113.db2.gz IGXPCUIDYUCDEB-CQSZACIVSA-N 1 1 344.415 3.655 20 5 EHBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100777 1026374846 /nfs/dbraw/zinc/37/48/46/1026374846.db2.gz VCGUXVDPVGHTRM-IAQYHMDHSA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C2CC2)O1 ZINC000475282913 1026441423 /nfs/dbraw/zinc/44/14/23/1026441423.db2.gz VCOUGDBAKAQXCD-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C2CC2)O1 ZINC000475282913 1026441429 /nfs/dbraw/zinc/44/14/29/1026441429.db2.gz VCOUGDBAKAQXCD-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C2CC2)O1 ZINC000475296341 1026448446 /nfs/dbraw/zinc/44/84/46/1026448446.db2.gz UJFKVNNUMBAHNJ-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C2CC2)O1 ZINC000475296341 1026448452 /nfs/dbraw/zinc/44/84/52/1026448452.db2.gz UJFKVNNUMBAHNJ-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067682 1026461489 /nfs/dbraw/zinc/46/14/89/1026461489.db2.gz ANXGCSRRGIAFLO-ZDUSSCGKSA-N 1 1 344.415 3.903 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC000531164059 1026636698 /nfs/dbraw/zinc/63/66/98/1026636698.db2.gz NHOVJQJFRLQHAR-HXUWFJFHSA-N 1 1 340.423 3.857 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000301382738 1026784557 /nfs/dbraw/zinc/78/45/57/1026784557.db2.gz VGTHVIIEVNFOKO-NEPJUHHUSA-N 1 1 343.374 3.729 20 5 EHBDMO CC(C)[NH+](CCN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(C)C ZINC000480080391 1026982760 /nfs/dbraw/zinc/98/27/60/1026982760.db2.gz LFHJVVCXMBTUMR-GOSISDBHSA-N 1 1 333.476 3.624 20 5 EHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531587150 1027076507 /nfs/dbraw/zinc/07/65/07/1027076507.db2.gz PLWMDMAKACANPA-CQSZACIVSA-N 1 1 334.416 3.719 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccc3cn[nH]c3c1)CCC2 ZINC000342816030 1027361881 /nfs/dbraw/zinc/36/18/81/1027361881.db2.gz SLIYTDFDKDCMDZ-GOSISDBHSA-N 1 1 336.395 3.681 20 5 EHBDMO Cc1cc(Nc2ccc([N+](=O)[O-])nc2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503277899 1027700018 /nfs/dbraw/zinc/70/00/18/1027700018.db2.gz ZSFYUFGNKUMSTL-ZDUSSCGKSA-N 1 1 327.388 3.816 20 5 EHBDMO Cc1nc(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781586 1027788307 /nfs/dbraw/zinc/78/83/07/1027788307.db2.gz BQOJWUNUAQKKFM-PBHICJAKSA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420944262 1027901840 /nfs/dbraw/zinc/90/18/40/1027901840.db2.gz JGUSDVNDJBDTGX-LBPRGKRZSA-N 1 1 332.322 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@]2(CO)CCCc3ccccc32)c(Cl)c1 ZINC000440467365 1028057724 /nfs/dbraw/zinc/05/77/24/1028057724.db2.gz RGVBDVUQYMFIAN-GOSISDBHSA-N 1 1 346.814 3.562 20 5 EHBDMO COC[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467118633 1028206159 /nfs/dbraw/zinc/20/61/59/1028206159.db2.gz PCYQZFXXZNOEFF-HNNXBMFYSA-N 1 1 336.432 3.631 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](n3ncc4ccccc43)C2)cc1F ZINC000366969947 1028489861 /nfs/dbraw/zinc/48/98/61/1028489861.db2.gz OSFQMSUUZDBSBH-HNNXBMFYSA-N 1 1 340.358 3.531 20 5 EHBDMO COc1cc(C[N@@H+](C)CC(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000524276551 1029049209 /nfs/dbraw/zinc/04/92/09/1029049209.db2.gz WTUWIIQZOBLOFT-UHFFFAOYSA-N 1 1 332.347 3.683 20 5 EHBDMO Cc1ccc(CNC[C@H]2CC[N@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409448 1029068280 /nfs/dbraw/zinc/06/82/80/1029068280.db2.gz YLPAHORNASLSPR-GOSISDBHSA-N 1 1 331.460 3.790 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@H]2CCN2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409448 1029068296 /nfs/dbraw/zinc/06/82/96/1029068296.db2.gz YLPAHORNASLSPR-GOSISDBHSA-N 1 1 331.460 3.790 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923540 1029109532 /nfs/dbraw/zinc/10/95/32/1029109532.db2.gz BKHPYAMWTHGORM-BXUZGUMPSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923540 1029109541 /nfs/dbraw/zinc/10/95/41/1029109541.db2.gz BKHPYAMWTHGORM-BXUZGUMPSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000126361691 1029341810 /nfs/dbraw/zinc/34/18/10/1029341810.db2.gz YICBLBRHGBNYHQ-IBGZPJMESA-N 1 1 326.396 3.519 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000126361691 1029341819 /nfs/dbraw/zinc/34/18/19/1029341819.db2.gz YICBLBRHGBNYHQ-IBGZPJMESA-N 1 1 326.396 3.519 20 5 EHBDMO CC1(C)CCCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000446086146 1029376628 /nfs/dbraw/zinc/37/66/28/1029376628.db2.gz YDZUKHMNHGXJBP-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO CC(C)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000533254677 1029534678 /nfs/dbraw/zinc/53/46/78/1029534678.db2.gz FSBOHTYDADBCBX-UHFFFAOYSA-N 1 1 341.411 3.692 20 5 EHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525410913 1029840152 /nfs/dbraw/zinc/84/01/52/1029840152.db2.gz PNTGINFIEMKSLV-CGTJXYLNSA-N 1 1 348.443 3.629 20 5 EHBDMO CCS[C@H]1CCCC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509648919 1029944109 /nfs/dbraw/zinc/94/41/09/1029944109.db2.gz CXSIPVLEOCIPJL-LBPRGKRZSA-N 1 1 330.400 3.981 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509648919 1029944124 /nfs/dbraw/zinc/94/41/24/1029944124.db2.gz CXSIPVLEOCIPJL-LBPRGKRZSA-N 1 1 330.400 3.981 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CC2)OCCc2ccccc23)cs1 ZINC000453572013 1030359194 /nfs/dbraw/zinc/35/91/94/1030359194.db2.gz GHNDRQUWVLFMDP-UHFFFAOYSA-N 1 1 344.436 3.720 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128667950 1030401270 /nfs/dbraw/zinc/40/12/70/1030401270.db2.gz UQXHYZLPGKUNHX-MRXNPFEDSA-N 1 1 337.395 3.573 20 5 EHBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073327 1030939297 /nfs/dbraw/zinc/93/92/97/1030939297.db2.gz XVXJDYUZOQPIGB-KUHUBIRLSA-N 1 1 342.395 3.675 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483226984 1031040309 /nfs/dbraw/zinc/04/03/09/1031040309.db2.gz JGSULRNQKXRNSW-CQSZACIVSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC1CC1)CC1CCC1 ZINC000483276239 1031083532 /nfs/dbraw/zinc/08/35/32/1031083532.db2.gz DVIIHCBJZOSCMU-UHFFFAOYSA-N 1 1 345.443 3.744 20 5 EHBDMO CC[C@@H](N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807237 1031341857 /nfs/dbraw/zinc/34/18/57/1031341857.db2.gz LZSWMABKDKUVPZ-IEBWSBKVSA-N 1 1 331.460 3.900 20 5 EHBDMO CC[C@@H]([NH2+][C@@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807237 1031341872 /nfs/dbraw/zinc/34/18/72/1031341872.db2.gz LZSWMABKDKUVPZ-IEBWSBKVSA-N 1 1 331.460 3.900 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161242803 1031428351 /nfs/dbraw/zinc/42/83/51/1031428351.db2.gz WRIXLILWBLKQTR-BXUZGUMPSA-N 1 1 343.349 3.534 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737963 1031705252 /nfs/dbraw/zinc/70/52/52/1031705252.db2.gz HERGFMCDWSRMQA-FRRDWIJNSA-N 1 1 330.388 3.511 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000235737348 1033409931 /nfs/dbraw/zinc/40/99/31/1033409931.db2.gz FAUQPZUEACTAGG-QWRGUYRKSA-N 1 1 342.237 3.560 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594603456 1033448768 /nfs/dbraw/zinc/44/87/68/1033448768.db2.gz VJSZVSRQCIOUKG-RDJZCZTQSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292779 1033555167 /nfs/dbraw/zinc/55/51/67/1033555167.db2.gz NEMYBXOUWMBCEA-NVXWUHKLSA-N 1 1 346.456 3.570 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(C(F)F)nc1 ZINC000595009911 1033605085 /nfs/dbraw/zinc/60/50/85/1033605085.db2.gz DYCGQXVHIILZJV-SNVBAGLBSA-N 1 1 337.326 3.787 20 5 EHBDMO COCC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(C)o1 ZINC000595034171 1033655081 /nfs/dbraw/zinc/65/50/81/1033655081.db2.gz QCMBLXZADKBEAE-XJKSGUPXSA-N 1 1 348.399 3.933 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000595042562 1033660348 /nfs/dbraw/zinc/66/03/48/1033660348.db2.gz AMMSCGCNPPPKCZ-PXAZEXFGSA-N 1 1 328.368 3.526 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H]2COC(C)(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595048324 1033665723 /nfs/dbraw/zinc/66/57/23/1033665723.db2.gz KBHAWPMYIGRHMV-KBXCAEBGSA-N 1 1 344.411 3.997 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000595356400 1033782362 /nfs/dbraw/zinc/78/23/62/1033782362.db2.gz LZCUFSDEAHPHAH-AWEZNQCLSA-N 1 1 340.383 3.752 20 5 EHBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595411001 1033788354 /nfs/dbraw/zinc/78/83/54/1033788354.db2.gz KZEOFRPQLJYDQL-CQSZACIVSA-N 1 1 332.375 3.507 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000595440708 1033803795 /nfs/dbraw/zinc/80/37/95/1033803795.db2.gz GJFUGZRQBBSLNK-UHFFFAOYSA-N 1 1 335.791 3.924 20 5 EHBDMO Cc1cnc(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)s1 ZINC000595458323 1033817293 /nfs/dbraw/zinc/81/72/93/1033817293.db2.gz GFHAPNIAMXTSDC-UHFFFAOYSA-N 1 1 335.404 3.878 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000599354547 1033888506 /nfs/dbraw/zinc/88/85/06/1033888506.db2.gz PZXWWQTYEBQODZ-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670816 1033943900 /nfs/dbraw/zinc/94/39/00/1033943900.db2.gz DNPVLWXDCHTWLD-NHYWBVRUSA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](CCF)C1 ZINC000595754775 1033985074 /nfs/dbraw/zinc/98/50/74/1033985074.db2.gz BULVCDAIMWZLBJ-QWHCGFSZSA-N 1 1 348.378 3.777 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](C4CCC4)C3)o2)cc1 ZINC000595839449 1034004423 /nfs/dbraw/zinc/00/44/23/1034004423.db2.gz YMGJOYDFBOOJOV-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599573585 1034019450 /nfs/dbraw/zinc/01/94/50/1034019450.db2.gz ISLQCSXNNJNOSQ-SFHVURJKSA-N 1 1 327.384 3.629 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584501 1034025290 /nfs/dbraw/zinc/02/52/90/1034025290.db2.gz ADZICILGQCIYDR-KFWWJZLASA-N 1 1 348.443 3.956 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097528 1034061056 /nfs/dbraw/zinc/06/10/56/1034061056.db2.gz YSLCWDCUIXHZLA-DOTOQJQBSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c([N+](=O)[O-])s1 ZINC000596214089 1034122335 /nfs/dbraw/zinc/12/23/35/1034122335.db2.gz DLDKFDFEFUPVLW-UHFFFAOYSA-N 1 1 346.456 3.882 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596569739 1034291705 /nfs/dbraw/zinc/29/17/05/1034291705.db2.gz DMABIKMGFMDNKH-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484477 1034387715 /nfs/dbraw/zinc/38/77/15/1034387715.db2.gz TWQHIUNUQQVYKK-QGZVFWFLSA-N 1 1 328.368 3.646 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484477 1034387719 /nfs/dbraw/zinc/38/77/19/1034387719.db2.gz TWQHIUNUQQVYKK-QGZVFWFLSA-N 1 1 328.368 3.646 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000534660720 1034782117 /nfs/dbraw/zinc/78/21/17/1034782117.db2.gz GZTBCBHXZJJTIM-UHFFFAOYSA-N 1 1 345.443 3.910 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411126029 1034796284 /nfs/dbraw/zinc/79/62/84/1034796284.db2.gz NIMQJHVMDDJNKW-GOSISDBHSA-N 1 1 339.395 3.761 20 5 EHBDMO CC(C)[N@H+](C)Cc1cccc(CNCc2ccccc2[N+](=O)[O-])c1 ZINC000236666558 1035037587 /nfs/dbraw/zinc/03/75/87/1035037587.db2.gz AFUUASPJKAXSPT-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO CC(C)[N@@H+](C)Cc1cccc(CNCc2ccccc2[N+](=O)[O-])c1 ZINC000236666558 1035037594 /nfs/dbraw/zinc/03/75/94/1035037594.db2.gz AFUUASPJKAXSPT-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000612578797 1035074898 /nfs/dbraw/zinc/07/48/98/1035074898.db2.gz JVLZQHKOGIZSFI-HXUWFJFHSA-N 1 1 339.439 3.610 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(F)cc1 ZINC000066434489 1035458133 /nfs/dbraw/zinc/45/81/33/1035458133.db2.gz XAKXQKQRFXCMFC-GOSISDBHSA-N 1 1 332.375 3.678 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000078338121 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O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000511837981 1041684644 /nfs/dbraw/zinc/68/46/44/1041684644.db2.gz KUCYAYKTDJCAOP-FZMZJTMJSA-N 1 1 326.343 3.961 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000067226843 1042774561 /nfs/dbraw/zinc/77/45/61/1042774561.db2.gz DWRMDDDGBOMJGN-CQSZACIVSA-N 1 1 329.400 3.808 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000500460238 1044862670 /nfs/dbraw/zinc/86/26/70/1044862670.db2.gz XAGBOIFEOUOCBO-CYBMUJFWSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001127726455 1127387627 /nfs/dbraw/zinc/38/76/27/1127387627.db2.gz ACHQRWBPUKJNLX-UHFFFAOYSA-N 1 1 327.384 3.578 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000301293615 1127734448 /nfs/dbraw/zinc/73/44/48/1127734448.db2.gz WEBDZMDMOCAHHJ-AWEZNQCLSA-N 1 1 346.818 3.720 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000027501523 1127742071 /nfs/dbraw/zinc/74/20/71/1127742071.db2.gz VQCRGVULNKIVLJ-UHFFFAOYSA-N 1 1 330.775 3.687 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000027501523 1127742075 /nfs/dbraw/zinc/74/20/75/1127742075.db2.gz VQCRGVULNKIVLJ-UHFFFAOYSA-N 1 1 330.775 3.687 20 5 EHBDMO COc1cc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609979 1128518161 /nfs/dbraw/zinc/51/81/61/1128518161.db2.gz BUCFYTUYAXOSQV-WMLDXEAASA-N 1 1 341.411 3.678 20 5 EHBDMO C[N@H+]1CC[C@H](c2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000624749437 1128627291 /nfs/dbraw/zinc/62/72/91/1128627291.db2.gz MUCGIVLQYZJOGR-ZDUSSCGKSA-N 1 1 330.391 3.857 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000301650620 1128849582 /nfs/dbraw/zinc/84/95/82/1128849582.db2.gz GIMSDZFLZNMKGH-INIZCTEOSA-N 1 1 346.475 3.779 20 5 EHBDMO CCc1ccc([C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000484556967 1120352363 /nfs/dbraw/zinc/35/23/63/1120352363.db2.gz UDBRJYKFTDDXTI-HXUWFJFHSA-N 1 1 340.423 3.773 20 5 EHBDMO CCc1ccc([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000484556967 1120352368 /nfs/dbraw/zinc/35/23/68/1120352368.db2.gz UDBRJYKFTDDXTI-HXUWFJFHSA-N 1 1 340.423 3.773 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CCc1ccccc1 ZINC000542519345 1120886066 /nfs/dbraw/zinc/88/60/66/1120886066.db2.gz ROPJHBHQIWMFHB-FQEVSTJZSA-N 1 1 342.439 3.799 20 5 EHBDMO Cc1nc2ccccn2c1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153251703 1120921155 /nfs/dbraw/zinc/92/11/55/1120921155.db2.gz CIEOQILKBBKDHY-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1nc2ccccn2c1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153251703 1120921158 /nfs/dbraw/zinc/92/11/58/1120921158.db2.gz CIEOQILKBBKDHY-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cc(C)ccc2C)c(C)c1[N+](=O)[O-] ZINC000761829815 1120974362 /nfs/dbraw/zinc/97/43/62/1120974362.db2.gz CGZIIRHXJNVXAX-QGZVFWFLSA-N 1 1 328.416 3.820 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)c(C)c1[N+](=O)[O-] ZINC000761829815 1120974364 /nfs/dbraw/zinc/97/43/64/1120974364.db2.gz CGZIIRHXJNVXAX-QGZVFWFLSA-N 1 1 328.416 3.820 20 5 EHBDMO COC(=O)Nc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000495686958 1121362553 /nfs/dbraw/zinc/36/25/53/1121362553.db2.gz IZAFVLGINPKSOP-UHFFFAOYSA-N 1 1 349.774 3.716 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(F)cc2C)c([N+](=O)[O-])c1 ZINC000487965410 1121390130 /nfs/dbraw/zinc/39/01/30/1121390130.db2.gz SMEQNMAOWKJACS-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC000780400263 1121575335 /nfs/dbraw/zinc/57/53/35/1121575335.db2.gz UQZPVQNKRTVKJO-QQXWZLKESA-N 1 1 338.407 3.806 20 5 EHBDMO C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000916151485 1122081163 /nfs/dbraw/zinc/08/11/63/1122081163.db2.gz ITIDPIGPPFCNMW-ZDUSSCGKSA-N 1 1 340.379 3.581 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000916151485 1122081168 /nfs/dbraw/zinc/08/11/68/1122081168.db2.gz ITIDPIGPPFCNMW-ZDUSSCGKSA-N 1 1 340.379 3.581 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301163738 1122218031 /nfs/dbraw/zinc/21/80/31/1122218031.db2.gz CEDFAIJMMKEYQD-INIZCTEOSA-N 1 1 343.402 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(F)c1 ZINC000301184171 1122298908 /nfs/dbraw/zinc/29/89/08/1122298908.db2.gz IWJTWWCDUWYRKK-INIZCTEOSA-N 1 1 343.402 3.710 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCC[C@@H]1O ZINC000497157479 1122354804 /nfs/dbraw/zinc/35/48/04/1122354804.db2.gz AFRLKOUSTVCDGC-YJBOKZPZSA-N 1 1 344.411 3.838 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCC[C@H]1O ZINC000497264039 1122428719 /nfs/dbraw/zinc/42/87/19/1122428719.db2.gz VZSCOOCIXQXDGY-KBXCAEBGSA-N 1 1 344.411 3.838 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000498900589 1123108495 /nfs/dbraw/zinc/10/84/95/1123108495.db2.gz JTTOGXSUROSRTG-UHFFFAOYSA-N 1 1 326.396 3.755 20 5 EHBDMO C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131965 1123165318 /nfs/dbraw/zinc/16/53/18/1123165318.db2.gz BTHPXNWILXEPAA-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131965 1123165321 /nfs/dbraw/zinc/16/53/21/1123165321.db2.gz BTHPXNWILXEPAA-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131965 1123165322 /nfs/dbraw/zinc/16/53/22/1123165322.db2.gz BTHPXNWILXEPAA-SJLPKXTDSA-N 1 1 339.439 3.768 20 5 EHBDMO CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000556896391 1123173343 /nfs/dbraw/zinc/17/33/43/1123173343.db2.gz VWVFKWYFGVRFAG-JQHSSLGASA-N 1 1 332.444 3.929 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](CCO)CCc1ccccc1 ZINC000615835597 1123884278 /nfs/dbraw/zinc/88/42/78/1123884278.db2.gz UPKAFMCRTKIXJU-SAPNQHFASA-N 1 1 340.423 3.535 20 5 EHBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000068778142 1124027211 /nfs/dbraw/zinc/02/72/11/1124027211.db2.gz VJOJFXSJYRHIRU-UHFFFAOYSA-N 1 1 347.462 3.944 20 5 EHBDMO COc1ccc(C[NH2+]C2(c3nc(C)cs3)CCCC2)cc1[N+](=O)[O-] ZINC000171842771 1124625436 /nfs/dbraw/zinc/62/54/36/1124625436.db2.gz MKYPIFMAAIDDTN-UHFFFAOYSA-N 1 1 347.440 3.927 20 5 EHBDMO COc1ccccc1CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735492344 1131353514 /nfs/dbraw/zinc/35/35/14/1131353514.db2.gz PIDQEQMAMVZJIP-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735492344 1131353519 /nfs/dbraw/zinc/35/35/19/1131353519.db2.gz PIDQEQMAMVZJIP-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO CC(C)Cn1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000183062699 1125428837 /nfs/dbraw/zinc/42/88/37/1125428837.db2.gz VBXJMSHPRVNNGG-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO CC(C)Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000183062699 1125428839 /nfs/dbraw/zinc/42/88/39/1125428839.db2.gz VBXJMSHPRVNNGG-UHFFFAOYSA-N 1 1 328.416 3.612 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000078705059 1129185273 /nfs/dbraw/zinc/18/52/73/1129185273.db2.gz WCCGVAYIWYEXKR-UHFFFAOYSA-N 1 1 344.386 3.820 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027257 1129376299 /nfs/dbraw/zinc/37/62/99/1129376299.db2.gz YSYQPZBNUGZPQI-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)c1ccco1 ZINC000069070380 1129420699 /nfs/dbraw/zinc/42/06/99/1129420699.db2.gz HACRBZABMGNPOG-CYBMUJFWSA-N 1 1 331.372 3.518 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466461842 1129468188 /nfs/dbraw/zinc/46/81/88/1129468188.db2.gz ANCHQWZWTXNCCJ-HNNXBMFYSA-N 1 1 333.432 3.744 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000154701823 1129581376 /nfs/dbraw/zinc/58/13/76/1129581376.db2.gz AOPSAHQKQDCWTK-AWEZNQCLSA-N 1 1 329.400 3.938 20 5 EHBDMO COc1cc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000390668984 1129628772 /nfs/dbraw/zinc/62/87/72/1129628772.db2.gz XNNOQZMXLADPOI-CYBMUJFWSA-N 1 1 347.390 3.675 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000330640043 1129642519 /nfs/dbraw/zinc/64/25/19/1129642519.db2.gz HLCAUZVKNFNEBD-LBKYZSNHSA-N 1 1 347.459 3.575 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000509030918 1129672246 /nfs/dbraw/zinc/67/22/46/1129672246.db2.gz KLWISOUNMUSEMC-SCLBCKFNSA-N 1 1 348.349 3.740 20 5 EHBDMO CO[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384165 1129674398 /nfs/dbraw/zinc/67/43/98/1129674398.db2.gz QWCRPNPRXCMMBZ-BLLLJJGKSA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384165 1129674401 /nfs/dbraw/zinc/67/44/01/1129674401.db2.gz QWCRPNPRXCMMBZ-BLLLJJGKSA-N 1 1 347.440 3.718 20 5 EHBDMO COC(=O)CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470172487 1129681167 /nfs/dbraw/zinc/68/11/67/1129681167.db2.gz XJKZBBXQBHZXSE-XNTDXEJSSA-N 1 1 334.416 3.519 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccc(F)cc2)CCOCC1 ZINC000170972187 1129707640 /nfs/dbraw/zinc/70/76/40/1129707640.db2.gz ODTZVNYDLWDOIV-UHFFFAOYSA-N 1 1 348.349 3.669 20 5 EHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000156875807 1129741472 /nfs/dbraw/zinc/74/14/72/1129741472.db2.gz DOELQVPQOVMRMG-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302040817 1129765152 /nfs/dbraw/zinc/76/51/52/1129765152.db2.gz HYTJPRWNDBIZAP-NEPJUHHUSA-N 1 1 339.386 3.938 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302204128 1129772972 /nfs/dbraw/zinc/77/29/72/1129772972.db2.gz WFVSFYLXCDFDCK-HNNXBMFYSA-N 1 1 342.443 3.620 20 5 EHBDMO CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302204128 1129772977 /nfs/dbraw/zinc/77/29/77/1129772977.db2.gz WFVSFYLXCDFDCK-HNNXBMFYSA-N 1 1 342.443 3.620 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302204128 1129772982 /nfs/dbraw/zinc/77/29/82/1129772982.db2.gz WFVSFYLXCDFDCK-HNNXBMFYSA-N 1 1 342.443 3.620 20 5 EHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000302718828 1129787209 /nfs/dbraw/zinc/78/72/09/1129787209.db2.gz ZDJOBRSUEKKLAV-CYBMUJFWSA-N 1 1 348.834 3.749 20 5 EHBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475455 1129848285 /nfs/dbraw/zinc/84/82/85/1129848285.db2.gz RQXQHRXJYXVBLE-QLFBSQMISA-N 1 1 342.443 3.921 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@@H]21 ZINC000133725492 1129961161 /nfs/dbraw/zinc/96/11/61/1129961161.db2.gz VMMSMZOUGUFLHJ-RISCZKNCSA-N 1 1 343.349 3.534 20 5 EHBDMO CC(C)([NH2+]Cc1nc2cccnc2s1)c1ccccc1[N+](=O)[O-] ZINC000429239993 1130200187 /nfs/dbraw/zinc/20/01/87/1130200187.db2.gz WLMGCJLXSIDVRT-UHFFFAOYSA-N 1 1 328.397 3.624 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000245710536 1130297519 /nfs/dbraw/zinc/29/75/19/1130297519.db2.gz FGHSMVRJFPVCSV-SWLSCSKDSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000245710536 1130297524 /nfs/dbraw/zinc/29/75/24/1130297524.db2.gz FGHSMVRJFPVCSV-SWLSCSKDSA-N 1 1 341.415 3.531 20 5 EHBDMO C[N@H+]1CCC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987157 1130335878 /nfs/dbraw/zinc/33/58/78/1130335878.db2.gz QFCLJLXJDVBIHZ-OXJNMPFZSA-N 1 1 339.439 3.616 20 5 EHBDMO CCc1ccc([C@@H](COC)[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000174479724 1130362133 /nfs/dbraw/zinc/36/21/33/1130362133.db2.gz UEBTUXYUXFFQNN-IQIBNGDESA-N 1 1 330.384 3.741 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(NCC[NH+]3Cc4ccccc4C3)sc2c1 ZINC000731209766 1130779342 /nfs/dbraw/zinc/77/93/42/1130779342.db2.gz ZETCROZIKCWROD-UHFFFAOYSA-N 1 1 340.408 3.632 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000736628314 1131428810 /nfs/dbraw/zinc/42/88/10/1131428810.db2.gz IWCKXCLQPKAKMK-CQSZACIVSA-N 1 1 332.350 3.938 20 5 EHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057486 1131461951 /nfs/dbraw/zinc/46/19/51/1131461951.db2.gz RJVNCKDXBOWOOH-YOEHRIQHSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(N3CCC[N@H+](C4CCCC4)CC3)sc2c1 ZINC000737420412 1131589086 /nfs/dbraw/zinc/58/90/86/1131589086.db2.gz HJOOABIIOMDDMZ-UHFFFAOYSA-N 1 1 346.456 3.659 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000742430918 1131729519 /nfs/dbraw/zinc/72/95/19/1131729519.db2.gz YQXGLFNVXOLSFG-INIZCTEOSA-N 1 1 343.402 3.692 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC(F)(F)c1ccccn1)CC2 ZINC001172901727 1131884524 /nfs/dbraw/zinc/88/45/24/1131884524.db2.gz JUUKQGCVZDSJGK-OAHLLOKOSA-N 1 1 347.365 3.619 20 5 EHBDMO CCC[N@@H+](CC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014365 1131935446 /nfs/dbraw/zinc/93/54/46/1131935446.db2.gz PVIPNBAVKYPGLR-UHFFFAOYSA-N 1 1 327.375 3.574 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000743842622 1131980558 /nfs/dbraw/zinc/98/05/58/1131980558.db2.gz IYYGJTILJBBZSO-ZIAGYGMSSA-N 1 1 349.431 3.645 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000743842622 1131980561 /nfs/dbraw/zinc/98/05/61/1131980561.db2.gz IYYGJTILJBBZSO-ZIAGYGMSSA-N 1 1 349.431 3.645 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@](C)(F)CC2)c1F ZINC001173178946 1131992626 /nfs/dbraw/zinc/99/26/26/1131992626.db2.gz CHZIUHQIWCWBSP-YVEFUNNKSA-N 1 1 342.386 3.888 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2ccc(F)cc2)C1 ZINC001173227262 1132006994 /nfs/dbraw/zinc/00/69/94/1132006994.db2.gz PAWLSDDAARZWTF-IFXJQAMLSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1CC(=O)OC(C)(C)C ZINC001173231926 1132008894 /nfs/dbraw/zinc/00/88/94/1132008894.db2.gz OXGXYWDDKSEECK-YOEHRIQHSA-N 1 1 348.443 3.722 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC001173238529 1132026905 /nfs/dbraw/zinc/02/69/05/1132026905.db2.gz UYPDUMCZLVEDBE-KUHUBIRLSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@H]1c1ccc(F)cc1 ZINC001173238529 1132026911 /nfs/dbraw/zinc/02/69/11/1132026911.db2.gz UYPDUMCZLVEDBE-KUHUBIRLSA-N 1 1 344.386 3.738 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(CCc4c3cccc4F)C2)C1 ZINC001169051292 1132643314 /nfs/dbraw/zinc/64/33/14/1132643314.db2.gz CTWPQZDOQGJCSE-ZRGWGRIASA-N 1 1 332.419 3.551 20 5 EHBDMO Cc1cccc([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001169197576 1132688774 /nfs/dbraw/zinc/68/87/74/1132688774.db2.gz OOQPNRATFPIKCZ-KRWDZBQOSA-N 1 1 326.396 3.772 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761321 1133049149 /nfs/dbraw/zinc/04/91/49/1133049149.db2.gz JXOLTSQMKMJXOL-MRXNPFEDSA-N 1 1 343.431 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000773705255 1133095315 /nfs/dbraw/zinc/09/53/15/1133095315.db2.gz UQUJVVMDMQUHKX-KBPBESRZSA-N 1 1 338.835 3.887 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209609 1133107736 /nfs/dbraw/zinc/10/77/36/1133107736.db2.gz SFNKWSYRDFLPRO-HNNXBMFYSA-N 1 1 327.428 3.849 20 5 EHBDMO CCCC[N@@H+](CCOC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000769390002 1133275511 /nfs/dbraw/zinc/27/55/11/1133275511.db2.gz TWAXVYGQPYXLNK-UHFFFAOYSA-N 1 1 345.237 3.606 20 5 EHBDMO COc1cncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878489 1133545608 /nfs/dbraw/zinc/54/56/08/1133545608.db2.gz BCJVVKRWLAEECG-INIZCTEOSA-N 1 1 341.411 3.686 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774518643 1133703776 /nfs/dbraw/zinc/70/37/76/1133703776.db2.gz WLRZXSHHTDXFCL-HIFRSBDPSA-N 1 1 329.375 3.981 20 5 EHBDMO C[C@@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839178 1133996497 /nfs/dbraw/zinc/99/64/97/1133996497.db2.gz DIWOTZCYRAENNB-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1CCCC[C@H]1C ZINC001184856778 1133999426 /nfs/dbraw/zinc/99/94/26/1133999426.db2.gz LQXLJTGQOXGAQO-GHMZBOCLSA-N 1 1 346.353 3.683 20 5 EHBDMO CC(C)[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774833365 1134041165 /nfs/dbraw/zinc/04/11/65/1134041165.db2.gz POPOKZQTZARMHE-UHFFFAOYSA-N 1 1 335.385 3.975 20 5 EHBDMO CC(C)[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774833365 1134041172 /nfs/dbraw/zinc/04/11/72/1134041172.db2.gz POPOKZQTZARMHE-UHFFFAOYSA-N 1 1 335.385 3.975 20 5 EHBDMO C[C@H](NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804150 1134171186 /nfs/dbraw/zinc/17/11/86/1134171186.db2.gz VBTXNANVUQWXDV-YOEHRIQHSA-N 1 1 346.475 3.625 20 5 EHBDMO C[C@H]([NH2+]C[C@@H]1CCCN1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804150 1134171188 /nfs/dbraw/zinc/17/11/88/1134171188.db2.gz VBTXNANVUQWXDV-YOEHRIQHSA-N 1 1 346.475 3.625 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001186368658 1134203262 /nfs/dbraw/zinc/20/32/62/1134203262.db2.gz VEIKZOBUQKEOOT-QGZVFWFLSA-N 1 1 333.432 3.720 20 5 EHBDMO C[N@H+]1C[C@@H]2CC[C@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC001187913800 1134395990 /nfs/dbraw/zinc/39/59/90/1134395990.db2.gz QCYXKPKVKRNJLG-NGZCFLSTSA-N 1 1 330.215 3.654 20 5 EHBDMO Cc1c(C[NH2+]Cc2c(Cl)n(C)nc2C(C)C)cccc1[N+](=O)[O-] ZINC000790995809 1134491063 /nfs/dbraw/zinc/49/10/63/1134491063.db2.gz DITPECVICZJUPS-UHFFFAOYSA-N 1 1 336.823 3.703 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1CSCC[N@@H+](C)Cc1ccccc1 ZINC001189216252 1134560007 /nfs/dbraw/zinc/56/00/07/1134560007.db2.gz YFAFXBWNMIOEAI-UHFFFAOYSA-N 1 1 346.452 3.969 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@H+](CC1CCCC1)CC2 ZINC001170235337 1134716772 /nfs/dbraw/zinc/71/67/72/1134716772.db2.gz YVKBAPWVVWAKLW-UHFFFAOYSA-N 1 1 339.233 3.906 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@@H+](CC1CCCC1)CC2 ZINC001170235337 1134716776 /nfs/dbraw/zinc/71/67/76/1134716776.db2.gz YVKBAPWVVWAKLW-UHFFFAOYSA-N 1 1 339.233 3.906 20 5 EHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC001190588760 1134723417 /nfs/dbraw/zinc/72/34/17/1134723417.db2.gz DUWGOTYWFCQKFE-AWEZNQCLSA-N 1 1 334.420 3.864 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3cc(F)ccc3C2)c([N+](=O)[O-])c1 ZINC001170352300 1134754426 /nfs/dbraw/zinc/75/44/26/1134754426.db2.gz LTNWDSCRFBZQNA-CYBMUJFWSA-N 1 1 344.386 3.732 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345842 1134759786 /nfs/dbraw/zinc/75/97/86/1134759786.db2.gz MXANIWHQPWSNIJ-KDOFPFPSSA-N 1 1 341.411 3.767 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3c(F)cccc3C2)c([N+](=O)[O-])c1 ZINC001170351728 1134760888 /nfs/dbraw/zinc/76/08/88/1134760888.db2.gz HIEJGDNUWRGUHS-CYBMUJFWSA-N 1 1 344.386 3.732 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC001191075712 1134788723 /nfs/dbraw/zinc/78/87/23/1134788723.db2.gz CLXJFNCSLIKQJW-IOASZLSFSA-N 1 1 332.400 3.534 20 5 EHBDMO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])o1 ZINC001191258262 1134826416 /nfs/dbraw/zinc/82/64/16/1134826416.db2.gz LSCZMNCPGUKWSX-BBRMVZONSA-N 1 1 346.431 3.728 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)Cc2cccs2)c1 ZINC001191465279 1134876102 /nfs/dbraw/zinc/87/61/02/1134876102.db2.gz YSDLGKBALDWXLN-LBPRGKRZSA-N 1 1 348.424 3.506 20 5 EHBDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001191464696 1134876145 /nfs/dbraw/zinc/87/61/45/1134876145.db2.gz MVBUOYHJEBPXEB-NSHDSACASA-N 1 1 330.413 3.596 20 5 EHBDMO Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504168 1135093444 /nfs/dbraw/zinc/09/34/44/1135093444.db2.gz NMBHZFQLZVWSGQ-GHMZBOCLSA-N 1 1 342.237 3.560 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1)CC(C)C ZINC000804592089 1135127972 /nfs/dbraw/zinc/12/79/72/1135127972.db2.gz WWXYKNLFJWAMBE-UHFFFAOYSA-N 1 1 348.491 3.761 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001193808054 1135187441 /nfs/dbraw/zinc/18/74/41/1135187441.db2.gz QKKIGXFNEZGWBH-AWEZNQCLSA-N 1 1 333.432 3.682 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613673 1135589244 /nfs/dbraw/zinc/58/92/44/1135589244.db2.gz KVZAUSKWLRDCPT-LPUOJRKPSA-N 1 1 331.416 3.600 20 5 EHBDMO C[C@@]1(C2CCCCC2)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001197238025 1135663675 /nfs/dbraw/zinc/66/36/75/1135663675.db2.gz CQLCQDPPPVFUCT-SFHVURJKSA-N 1 1 331.416 3.578 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001198790270 1135853683 /nfs/dbraw/zinc/85/36/83/1135853683.db2.gz FXSAWFLHBIYWMK-HNNXBMFYSA-N 1 1 326.824 3.885 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001198790270 1135853687 /nfs/dbraw/zinc/85/36/87/1135853687.db2.gz FXSAWFLHBIYWMK-HNNXBMFYSA-N 1 1 326.824 3.885 20 5 EHBDMO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000809736972 1135882390 /nfs/dbraw/zinc/88/23/90/1135882390.db2.gz ACPYJRBNTOEFNV-UHFFFAOYSA-N 1 1 347.846 3.942 20 5 EHBDMO CC[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCCC1 ZINC000811474159 1136095835 /nfs/dbraw/zinc/09/58/35/1136095835.db2.gz VUOGYMVOCWTTCX-CYBMUJFWSA-N 1 1 346.258 3.866 20 5 EHBDMO C[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCCCC1 ZINC000811474813 1136096375 /nfs/dbraw/zinc/09/63/75/1136096375.db2.gz BVUZLGBVOKIRRS-LLVKDONJSA-N 1 1 346.258 3.866 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506561 1136101585 /nfs/dbraw/zinc/10/15/85/1136101585.db2.gz AEACYQKTXFQHAQ-NSHDSACASA-N 1 1 346.258 3.722 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2COc2ccccc2)cc1F ZINC001170648564 1136153852 /nfs/dbraw/zinc/15/38/52/1136153852.db2.gz ANWHZLKKWIAKLP-HNNXBMFYSA-N 1 1 330.359 3.777 20 5 EHBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850391159 1136247589 /nfs/dbraw/zinc/24/75/89/1136247589.db2.gz GNTNAKDUIICVSF-UHFFFAOYSA-N 1 1 334.807 3.539 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847472 1136259502 /nfs/dbraw/zinc/25/95/02/1136259502.db2.gz DDMSFPDZTCEGED-AUUYWEPGSA-N 1 1 344.411 3.547 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812853108 1136262907 /nfs/dbraw/zinc/26/29/07/1136262907.db2.gz AOSLJJQSAGCMBL-BEFAXECRSA-N 1 1 328.412 3.581 20 5 EHBDMO CC(C)(C)CCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174448 1136298186 /nfs/dbraw/zinc/29/81/86/1136298186.db2.gz SWTFGRPSTBYZRP-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO CC(C)(C)CCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174448 1136298188 /nfs/dbraw/zinc/29/81/88/1136298188.db2.gz SWTFGRPSTBYZRP-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c(F)c1 ZINC000747840760 1136307121 /nfs/dbraw/zinc/30/71/21/1136307121.db2.gz SRKSQGUKILHNLQ-OALUTQOASA-N 1 1 344.386 3.822 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H](c4ccccc4)C3)c2c1 ZINC000814226333 1136425775 /nfs/dbraw/zinc/42/57/75/1136425775.db2.gz VIQITTZAYISYIL-KRWDZBQOSA-N 1 1 336.395 3.782 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583104 1136441607 /nfs/dbraw/zinc/44/16/07/1136441607.db2.gz WJNYXEAIAMOZGM-QAPCUYQASA-N 1 1 346.814 3.771 20 5 EHBDMO Cc1ccc(C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1C ZINC000776584685 1136442327 /nfs/dbraw/zinc/44/23/27/1136442327.db2.gz ORUNKPLGJWDNEY-HXUWFJFHSA-N 1 1 340.423 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000776578112 1136443370 /nfs/dbraw/zinc/44/33/70/1136443370.db2.gz DLDWMERNLVLFJB-SFHVURJKSA-N 1 1 330.384 3.666 20 5 EHBDMO CCC[N@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580680 1136444918 /nfs/dbraw/zinc/44/49/18/1136444918.db2.gz YXEQQHWIAUNLAR-GOSISDBHSA-N 1 1 332.375 3.680 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000776591053 1136451166 /nfs/dbraw/zinc/45/11/66/1136451166.db2.gz GIIUWOLGLOPWRV-VMDGZTHMSA-N 1 1 344.386 3.850 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591984 1136453065 /nfs/dbraw/zinc/45/30/65/1136453065.db2.gz NPISFMFRSPXBHL-ZMYBRWDISA-N 1 1 326.396 3.506 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1ccsc1 ZINC000338958004 1136587289 /nfs/dbraw/zinc/58/72/89/1136587289.db2.gz NONXQHVAHVHYAQ-UHFFFAOYSA-N 1 1 342.424 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3CC3)CC2)c(Br)c1 ZINC001170869922 1136812338 /nfs/dbraw/zinc/81/23/38/1136812338.db2.gz GEDPEZCGEGUNQT-UHFFFAOYSA-N 1 1 339.233 3.979 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)cc1 ZINC000858014452 1136931688 /nfs/dbraw/zinc/93/16/88/1136931688.db2.gz LKFVOUMUNOEPGK-SFHVURJKSA-N 1 1 339.395 3.521 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1 ZINC000859567940 1137020510 /nfs/dbraw/zinc/02/05/10/1137020510.db2.gz MIOUCHLVUYAYGS-KRWDZBQOSA-N 1 1 342.355 3.529 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001171008100 1137088907 /nfs/dbraw/zinc/08/89/07/1137088907.db2.gz QMIJGUWOMYLDLE-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001171008100 1137088908 /nfs/dbraw/zinc/08/89/08/1137088908.db2.gz QMIJGUWOMYLDLE-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO Cc1c(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000864005478 1137211262 /nfs/dbraw/zinc/21/12/62/1137211262.db2.gz YEDZRNRXCBIXPA-GOSISDBHSA-N 1 1 337.423 3.888 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794703080 1137236195 /nfs/dbraw/zinc/23/61/95/1137236195.db2.gz HUULDCARRMMYHY-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)c1cc[nH]n1 ZINC001146841581 1137396076 /nfs/dbraw/zinc/39/60/76/1137396076.db2.gz DCUODJMPUPAVGZ-UHFFFAOYSA-N 1 1 345.406 3.738 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001649160324 1137479568 /nfs/dbraw/zinc/47/95/68/1137479568.db2.gz XEZRRVDWFPADKS-KRWDZBQOSA-N 1 1 348.406 3.829 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC001171752312 1137508485 /nfs/dbraw/zinc/50/84/85/1137508485.db2.gz RPNQPBZMXFDXFL-MRXNPFEDSA-N 1 1 334.416 3.637 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2C[C@H]3CCCC[C@H]32)c1 ZINC001171756420 1137508534 /nfs/dbraw/zinc/50/85/34/1137508534.db2.gz JUCQXLKCFFJCCF-QMTHXVAHSA-N 1 1 325.206 3.732 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2C[C@H]3CCCC[C@H]32)c1 ZINC001171756420 1137508535 /nfs/dbraw/zinc/50/85/35/1137508535.db2.gz JUCQXLKCFFJCCF-QMTHXVAHSA-N 1 1 325.206 3.732 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872032403 1137566528 /nfs/dbraw/zinc/56/65/28/1137566528.db2.gz SODJCLLEWJXDEI-GFCCVEGCSA-N 1 1 346.358 3.746 20 5 EHBDMO COc1ccc(COCC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872046648 1137567638 /nfs/dbraw/zinc/56/76/38/1137567638.db2.gz KBRIDCGJPDKKTB-CYBMUJFWSA-N 1 1 348.374 3.610 20 5 EHBDMO COc1cc2c(c(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])c1)O[C@H](C)C2 ZINC000873184799 1137593072 /nfs/dbraw/zinc/59/30/72/1137593072.db2.gz ZJBZAHRHZKRDHM-CHWSQXEVSA-N 1 1 342.395 3.778 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877795372 1137690346 /nfs/dbraw/zinc/69/03/46/1137690346.db2.gz IDRBXWDDQHAWNN-ZDUSSCGKSA-N 1 1 346.349 3.597 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC(C)(C)C ZINC000878038294 1137700309 /nfs/dbraw/zinc/70/03/09/1137700309.db2.gz GGZDDFUHLJQVSL-UHFFFAOYSA-N 1 1 338.795 3.776 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(OC)c1OC ZINC000879466930 1137748591 /nfs/dbraw/zinc/74/85/91/1137748591.db2.gz XWOZDBKXIFYFES-HNNXBMFYSA-N 1 1 348.374 3.992 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c(F)c1 ZINC000879671822 1137754783 /nfs/dbraw/zinc/75/47/83/1137754783.db2.gz KEFLGVMHOYRWED-ZWNOBZJWSA-N 1 1 336.260 3.860 20 5 EHBDMO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000883328313 1137855097 /nfs/dbraw/zinc/85/50/97/1137855097.db2.gz PHRHADWNPMZMKI-ZDUSSCGKSA-N 1 1 334.397 3.668 20 5 EHBDMO CCCC[N@@H+](CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000131875168 1137860882 /nfs/dbraw/zinc/86/08/82/1137860882.db2.gz VXQMRMAWRQLSFH-LLVKDONJSA-N 1 1 327.812 3.697 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034160 1137929412 /nfs/dbraw/zinc/92/94/12/1137929412.db2.gz ZVOFYHWMPOOBNR-UUKVCBHOSA-N 1 1 332.444 3.917 20 5 EHBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371329 1139486571 /nfs/dbraw/zinc/48/65/71/1139486571.db2.gz LZBLLAWDHBWPAJ-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371329 1139486573 /nfs/dbraw/zinc/48/65/73/1139486573.db2.gz LZBLLAWDHBWPAJ-ZLOXQWCVSA-N 1 1 332.425 3.525 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000175851023 1139522931 /nfs/dbraw/zinc/52/29/31/1139522931.db2.gz MMMWFNBRIUKGCB-SJORKVTESA-N 1 1 346.452 3.787 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OC4CCCC4)CC3)nc2c1 ZINC000177031563 1139593349 /nfs/dbraw/zinc/59/33/49/1139593349.db2.gz JFWOMRJRTGYDIZ-UHFFFAOYSA-N 1 1 345.399 3.660 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000181530112 1139913264 /nfs/dbraw/zinc/91/32/64/1139913264.db2.gz RCWCKGSYLNAKLN-CYBMUJFWSA-N 1 1 330.384 3.938 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189953029 1140373861 /nfs/dbraw/zinc/37/38/61/1140373861.db2.gz YNZHTKOVVKBFOO-HNNXBMFYSA-N 1 1 347.459 3.522 20 5 EHBDMO O=C(c1ccc(F)cc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000192465292 1140533914 /nfs/dbraw/zinc/53/39/14/1140533914.db2.gz SVRUNNUGQTZRTI-UHFFFAOYSA-N 1 1 342.370 3.829 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269672660 1141133788 /nfs/dbraw/zinc/13/37/88/1141133788.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 1 1 329.444 3.605 20 5 EHBDMO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000271665263 1141415494 /nfs/dbraw/zinc/41/54/94/1141415494.db2.gz ZCLBRJODALWYSM-LSDHHAIUSA-N 1 1 341.411 3.889 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000339140120 1141507893 /nfs/dbraw/zinc/50/78/93/1141507893.db2.gz FNMZTTLQLBFLBL-WBMJQRKESA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000339140120 1141507896 /nfs/dbraw/zinc/50/78/96/1141507896.db2.gz FNMZTTLQLBFLBL-WBMJQRKESA-N 1 1 345.424 3.820 20 5 EHBDMO CSC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189062 1014697367 /nfs/dbraw/zinc/69/73/67/1014697367.db2.gz CTHXVZABDBZQIX-NSHDSACASA-N 1 1 346.399 3.771 20 5 EHBDMO CSC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189062 1014697373 /nfs/dbraw/zinc/69/73/73/1014697373.db2.gz CTHXVZABDBZQIX-NSHDSACASA-N 1 1 346.399 3.771 20 5 EHBDMO CCCCC[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126865421 1014942287 /nfs/dbraw/zinc/94/22/87/1014942287.db2.gz FZUQYZOPUAXSKF-UHFFFAOYSA-N 1 1 349.456 3.703 20 5 EHBDMO CCCCC[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126865421 1014942296 /nfs/dbraw/zinc/94/22/96/1014942296.db2.gz FZUQYZOPUAXSKF-UHFFFAOYSA-N 1 1 349.456 3.703 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000430211022 1014996448 /nfs/dbraw/zinc/99/64/48/1014996448.db2.gz HBTGIRMAZWROQH-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC[C@@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680282 1032122956 /nfs/dbraw/zinc/12/29/56/1032122956.db2.gz LMBDJUNXJWBDFN-DOTOQJQBSA-N 1 1 340.427 3.670 20 5 EHBDMO CCc1cnc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000175503443 1016306321 /nfs/dbraw/zinc/30/63/21/1016306321.db2.gz JKHDADMLQKYSJO-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO CCc1cnc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000175503443 1016306335 /nfs/dbraw/zinc/30/63/35/1016306335.db2.gz JKHDADMLQKYSJO-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO Cc1cccc(OCC[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083132374 1016354854 /nfs/dbraw/zinc/35/48/54/1016354854.db2.gz FRYWINPMJHKDBT-UHFFFAOYSA-N 1 1 341.367 3.555 20 5 EHBDMO Cc1cccc(OCC[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083132374 1016354864 /nfs/dbraw/zinc/35/48/64/1016354864.db2.gz FRYWINPMJHKDBT-UHFFFAOYSA-N 1 1 341.367 3.555 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000189941848 1016783002 /nfs/dbraw/zinc/78/30/02/1016783002.db2.gz QPMGDMZRKJCTFV-UHFFFAOYSA-N 1 1 330.384 3.590 20 5 EHBDMO CC(C)[C@@H]1[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527944 1016954182 /nfs/dbraw/zinc/95/41/82/1016954182.db2.gz NJYBVTZHILJHEM-YEODSOHDSA-N 1 1 330.428 3.745 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593517 1032314881 /nfs/dbraw/zinc/31/48/81/1032314881.db2.gz VOYBOPWMXNVOAE-ACJLOTCBSA-N 1 1 334.416 3.710 20 5 EHBDMO CC[N@@H+](C[C@@H]1COc2ccccc2O1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189007 1032368412 /nfs/dbraw/zinc/36/84/12/1032368412.db2.gz FKGWQLJOKCEKOP-LSDHHAIUSA-N 1 1 342.395 3.818 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000086187686 1032482635 /nfs/dbraw/zinc/48/26/35/1032482635.db2.gz DHYNRJZGWAQBTF-CYBMUJFWSA-N 1 1 337.383 3.965 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](CO)c1ccccc1 ZINC000449460828 1032577208 /nfs/dbraw/zinc/57/72/08/1032577208.db2.gz ZYNGXDJNWKVRJB-HVEPWOEZSA-N 1 1 326.396 3.664 20 5 EHBDMO C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]C1 ZINC000414850955 1017249536 /nfs/dbraw/zinc/24/95/36/1017249536.db2.gz IVYKYAYRLANTTP-ZIAGYGMSSA-N 1 1 345.468 3.801 20 5 EHBDMO COc1c(O)ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c1[N+](=O)[O-] ZINC000892786857 1017423154 /nfs/dbraw/zinc/42/31/54/1017423154.db2.gz VRUWXISZDZTWBB-UHFFFAOYSA-N 1 1 346.358 3.617 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2cccnc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000610281278 1017608064 /nfs/dbraw/zinc/60/80/64/1017608064.db2.gz AHSLAZZDVOFQIO-IUODEOHRSA-N 1 1 332.429 3.546 20 5 EHBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C2 ZINC001167326759 1018088320 /nfs/dbraw/zinc/08/83/20/1018088320.db2.gz QEORRKYPGDXTGR-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C2 ZINC001167326759 1018088335 /nfs/dbraw/zinc/08/83/35/1018088335.db2.gz QEORRKYPGDXTGR-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000119197977 1018127840 /nfs/dbraw/zinc/12/78/40/1018127840.db2.gz FMOSNVHTNVOKKY-CYBMUJFWSA-N 1 1 346.818 3.577 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000119197977 1018127849 /nfs/dbraw/zinc/12/78/49/1018127849.db2.gz FMOSNVHTNVOKKY-CYBMUJFWSA-N 1 1 346.818 3.577 20 5 EHBDMO C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160135 /nfs/dbraw/zinc/16/01/35/1018160135.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]1C[N@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160140 /nfs/dbraw/zinc/16/01/40/1018160140.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160147 /nfs/dbraw/zinc/16/01/47/1018160147.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000119632642 1018174518 /nfs/dbraw/zinc/17/45/18/1018174518.db2.gz VSPUZLWPKLJXRI-LLVKDONJSA-N 1 1 348.786 3.870 20 5 EHBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cn1 ZINC000398004828 1018950658 /nfs/dbraw/zinc/95/06/58/1018950658.db2.gz AMIFQUGJTKUNFV-QGZVFWFLSA-N 1 1 328.416 3.558 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CCO)c1ccccc1F ZINC000592402408 1032797306 /nfs/dbraw/zinc/79/73/06/1032797306.db2.gz GSWLBVZOKMYWAF-SCLBCKFNSA-N 1 1 332.375 3.817 20 5 EHBDMO Cc1c(C[N@H+]2CCCN(c3ccccc3F)CC2)cccc1[N+](=O)[O-] ZINC000513368520 1019589146 /nfs/dbraw/zinc/58/91/46/1019589146.db2.gz WJESYXOHHLOTIR-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3nccnc3c2)C2CC2)c1 ZINC000602441201 1032888957 /nfs/dbraw/zinc/88/89/57/1032888957.db2.gz VYHMPLBORWGZGU-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000439255051 1021300944 /nfs/dbraw/zinc/30/09/44/1021300944.db2.gz FSBDQVXNNDQMTN-LJQANCHMSA-N 1 1 328.412 3.758 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270139439 1021365219 /nfs/dbraw/zinc/36/52/19/1021365219.db2.gz ACDHOFHILPMGQL-SFTDATJTSA-N 1 1 330.431 3.912 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c(Cl)c1 ZINC000322895820 1021373932 /nfs/dbraw/zinc/37/39/32/1021373932.db2.gz BSPBGKWGCYTILD-USXIJHARSA-N 1 1 338.835 3.764 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000439478874 1021471595 /nfs/dbraw/zinc/47/15/95/1021471595.db2.gz PADBZKCQPWUSLI-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670755 1021640242 /nfs/dbraw/zinc/64/02/42/1021640242.db2.gz RHBUNVPQVBMEIP-KBPBESRZSA-N 1 1 334.416 3.623 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(Nc3cccc4cc[nH+]cc43)CC2)cn1 ZINC000602586623 1033005702 /nfs/dbraw/zinc/00/57/02/1033005702.db2.gz CQFTXWCYPQRKEB-UHFFFAOYSA-N 1 1 349.394 3.619 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000469470464 1021937322 /nfs/dbraw/zinc/93/73/22/1021937322.db2.gz KTFPNLUITSCKCE-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000469470464 1021937334 /nfs/dbraw/zinc/93/73/34/1021937334.db2.gz KTFPNLUITSCKCE-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CCCCO)cc1[N+](=O)[O-] ZINC000471812112 1022328576 /nfs/dbraw/zinc/32/85/76/1022328576.db2.gz UQGRCTXQWIHNSJ-UHFFFAOYSA-N 1 1 343.427 3.567 20 5 EHBDMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968577 1022520732 /nfs/dbraw/zinc/52/07/32/1022520732.db2.gz SNCIJFJQJCVWMF-STQMWFEESA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@@H](C)O1 ZINC000438365674 1022595158 /nfs/dbraw/zinc/59/51/58/1022595158.db2.gz CUVSAQUJKCCMJB-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@@H](C)O1 ZINC000438365674 1022595171 /nfs/dbraw/zinc/59/51/71/1022595171.db2.gz CUVSAQUJKCCMJB-HZSPNIEDSA-N 1 1 330.384 3.853 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000550188379 1022676494 /nfs/dbraw/zinc/67/64/94/1022676494.db2.gz LLQBIONRTDOPFA-GOSISDBHSA-N 1 1 336.432 3.629 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000550188379 1022676499 /nfs/dbraw/zinc/67/64/99/1022676499.db2.gz LLQBIONRTDOPFA-GOSISDBHSA-N 1 1 336.432 3.629 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[NH+](Cc2cccs2)CC1 ZINC000060847355 1033077912 /nfs/dbraw/zinc/07/79/12/1033077912.db2.gz MRZWCIMKZNNLQD-UHFFFAOYSA-N 1 1 337.832 3.632 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@H]43)o2)c1 ZINC000430877435 1022823771 /nfs/dbraw/zinc/82/37/71/1022823771.db2.gz XYVISZPRJMVFIA-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@H]43)o2)c1 ZINC000430877435 1022823788 /nfs/dbraw/zinc/82/37/88/1022823788.db2.gz XYVISZPRJMVFIA-AEFFLSMTSA-N 1 1 328.368 3.608 20 5 EHBDMO CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602701239 1033089954 /nfs/dbraw/zinc/08/99/54/1033089954.db2.gz ISVRDYQSWYVUBY-CYBMUJFWSA-N 1 1 332.322 3.613 20 5 EHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000015366820 1022993790 /nfs/dbraw/zinc/99/37/90/1022993790.db2.gz ZKXWJGPCANZXKY-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000015366820 1022993797 /nfs/dbraw/zinc/99/37/97/1022993797.db2.gz ZKXWJGPCANZXKY-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000015366818 1022994597 /nfs/dbraw/zinc/99/45/97/1022994597.db2.gz ZKXWJGPCANZXKY-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000015366818 1022994599 /nfs/dbraw/zinc/99/45/99/1022994599.db2.gz ZKXWJGPCANZXKY-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2[N+](=O)[O-])cc1 ZINC000506369586 1023012056 /nfs/dbraw/zinc/01/20/56/1023012056.db2.gz LIVPMRDOEGXSTR-OAHLLOKOSA-N 1 1 344.436 3.621 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2[N+](=O)[O-])cc1 ZINC000506369586 1023012072 /nfs/dbraw/zinc/01/20/72/1023012072.db2.gz LIVPMRDOEGXSTR-OAHLLOKOSA-N 1 1 344.436 3.621 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729740 1033118170 /nfs/dbraw/zinc/11/81/70/1033118170.db2.gz CAHQMEWWSUYBLG-PKOBYXMFSA-N 1 1 326.396 3.601 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000602732947 1033124314 /nfs/dbraw/zinc/12/43/14/1033124314.db2.gz WBPUBNXSAQSSSC-AEFFLSMTSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000602732947 1033124324 /nfs/dbraw/zinc/12/43/24/1033124324.db2.gz WBPUBNXSAQSSSC-AEFFLSMTSA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1cc(Cc2noc([C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957892 1023476046 /nfs/dbraw/zinc/47/60/46/1023476046.db2.gz RLZMSMCAIJCYDB-HZSPNIEDSA-N 1 1 344.415 3.811 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208804 1023916006 /nfs/dbraw/zinc/91/60/06/1023916006.db2.gz CVDHJCWXCLDDMP-LJQANCHMSA-N 1 1 342.395 3.819 20 5 EHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000342109487 1024072532 /nfs/dbraw/zinc/07/25/32/1024072532.db2.gz GTAAANSAYIBCJT-NSHDSACASA-N 1 1 349.460 3.522 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CCc2ccc(F)cc2)C2CC2)cc1 ZINC000522659412 1024162262 /nfs/dbraw/zinc/16/22/62/1024162262.db2.gz TWVLHNYBXHLXFN-UHFFFAOYSA-N 1 1 328.387 3.984 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@@H](C)C1 ZINC000443643642 1024306985 /nfs/dbraw/zinc/30/69/85/1024306985.db2.gz SEOLYIDDGLRGJV-UONOGXRCSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1nc2ccccc2n1C1CC1 ZINC000184785971 1024327156 /nfs/dbraw/zinc/32/71/56/1024327156.db2.gz OZTJPFXVULDFMB-UHFFFAOYSA-N 1 1 336.395 3.878 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](c2ccccc2)[NH+](C)C)n1 ZINC000520655900 1024355987 /nfs/dbraw/zinc/35/59/87/1024355987.db2.gz ANYSPRNQMIDZRZ-MRXNPFEDSA-N 1 1 338.367 3.604 20 5 EHBDMO CCOc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000380731448 1024461337 /nfs/dbraw/zinc/46/13/37/1024461337.db2.gz INBDJGVYWVZIIW-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCc3ccccc3[C@H]2CO)cc1[N+](=O)[O-] ZINC000538736628 1024500236 /nfs/dbraw/zinc/50/02/36/1024500236.db2.gz RXWXNFCXDVKKGG-HXUWFJFHSA-N 1 1 340.423 3.810 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCc3ccccc3[C@H]2CO)cc1[N+](=O)[O-] ZINC000538736628 1024500245 /nfs/dbraw/zinc/50/02/45/1024500245.db2.gz RXWXNFCXDVKKGG-HXUWFJFHSA-N 1 1 340.423 3.810 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581237 1024638673 /nfs/dbraw/zinc/63/86/73/1024638673.db2.gz MNEWZKZQSMPCEW-UZGISAJGSA-N 1 1 329.425 3.944 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581231 1024639149 /nfs/dbraw/zinc/63/91/49/1024639149.db2.gz MNEWZKZQSMPCEW-BMQCOBNYSA-N 1 1 329.425 3.944 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000065535761 1024660895 /nfs/dbraw/zinc/66/08/95/1024660895.db2.gz YYTAKNUEFDFEIT-SFHVURJKSA-N 1 1 330.359 3.950 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1n1ccnc1 ZINC000248447541 1024685470 /nfs/dbraw/zinc/68/54/70/1024685470.db2.gz XDLMQMURFWXHGX-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1n1ccnc1 ZINC000248447541 1024685479 /nfs/dbraw/zinc/68/54/79/1024685479.db2.gz XDLMQMURFWXHGX-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000025358678 1024703426 /nfs/dbraw/zinc/70/34/26/1024703426.db2.gz AJSALENWOUKFEH-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cs1 ZINC000602888064 1033237312 /nfs/dbraw/zinc/23/73/12/1033237312.db2.gz OVOJCPROQNASFJ-CQSZACIVSA-N 1 1 340.408 3.589 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cccc1[N+](=O)[O-] ZINC000602886871 1033237448 /nfs/dbraw/zinc/23/74/48/1033237448.db2.gz JPISQKBYXZBWTP-KRWDZBQOSA-N 1 1 348.406 3.836 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]([C@@H]4CCCO4)C3)o2)cc1 ZINC000895843873 1024890048 /nfs/dbraw/zinc/89/00/48/1024890048.db2.gz JESKMVLCRAJWGS-YJBOKZPZSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)o1 ZINC000895843996 1024890922 /nfs/dbraw/zinc/89/09/22/1024890922.db2.gz KXBZGBSLIKLNMI-RDTXWAMCSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1 ZINC000053221415 1024988400 /nfs/dbraw/zinc/98/84/00/1024988400.db2.gz HKXQARNNDUIZHN-LJQANCHMSA-N 1 1 326.396 3.776 20 5 EHBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000346782357 1025092956 /nfs/dbraw/zinc/09/29/56/1025092956.db2.gz YFRBDNSSSVLVKL-HZPDHXFCSA-N 1 1 347.462 3.943 20 5 EHBDMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000521063259 1025193321 /nfs/dbraw/zinc/19/33/21/1025193321.db2.gz NTXOIVBDEVOQGU-CYBMUJFWSA-N 1 1 331.803 3.941 20 5 EHBDMO CC[N@@H+]1CCCC[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175843 1025248052 /nfs/dbraw/zinc/24/80/52/1025248052.db2.gz YWGYTLLQRQNCTP-KRWDZBQOSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175843 1025248062 /nfs/dbraw/zinc/24/80/62/1025248062.db2.gz YWGYTLLQRQNCTP-KRWDZBQOSA-N 1 1 343.427 3.819 20 5 EHBDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)s1 ZINC000602958584 1033278732 /nfs/dbraw/zinc/27/87/32/1033278732.db2.gz YIPBZUHWYCUBGQ-LLVKDONJSA-N 1 1 335.429 3.998 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478221 1025659132 /nfs/dbraw/zinc/65/91/32/1025659132.db2.gz HEEKVOKEPUDIPW-GXTWGEPZSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c(F)c1 ZINC000282031500 1026044707 /nfs/dbraw/zinc/04/47/07/1026044707.db2.gz WPHOOZSKLPCXRU-CYBMUJFWSA-N 1 1 344.390 3.651 20 5 EHBDMO Cc1cnn(CCCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130062134 1026255691 /nfs/dbraw/zinc/25/56/91/1026255691.db2.gz PWPVGFVREYSKSF-UHFFFAOYSA-N 1 1 342.443 3.935 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000452081438 1026480506 /nfs/dbraw/zinc/48/05/06/1026480506.db2.gz JWCIBXMJBKVDOW-HNNXBMFYSA-N 1 1 336.432 3.631 20 5 EHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001167582125 1026525409 /nfs/dbraw/zinc/52/54/09/1026525409.db2.gz KYTAXLXQPXEXBG-CQSZACIVSA-N 1 1 334.441 3.988 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041892 1026680370 /nfs/dbraw/zinc/68/03/70/1026680370.db2.gz SPEZHJMTPANVMC-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000339905658 1026734080 /nfs/dbraw/zinc/73/40/80/1026734080.db2.gz ACRSNBYAROOWAZ-INIZCTEOSA-N 1 1 336.395 3.609 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@H]1CCc2[nH+]ccn2C1 ZINC000340018461 1026799858 /nfs/dbraw/zinc/79/98/58/1026799858.db2.gz QTRMNOHAUGPYBI-SECBINFHSA-N 1 1 341.198 3.773 20 5 EHBDMO CC(C)c1ccc(CN[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200573 1027078529 /nfs/dbraw/zinc/07/85/29/1027078529.db2.gz CPVROQRQISIXSF-JKSUJKDBSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(C[NH2+][C@H](C)CN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200573 1027078538 /nfs/dbraw/zinc/07/85/38/1027078538.db2.gz CPVROQRQISIXSF-JKSUJKDBSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533434158 1027872726 /nfs/dbraw/zinc/87/27/26/1027872726.db2.gz UYRYSGWWONQEQJ-HNNXBMFYSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533434158 1027872750 /nfs/dbraw/zinc/87/27/50/1027872750.db2.gz UYRYSGWWONQEQJ-HNNXBMFYSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](C4CCCC4)C3)n2)c1 ZINC000420960211 1027928317 /nfs/dbraw/zinc/92/83/17/1027928317.db2.gz GLPDDEAHNBPUQK-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000444686840 1028134910 /nfs/dbraw/zinc/13/49/10/1028134910.db2.gz UGPUFONVAGBZJM-HNNXBMFYSA-N 1 1 336.395 3.769 20 5 EHBDMO C[C@H](N[C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144922 1028206201 /nfs/dbraw/zinc/20/62/01/1028206201.db2.gz IITODWJQSXXXPY-FNHZYXHNSA-N 1 1 325.412 3.739 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)n1 ZINC000444806581 1028279483 /nfs/dbraw/zinc/27/94/83/1028279483.db2.gz UXLYTBLWNUYVCD-HNNXBMFYSA-N 1 1 334.807 3.672 20 5 EHBDMO O=C(CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1 ZINC000130194120 1028367254 /nfs/dbraw/zinc/36/72/54/1028367254.db2.gz UKXUDUNRSXDLQX-UHFFFAOYSA-N 1 1 339.395 3.588 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521289 1028710001 /nfs/dbraw/zinc/71/00/01/1028710001.db2.gz KECRQWJUEYAWFG-HNNXBMFYSA-N 1 1 342.395 3.602 20 5 EHBDMO COc1ccc([C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000421829713 1028817265 /nfs/dbraw/zinc/81/72/65/1028817265.db2.gz AGPMDCNWARUNAM-SFHVURJKSA-N 1 1 330.359 3.983 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C(C)(C)C ZINC000532969601 1029115795 /nfs/dbraw/zinc/11/57/95/1029115795.db2.gz JZHTZHYUPDNGPH-INIZCTEOSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCCC2)C1 ZINC000445864897 1029195408 /nfs/dbraw/zinc/19/54/08/1029195408.db2.gz ZVIDRGSUZDLUSB-AWEZNQCLSA-N 1 1 331.416 3.578 20 5 EHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524894993 1029588397 /nfs/dbraw/zinc/58/83/97/1029588397.db2.gz ZHDFBNKVZALTKC-KBAYOESNSA-N 1 1 332.444 3.929 20 5 EHBDMO COc1cc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c([N+](=O)[O-])cc1F ZINC000192354826 1029645277 /nfs/dbraw/zinc/64/52/77/1029645277.db2.gz IRGAPQNAJYEVBD-OAHLLOKOSA-N 1 1 346.358 3.615 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042870 1029660241 /nfs/dbraw/zinc/66/02/41/1029660241.db2.gz GECBPPXFLXQJQY-KUHUBIRLSA-N 1 1 326.396 3.727 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000343224678 1029809520 /nfs/dbraw/zinc/80/95/20/1029809520.db2.gz ZHHILLBFKWLAIZ-CYBMUJFWSA-N 1 1 342.399 3.550 20 5 EHBDMO C[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000525781217 1030118479 /nfs/dbraw/zinc/11/84/79/1030118479.db2.gz WYKVZGMWQWFGMT-QGZVFWFLSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H](CO)C(C)(C)C ZINC000537658514 1030902583 /nfs/dbraw/zinc/90/25/83/1030902583.db2.gz JXOKMNLDEWKRNP-KRWDZBQOSA-N 1 1 332.400 3.694 20 5 EHBDMO CCc1n[nH]c(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000190680084 1030914175 /nfs/dbraw/zinc/91/41/75/1030914175.db2.gz QNHYSRFMYKFVGO-ZDUSSCGKSA-N 1 1 343.431 3.524 20 5 EHBDMO CCc1nc(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000190680084 1030914188 /nfs/dbraw/zinc/91/41/88/1030914188.db2.gz QNHYSRFMYKFVGO-ZDUSSCGKSA-N 1 1 343.431 3.524 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000302166292 1031005389 /nfs/dbraw/zinc/00/53/89/1031005389.db2.gz JQPBFGASYNVRIQ-CQSZACIVSA-N 1 1 331.441 3.848 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368404 1031019491 /nfs/dbraw/zinc/01/94/91/1031019491.db2.gz UUHUZWZUHKMIIL-GJZGRUSLSA-N 1 1 344.411 3.980 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000161118885 1031336482 /nfs/dbraw/zinc/33/64/82/1031336482.db2.gz OYIGLBRRJYIXCG-PWSUYJOCSA-N 1 1 331.338 3.533 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccccc1[N+](=O)[O-] ZINC000278616967 1031667655 /nfs/dbraw/zinc/66/76/55/1031667655.db2.gz FUJVGHDNSJNOCV-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@H]1c1ccsc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000052803849 1031698908 /nfs/dbraw/zinc/69/89/08/1031698908.db2.gz VQNLZJHPJKCVAH-INIZCTEOSA-N 1 1 345.424 3.822 20 5 EHBDMO COc1cc(F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000584117313 1031752072 /nfs/dbraw/zinc/75/20/72/1031752072.db2.gz CHKMZJXVPONBFX-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1c([C@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000537966737 1032050954 /nfs/dbraw/zinc/05/09/54/1032050954.db2.gz BZXFPDSPUBTTTK-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO COc1cc(F)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000593611068 1033442296 /nfs/dbraw/zinc/44/22/96/1033442296.db2.gz IVEWCZPVOFOIAW-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c2ncccc12 ZINC000594596671 1033444221 /nfs/dbraw/zinc/44/42/21/1033444221.db2.gz BAYAFLHWZJROQO-RHSMWYFYSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cccc(OC3CC3)c2F)cc1[N+](=O)[O-] ZINC000594971344 1033577835 /nfs/dbraw/zinc/57/78/35/1033577835.db2.gz FYJAPAUIBKPUKL-UHFFFAOYSA-N 1 1 330.359 3.873 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@@H](OC2CCCC2)C(F)(F)F)cs1 ZINC000594969030 1033578599 /nfs/dbraw/zinc/57/85/99/1033578599.db2.gz UZVWSUZJZCIZPT-LLVKDONJSA-N 1 1 338.351 3.636 20 5 EHBDMO COc1ccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000059385978 1033603684 /nfs/dbraw/zinc/60/36/84/1033603684.db2.gz VFIOJVVXBFFEBO-UHFFFAOYSA-N 1 1 326.396 3.811 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OC(C)C)nc1 ZINC000595011263 1033606070 /nfs/dbraw/zinc/60/60/70/1033606070.db2.gz KVMPFOZSSUWJER-ZDUSSCGKSA-N 1 1 345.399 3.636 20 5 EHBDMO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000595019110 1033611579 /nfs/dbraw/zinc/61/15/79/1033611579.db2.gz IGZMWIKDWWATEF-DYVFJYSZSA-N 1 1 330.384 3.642 20 5 EHBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558827 1033713246 /nfs/dbraw/zinc/71/32/46/1033713246.db2.gz WXADVBLEUHXCPB-INIZCTEOSA-N 1 1 340.358 3.863 20 5 EHBDMO CCC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000595330862 1033729866 /nfs/dbraw/zinc/72/98/66/1033729866.db2.gz MZJZNLQYGHSMGD-UAGQMJEPSA-N 1 1 336.407 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cc(C4CC4)no3)CC2)cc1 ZINC000595330038 1033729908 /nfs/dbraw/zinc/72/99/08/1033729908.db2.gz HAFDHPBQXQTELE-UHFFFAOYSA-N 1 1 343.383 3.504 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000595356401 1033781311 /nfs/dbraw/zinc/78/13/11/1033781311.db2.gz LZCUFSDEAHPHAH-CQSZACIVSA-N 1 1 340.383 3.752 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC2(CCCCC2)CC1 ZINC000608833397 1033909560 /nfs/dbraw/zinc/90/95/60/1033909560.db2.gz SFZVSBJEHOQHQW-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603868409 1033994482 /nfs/dbraw/zinc/99/44/82/1033994482.db2.gz LOSRLTIUPDCWJX-GOSISDBHSA-N 1 1 326.396 3.811 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590222 1034028545 /nfs/dbraw/zinc/02/85/45/1034028545.db2.gz VWYRBWFEUOOVTH-CJNGLKHVSA-N 1 1 348.443 3.703 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910285 1034029771 /nfs/dbraw/zinc/02/97/71/1034029771.db2.gz OHSKCOHIZAAZSG-ZYSHUDEJSA-N 1 1 330.428 3.857 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000595868708 1034031818 /nfs/dbraw/zinc/03/18/18/1034031818.db2.gz YPFNQBAGHRAYTA-GXTWGEPZSA-N 1 1 330.388 3.798 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000595867716 1034032829 /nfs/dbraw/zinc/03/28/29/1034032829.db2.gz OXNOOOMTYAQDKQ-GXTWGEPZSA-N 1 1 330.388 3.798 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059047 1034063869 /nfs/dbraw/zinc/06/38/69/1034063869.db2.gz MCWNNXXUFRHRLP-XLCPLWEUSA-N 1 1 343.471 3.710 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059047 1034063884 /nfs/dbraw/zinc/06/38/84/1034063884.db2.gz MCWNNXXUFRHRLP-XLCPLWEUSA-N 1 1 343.471 3.710 20 5 EHBDMO Cc1ccc(C[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596062432 1034066920 /nfs/dbraw/zinc/06/69/20/1034066920.db2.gz REJZQVXPXNIBEK-KRWDZBQOSA-N 1 1 348.406 3.866 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689556 1034094890 /nfs/dbraw/zinc/09/48/90/1034094890.db2.gz JOCPQUGCCDNBNV-BWPKMQGJSA-N 1 1 331.416 3.520 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689556 1034094899 /nfs/dbraw/zinc/09/48/99/1034094899.db2.gz JOCPQUGCCDNBNV-BWPKMQGJSA-N 1 1 331.416 3.520 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174410 1034378390 /nfs/dbraw/zinc/37/83/90/1034378390.db2.gz KBGUSJPUKPPFAH-AWEZNQCLSA-N 1 1 334.322 3.526 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174410 1034378401 /nfs/dbraw/zinc/37/84/01/1034378401.db2.gz KBGUSJPUKPPFAH-AWEZNQCLSA-N 1 1 334.322 3.526 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435882 1034379569 /nfs/dbraw/zinc/37/95/69/1034379569.db2.gz CJFQXNNXBGLRGE-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc3c2OCCO3)C2CC2)cc1 ZINC000179518200 1034465427 /nfs/dbraw/zinc/46/54/27/1034465427.db2.gz CXTVXQRLODAGLJ-UHFFFAOYSA-N 1 1 340.379 3.531 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3c2OCCO3)C2CC2)cc1 ZINC000179518200 1034465435 /nfs/dbraw/zinc/46/54/35/1034465435.db2.gz CXTVXQRLODAGLJ-UHFFFAOYSA-N 1 1 340.379 3.531 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000179602150 1034515128 /nfs/dbraw/zinc/51/51/28/1034515128.db2.gz KHGADNALYVJUHI-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000179602150 1034515137 /nfs/dbraw/zinc/51/51/37/1034515137.db2.gz KHGADNALYVJUHI-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO CCCn1nccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597136938 1034556772 /nfs/dbraw/zinc/55/67/72/1034556772.db2.gz CNYIDHGRZKQWAZ-MRXNPFEDSA-N 1 1 328.416 3.581 20 5 EHBDMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210918 1034593782 /nfs/dbraw/zinc/59/37/82/1034593782.db2.gz ITTOXXHLTGWVBJ-SCLBCKFNSA-N 1 1 344.436 3.792 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cn1 ZINC000180051455 1035285080 /nfs/dbraw/zinc/28/50/80/1035285080.db2.gz JZUKOWBSBPKWRV-FQEVSTJZSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000580866992 1035465420 /nfs/dbraw/zinc/46/54/20/1035465420.db2.gz DALRKDSHCADPIF-NSHDSACASA-N 1 1 331.338 3.676 20 5 EHBDMO C[C@H](c1cccc(Nc2ccc(F)cc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000511461309 1035471619 /nfs/dbraw/zinc/47/16/19/1035471619.db2.gz KCSQDWWCPGCPOS-CYBMUJFWSA-N 1 1 345.374 3.871 20 5 EHBDMO CC1(C)CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000443956881 1035944516 /nfs/dbraw/zinc/94/45/16/1035944516.db2.gz BSOKAUSCWMIMSK-UHFFFAOYSA-N 1 1 328.416 3.677 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000443958076 1035981915 /nfs/dbraw/zinc/98/19/15/1035981915.db2.gz LNHWZFBNSZXQEK-KGLIPLIRSA-N 1 1 348.447 3.596 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630727 1036063682 /nfs/dbraw/zinc/06/36/82/1036063682.db2.gz DNYIMVCWWHBMAJ-JSGCOSHPSA-N 1 1 346.818 3.891 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1OC ZINC000892560925 1036098190 /nfs/dbraw/zinc/09/81/90/1036098190.db2.gz JRUVNUZMZAWKPN-AWEZNQCLSA-N 1 1 346.383 3.559 20 5 EHBDMO CCOc1cc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000492654889 1036114448 /nfs/dbraw/zinc/11/44/48/1036114448.db2.gz OLQWJGKNLHLUPK-QGZVFWFLSA-N 1 1 348.443 3.917 20 5 EHBDMO CC(C)[N@@H+](CCCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000541282696 1036165057 /nfs/dbraw/zinc/16/50/57/1036165057.db2.gz PBXPPFPFBQBMRI-UHFFFAOYSA-N 1 1 336.432 3.927 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000443992840 1036225193 /nfs/dbraw/zinc/22/51/93/1036225193.db2.gz YLPNIKSATUQDMY-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589111660 1036257915 /nfs/dbraw/zinc/25/79/15/1036257915.db2.gz MYGIDEIQNNQWEM-LBPRGKRZSA-N 1 1 345.365 3.782 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000493053208 1036602592 /nfs/dbraw/zinc/60/25/92/1036602592.db2.gz MKUNFSADTGIXLI-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO C[C@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000783775819 1036811083 /nfs/dbraw/zinc/81/10/83/1036811083.db2.gz IULOMQVTLBHQSY-GRYCIOLGSA-N 1 1 340.807 3.553 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000376448372 1036887740 /nfs/dbraw/zinc/88/77/40/1036887740.db2.gz MNAMAXKBEJQBJW-SJKOYZFVSA-N 1 1 346.456 3.734 20 5 EHBDMO COC(=O)c1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000271701911 1036932651 /nfs/dbraw/zinc/93/26/51/1036932651.db2.gz HPUOOINGZKJASM-SNVBAGLBSA-N 1 1 334.397 3.602 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000152857637 1036997564 /nfs/dbraw/zinc/99/75/64/1036997564.db2.gz OXMLZPNPKKFNHV-CABCVRRESA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000542049073 1037026072 /nfs/dbraw/zinc/02/60/72/1037026072.db2.gz QBNUFHDVKNYMBN-QILLFSRXSA-N 1 1 345.443 3.742 20 5 EHBDMO Cn1cc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C)cn1 ZINC000542053362 1037033133 /nfs/dbraw/zinc/03/31/33/1037033133.db2.gz NUBIWXZQMOKSLL-HNNXBMFYSA-N 1 1 336.823 3.859 20 5 EHBDMO CC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248894024 1037087357 /nfs/dbraw/zinc/08/73/57/1037087357.db2.gz HRKGAWUOOAMQHH-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248894024 1037087373 /nfs/dbraw/zinc/08/73/73/1037087373.db2.gz HRKGAWUOOAMQHH-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1cc(C)cc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271807150 1037357865 /nfs/dbraw/zinc/35/78/65/1037357865.db2.gz XRQQLLYKIZIZLI-AWEZNQCLSA-N 1 1 327.384 3.501 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532470202 1037414780 /nfs/dbraw/zinc/41/47/80/1037414780.db2.gz CFUNJGIUYAJXOM-FDQGKXFDSA-N 1 1 345.443 3.742 20 5 EHBDMO CC[N@H+]1CCC[C@@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423960 1037451227 /nfs/dbraw/zinc/45/12/27/1037451227.db2.gz QGJNIIPLHOMHMM-WOJBJXKFSA-N 1 1 339.439 3.758 20 5 EHBDMO CCN1CCC[C@@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423960 1037451238 /nfs/dbraw/zinc/45/12/38/1037451238.db2.gz QGJNIIPLHOMHMM-WOJBJXKFSA-N 1 1 339.439 3.758 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCOC1 ZINC000462879862 1037509158 /nfs/dbraw/zinc/50/91/58/1037509158.db2.gz ZXISFSIMGZXSBO-CQSZACIVSA-N 1 1 330.384 3.854 20 5 EHBDMO CCC(CC)[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CC1 ZINC000532528661 1037551413 /nfs/dbraw/zinc/55/14/13/1037551413.db2.gz RRGVWEPZOBSAKF-UHFFFAOYSA-N 1 1 347.415 3.546 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1(CO)CC1 ZINC000188952402 1037575093 /nfs/dbraw/zinc/57/50/93/1037575093.db2.gz HDNLPYNATKJQNF-UHFFFAOYSA-N 1 1 332.425 3.528 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000341253569 1037837912 /nfs/dbraw/zinc/83/79/12/1037837912.db2.gz CPPSBXJCKRBVCR-CQSZACIVSA-N 1 1 341.411 3.504 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](O)[C@@H]2CCc2ccccc2)cs1 ZINC000592165651 1037909503 /nfs/dbraw/zinc/90/95/03/1037909503.db2.gz DIOPGRXXXQOAPK-IRXDYDNUSA-N 1 1 346.452 3.614 20 5 EHBDMO CC[N@@H+]1CC[C@H](N(C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563606 /nfs/dbraw/zinc/56/36/06/1038563606.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 1 1 331.460 3.803 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563614 /nfs/dbraw/zinc/56/36/14/1038563614.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 1 1 331.460 3.803 20 5 EHBDMO CCN1CC[C@H]([N@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563619 /nfs/dbraw/zinc/56/36/19/1038563619.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 1 1 331.460 3.803 20 5 EHBDMO CCN1CC[C@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563629 /nfs/dbraw/zinc/56/36/29/1038563629.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 1 1 331.460 3.803 20 5 EHBDMO Cc1cc(NCC[N@@H+]2CCc3sccc3C2)c(F)cc1[N+](=O)[O-] ZINC000461778748 1038605539 /nfs/dbraw/zinc/60/55/39/1038605539.db2.gz PFWAYBCXKVCWIQ-UHFFFAOYSA-N 1 1 335.404 3.574 20 5 EHBDMO Cc1cc(NCC[N@H+]2CCc3sccc3C2)c(F)cc1[N+](=O)[O-] ZINC000461778748 1038605544 /nfs/dbraw/zinc/60/55/44/1038605544.db2.gz PFWAYBCXKVCWIQ-UHFFFAOYSA-N 1 1 335.404 3.574 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961577 1038698708 /nfs/dbraw/zinc/69/87/08/1038698708.db2.gz XUMUGMBNYAFZQO-MNOVXSKESA-N 1 1 331.338 3.817 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488034877 1038790532 /nfs/dbraw/zinc/79/05/32/1038790532.db2.gz VIWDORJEFLDZPP-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488034877 1038790546 /nfs/dbraw/zinc/79/05/46/1038790546.db2.gz VIWDORJEFLDZPP-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO COc1cccc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000290738645 1038934680 /nfs/dbraw/zinc/93/46/80/1038934680.db2.gz BOIATJFNMANRCZ-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036467 1039139214 /nfs/dbraw/zinc/13/92/14/1039139214.db2.gz KXFXPUSGZAADQS-YJBOKZPZSA-N 1 1 328.416 3.573 20 5 EHBDMO CC(C)[C@H](c1ccccc1Cl)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478044383 1039164444 /nfs/dbraw/zinc/16/44/44/1039164444.db2.gz CBGAOCHPYHLVGU-MRXNPFEDSA-N 1 1 336.823 3.774 20 5 EHBDMO COc1cc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507309 1039175844 /nfs/dbraw/zinc/17/58/44/1039175844.db2.gz VMYOVDMQUYROFQ-QGZVFWFLSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1cc(C[N@H+]2CCSC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507309 1039175850 /nfs/dbraw/zinc/17/58/50/1039175850.db2.gz VMYOVDMQUYROFQ-QGZVFWFLSA-N 1 1 344.436 3.894 20 5 EHBDMO CC(C)(C)c1ccc([C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478429962 1039436113 /nfs/dbraw/zinc/43/61/13/1039436113.db2.gz QJGDQKWPQAIORI-KRWDZBQOSA-N 1 1 342.443 3.926 20 5 EHBDMO CCCC[N@@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000488894141 1039457985 /nfs/dbraw/zinc/45/79/85/1039457985.db2.gz HXBRKNPXADLBNG-UHFFFAOYSA-N 1 1 335.451 3.850 20 5 EHBDMO CCN(CC)[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000236853808 1039489140 /nfs/dbraw/zinc/48/91/40/1039489140.db2.gz YTKPJLHYFGVAHY-INIZCTEOSA-N 1 1 333.457 3.829 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053232764 1039525658 /nfs/dbraw/zinc/52/56/58/1039525658.db2.gz WYQHSTLIPBVVSH-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053232764 1039525675 /nfs/dbraw/zinc/52/56/75/1039525675.db2.gz WYQHSTLIPBVVSH-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO COC(=O)c1ccc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000489256468 1039776480 /nfs/dbraw/zinc/77/64/80/1039776480.db2.gz SMBVFGYWMZUVRJ-CYBMUJFWSA-N 1 1 328.368 3.574 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000489256468 1039776493 /nfs/dbraw/zinc/77/64/93/1039776493.db2.gz SMBVFGYWMZUVRJ-CYBMUJFWSA-N 1 1 328.368 3.574 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700919 1039923818 /nfs/dbraw/zinc/92/38/18/1039923818.db2.gz RYZCYCWYQFVSDN-HZPDHXFCSA-N 1 1 349.475 3.909 20 5 EHBDMO C[C@H]([N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000027132778 1039939820 /nfs/dbraw/zinc/93/98/20/1039939820.db2.gz YQPXAALNJPQEOL-JTQLQIEISA-N 1 1 327.812 3.553 20 5 EHBDMO CC[NH+]1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236920657 1040183036 /nfs/dbraw/zinc/18/30/36/1040183036.db2.gz ODIJPZKCMPTKOV-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CC[NH+]1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236920657 1040183045 /nfs/dbraw/zinc/18/30/45/1040183045.db2.gz ODIJPZKCMPTKOV-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000553619731 1040265230 /nfs/dbraw/zinc/26/52/30/1040265230.db2.gz ZXONDTCUGSCIFK-QYJAPNMZSA-N 1 1 343.349 3.675 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000512622029 1040293456 /nfs/dbraw/zinc/29/34/56/1040293456.db2.gz HPWZCJADNDPVJS-CQSZACIVSA-N 1 1 326.343 3.961 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070430 1040434306 /nfs/dbraw/zinc/43/43/06/1040434306.db2.gz BJRNXKRCHVMLRM-HNNXBMFYSA-N 1 1 333.432 3.968 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075412 1040435073 /nfs/dbraw/zinc/43/50/73/1040435073.db2.gz PLUASMGBLMDSKW-IIAWOOMASA-N 1 1 331.416 3.576 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000486785934 1040460964 /nfs/dbraw/zinc/46/09/64/1040460964.db2.gz FQJTXCRMPJJNTR-AWEZNQCLSA-N 1 1 349.431 3.587 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CCC(CCC[NH+]3CCCC3)CC2)c(F)c1 ZINC000490339934 1040502726 /nfs/dbraw/zinc/50/27/26/1040502726.db2.gz KYCYWZSYIKTXTD-UHFFFAOYSA-N 1 1 349.450 3.822 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)c(F)c1 ZINC000490375983 1040531578 /nfs/dbraw/zinc/53/15/78/1040531578.db2.gz VVPSSOWETBSLDK-IBGZPJMESA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@H]2CCCc3ccccc32)c(F)c1 ZINC000490375983 1040531599 /nfs/dbraw/zinc/53/15/99/1040531599.db2.gz VVPSSOWETBSLDK-IBGZPJMESA-N 1 1 344.386 3.606 20 5 EHBDMO Cc1c(C[N@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000553952462 1040625897 /nfs/dbraw/zinc/62/58/97/1040625897.db2.gz UXDQJBYKQXXMMI-HOTGVXAUSA-N 1 1 342.439 3.890 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078763 1040885955 /nfs/dbraw/zinc/88/59/55/1040885955.db2.gz QATRPIVWONYKFH-CVEARBPZSA-N 1 1 349.450 3.820 20 5 EHBDMO CC1(C)C[C@H]([NH2+]C2CCN(CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154340 1040921078 /nfs/dbraw/zinc/92/10/78/1040921078.db2.gz ZBZKAYMXQWGLPA-IBGZPJMESA-N 1 1 343.471 3.781 20 5 EHBDMO CC(C)N1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433284388 1041234588 /nfs/dbraw/zinc/23/45/88/1041234588.db2.gz JURZNFZENCDRJD-SFHVURJKSA-N 1 1 331.460 3.780 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CCC(c3[nH+]cc4n3CCCC4)CC2)cs1 ZINC000278858121 1042597354 /nfs/dbraw/zinc/59/73/54/1042597354.db2.gz KYQOWELLHLGAPI-UHFFFAOYSA-N 1 1 346.456 3.569 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1F ZINC000182008639 1042998835 /nfs/dbraw/zinc/99/88/35/1042998835.db2.gz RYVFGWIPAUNPGJ-JTQLQIEISA-N 1 1 345.330 3.735 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2cn3ccccc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000279042276 1043236418 /nfs/dbraw/zinc/23/64/18/1043236418.db2.gz JMLLBMCBKRIWES-KRWDZBQOSA-N 1 1 336.395 3.755 20 5 EHBDMO CC[C@@]1(C)CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344220442 1043454950 /nfs/dbraw/zinc/45/49/50/1043454950.db2.gz QPMWGMOFQPASDK-SJCJKPOMSA-N 1 1 330.388 3.828 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1ccccc1 ZINC000301279158 1127631482 /nfs/dbraw/zinc/63/14/82/1127631482.db2.gz NGGIRIFVLRWJKD-LBPRGKRZSA-N 1 1 334.807 3.576 20 5 EHBDMO C[C@H]1COC(C)(C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000488370676 1127735457 /nfs/dbraw/zinc/73/54/57/1127735457.db2.gz WJJPJLWJOVPFOQ-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1COC(C)(C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000488370676 1127735462 /nfs/dbraw/zinc/73/54/62/1127735462.db2.gz WJJPJLWJOVPFOQ-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[N@H+]1CC[C@@H](c2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000624749436 1128627510 /nfs/dbraw/zinc/62/75/10/1128627510.db2.gz MUCGIVLQYZJOGR-CYBMUJFWSA-N 1 1 330.391 3.857 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC001167276701 1120041509 /nfs/dbraw/zinc/04/15/09/1120041509.db2.gz UUKIGUDZJGSPKO-UHFFFAOYSA-N 1 1 348.406 3.783 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2ccc(F)cc2F)C2CC2)c1 ZINC000153327308 1120965604 /nfs/dbraw/zinc/96/56/04/1120965604.db2.gz RHDZMKZRDSJDBW-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000542977378 1128982365 /nfs/dbraw/zinc/98/23/65/1128982365.db2.gz FSJCNUHSBLNQES-JOQOYGCGSA-N 1 1 345.443 3.742 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311162901 1128984818 /nfs/dbraw/zinc/98/48/18/1128984818.db2.gz PZIWBSAGHGOIJV-MRXNPFEDSA-N 1 1 341.411 3.537 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724055 1128994009 /nfs/dbraw/zinc/99/40/09/1128994009.db2.gz OOUGQRCVZABZGV-WCQYABFASA-N 1 1 343.349 3.534 20 5 EHBDMO C[C@H](O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536206 1121683628 /nfs/dbraw/zinc/68/36/28/1121683628.db2.gz OCUXWHABLIVFPY-STQMWFEESA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143281 1121784367 /nfs/dbraw/zinc/78/43/67/1121784367.db2.gz OXLCSTUULHJZSO-DOMZBBRYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151322 1122080837 /nfs/dbraw/zinc/08/08/37/1122080837.db2.gz FMJMCTOXEQPZBL-ZIAGYGMSSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151322 1122080845 /nfs/dbraw/zinc/08/08/45/1122080845.db2.gz FMJMCTOXEQPZBL-ZIAGYGMSSA-N 1 1 339.395 3.541 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000917092487 1122493842 /nfs/dbraw/zinc/49/38/42/1122493842.db2.gz VHCAJSZOYLPBBT-UHFFFAOYSA-N 1 1 325.840 3.805 20 5 EHBDMO CCC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCCO1 ZINC000609314337 1123354754 /nfs/dbraw/zinc/35/47/54/1123354754.db2.gz DNXVISRUMCSBLO-GOSISDBHSA-N 1 1 336.432 3.645 20 5 EHBDMO CCc1ccc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000007790908 1123418878 /nfs/dbraw/zinc/41/88/78/1123418878.db2.gz UOROOOGDXSUDHL-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000007790908 1123418882 /nfs/dbraw/zinc/41/88/82/1123418882.db2.gz UOROOOGDXSUDHL-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916593 1123692053 /nfs/dbraw/zinc/69/20/53/1123692053.db2.gz ZRTSHNMBEUJKNB-KRWDZBQOSA-N 1 1 328.387 3.841 20 5 EHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001844 1123710542 /nfs/dbraw/zinc/71/05/42/1123710542.db2.gz DSIHTARBBOQNJP-GUYCJALGSA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nn(-c3ccccc3)c3c2CCC3)cc1 ZINC000069782576 1125048017 /nfs/dbraw/zinc/04/80/17/1125048017.db2.gz SSGORXKQJMAATP-UHFFFAOYSA-N 1 1 348.406 3.559 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@H+]1C1CC1 ZINC000301846026 1129192303 /nfs/dbraw/zinc/19/23/03/1129192303.db2.gz ALBPLEWMCWDQED-UKRRQHHQSA-N 1 1 338.411 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)nc1-c1ccccc1 ZINC000301880115 1129249901 /nfs/dbraw/zinc/24/99/01/1129249901.db2.gz PCZQYXPTVMVTRD-CVEARBPZSA-N 1 1 338.411 3.696 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000068449286 1129371751 /nfs/dbraw/zinc/37/17/51/1129371751.db2.gz QEBOKEMHOGNRQS-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000328113002 1129548463 /nfs/dbraw/zinc/54/84/63/1129548463.db2.gz UYTPKRJJDIVYOW-NUJGCVRESA-N 1 1 348.443 3.509 20 5 EHBDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000093481656 1129590448 /nfs/dbraw/zinc/59/04/48/1129590448.db2.gz WQZOHBGGYQFGQC-CYBMUJFWSA-N 1 1 348.374 3.729 20 5 EHBDMO Cc1ccc(C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638060 1129597662 /nfs/dbraw/zinc/59/76/62/1129597662.db2.gz AFONHTKGFSENQT-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1ccc(C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638060 1129597666 /nfs/dbraw/zinc/59/76/66/1129597666.db2.gz AFONHTKGFSENQT-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000093870959 1129606392 /nfs/dbraw/zinc/60/63/92/1129606392.db2.gz IVSKNOBZTSCLSP-LBPRGKRZSA-N 1 1 342.461 3.576 20 5 EHBDMO C[N@@H+](CCn1cccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125251158 1129674080 /nfs/dbraw/zinc/67/40/80/1129674080.db2.gz KAHOIZYLBTWDJJ-UHFFFAOYSA-N 1 1 342.424 3.652 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922879823 1129703058 /nfs/dbraw/zinc/70/30/58/1129703058.db2.gz CTOSXBYBSXKCFP-INIZCTEOSA-N 1 1 327.384 3.556 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000132403543 1129898626 /nfs/dbraw/zinc/89/86/26/1129898626.db2.gz LJYQSGXYTKVIHI-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCO3)o2)cc1 ZINC000556620410 1129913858 /nfs/dbraw/zinc/91/38/58/1129913858.db2.gz ZXHACWCQRLSJRR-MJGOQNOKSA-N 1 1 342.395 3.998 20 5 EHBDMO CC(C)([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000429230525 1130098523 /nfs/dbraw/zinc/09/85/23/1130098523.db2.gz ZLIGGSJCTNNLKG-UHFFFAOYSA-N 1 1 347.802 3.712 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCCC1 ZINC000039536600 1130139740 /nfs/dbraw/zinc/13/97/40/1130139740.db2.gz VRTYTRAFFISYBO-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000173212258 1130196820 /nfs/dbraw/zinc/19/68/20/1130196820.db2.gz BTBXBYQTRUUUIP-CQSZACIVSA-N 1 1 349.337 3.552 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208669 1130779686 /nfs/dbraw/zinc/77/96/86/1130779686.db2.gz CSRIBIGJRIOEQO-RYUDHWBXSA-N 1 1 334.445 3.737 20 5 EHBDMO CC[NH+](CC)[C@H](C(=O)OCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000731907808 1130860112 /nfs/dbraw/zinc/86/01/12/1130860112.db2.gz KSHWATCSZIEYGD-SFHVURJKSA-N 1 1 342.395 3.721 20 5 EHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150031 1131693342 /nfs/dbraw/zinc/69/33/42/1131693342.db2.gz TYFOILBQSHBOSC-HOCLYGCPSA-N 1 1 343.431 3.711 20 5 EHBDMO CCCCC[NH+]1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172916522 1131904098 /nfs/dbraw/zinc/90/40/98/1131904098.db2.gz TWIYJNDBZKITQD-IBGZPJMESA-N 1 1 345.487 3.650 20 5 EHBDMO COc1cccc2c1C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172921012 1131905829 /nfs/dbraw/zinc/90/58/29/1131905829.db2.gz NXVUQSHNRNJYDO-QGZVFWFLSA-N 1 1 338.407 3.867 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001173189250 1131994889 /nfs/dbraw/zinc/99/48/89/1131994889.db2.gz JXACYPBALGSAIC-QWRGUYRKSA-N 1 1 346.349 3.651 20 5 EHBDMO CCOC(=O)[C@]1(C)CCCC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223253 1132005627 /nfs/dbraw/zinc/00/56/27/1132005627.db2.gz ZEFPSUGKFYKGCA-DNVCBOLYSA-N 1 1 348.443 3.581 20 5 EHBDMO COc1ccc(OCC[N@@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000744385192 1132086237 /nfs/dbraw/zinc/08/62/37/1132086237.db2.gz MXXGFTSPRNBWMS-AWEZNQCLSA-N 1 1 342.395 3.602 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746027041 1132350872 /nfs/dbraw/zinc/35/08/72/1132350872.db2.gz UNIYPAWQKBTLCK-UHFFFAOYSA-N 1 1 342.374 3.952 20 5 EHBDMO CC(C)CC[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000746064581 1132362569 /nfs/dbraw/zinc/36/25/69/1132362569.db2.gz NDZDMMMTDGLLTC-UHFFFAOYSA-N 1 1 347.415 3.751 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@H](C)C1CCCCC1 ZINC001175229302 1132601988 /nfs/dbraw/zinc/60/19/88/1132601988.db2.gz NXYRXZVCJYAISE-HNNXBMFYSA-N 1 1 347.459 3.990 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](c2ccc(F)cc2)C1(C)C ZINC001175231029 1132602454 /nfs/dbraw/zinc/60/24/54/1132602454.db2.gz ZQKVSDZEWUUWLZ-INIZCTEOSA-N 1 1 346.406 3.507 20 5 EHBDMO CCCCCC[C@](CC)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C(=O)OCC ZINC001169006293 1132630171 /nfs/dbraw/zinc/63/01/71/1132630171.db2.gz GQLAKJPMLXMJQU-NUJGCVRESA-N 1 1 342.480 3.704 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009704 1132631567 /nfs/dbraw/zinc/63/15/67/1132631567.db2.gz XHOMEXLSPXELQL-RBUKOAKNSA-N 1 1 325.412 3.529 20 5 EHBDMO COc1cc(C[N@H+](C)CCc2ccccc2F)c([N+](=O)[O-])cc1F ZINC000766778871 1132813008 /nfs/dbraw/zinc/81/30/08/1132813008.db2.gz CWYHEGLITJEMIX-UHFFFAOYSA-N 1 1 336.338 3.556 20 5 EHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2F)c([N+](=O)[O-])cc1F ZINC000766778871 1132813011 /nfs/dbraw/zinc/81/30/11/1132813011.db2.gz CWYHEGLITJEMIX-UHFFFAOYSA-N 1 1 336.338 3.556 20 5 EHBDMO Cc1ccc(F)c(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001169822142 1132870819 /nfs/dbraw/zinc/87/08/19/1132870819.db2.gz SDZHTTMUACJEDG-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000768541013 1133153089 /nfs/dbraw/zinc/15/30/89/1133153089.db2.gz CXWBDFVGTZWWJI-AWEZNQCLSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000768541013 1133153094 /nfs/dbraw/zinc/15/30/94/1133153094.db2.gz CXWBDFVGTZWWJI-AWEZNQCLSA-N 1 1 346.818 3.726 20 5 EHBDMO C[N@H+](Cc1ccc2c(c1)OCCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768543681 1133158305 /nfs/dbraw/zinc/15/83/05/1133158305.db2.gz CXBGMPCSGKXQNV-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO C[N@@H+](Cc1ccc2c(c1)OCCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768543681 1133158309 /nfs/dbraw/zinc/15/83/09/1133158309.db2.gz CXBGMPCSGKXQNV-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC000769192626 1133233515 /nfs/dbraw/zinc/23/35/15/1133233515.db2.gz MVZJDSYUOYKZBJ-UHFFFAOYSA-N 1 1 339.233 3.978 20 5 EHBDMO C[C@@H]1COCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455710 1133294630 /nfs/dbraw/zinc/29/46/30/1133294630.db2.gz JLWATHFTVWMJCA-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001182327205 1133634222 /nfs/dbraw/zinc/63/42/22/1133634222.db2.gz QCMOPJHWXLYMDT-AWEZNQCLSA-N 1 1 345.365 3.528 20 5 EHBDMO COC(=O)CC[C@@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC001183631245 1133839471 /nfs/dbraw/zinc/83/94/71/1133839471.db2.gz QIQOAOGRRADIJI-QZFKAFNDSA-N 1 1 346.427 3.663 20 5 EHBDMO C[C@@H](OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877270 1133916228 /nfs/dbraw/zinc/91/62/28/1133916228.db2.gz CDKQUPUZLPHLKS-DYVFJYSZSA-N 1 1 332.400 3.606 20 5 EHBDMO C[C@@H](OC(=O)[C@H]1CCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879803 1133922976 /nfs/dbraw/zinc/92/29/76/1133922976.db2.gz DVQCHOSYMBRABG-CXAGYDPISA-N 1 1 332.400 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000774835382 1134036878 /nfs/dbraw/zinc/03/68/78/1134036878.db2.gz KTMKDNLHIFCJAA-UHFFFAOYSA-N 1 1 341.367 3.710 20 5 EHBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120039 1134080119 /nfs/dbraw/zinc/08/01/19/1134080119.db2.gz PQAPPXSIVUFZQG-GXTWGEPZSA-N 1 1 346.408 3.593 20 5 EHBDMO CN(c1cccc(C(F)(F)F)c1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001186422525 1134216716 /nfs/dbraw/zinc/21/67/16/1134216716.db2.gz WUTDDUQFVJFWCA-FOSCPWQOSA-N 1 1 343.349 3.675 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001187243209 1134313500 /nfs/dbraw/zinc/31/35/00/1134313500.db2.gz SYDBUOMRSHOJPN-OAHLLOKOSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ncccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170330526 1134750422 /nfs/dbraw/zinc/75/04/22/1134750422.db2.gz ABHXEFLWDQNEPQ-OSYLJGHBSA-N 1 1 338.411 3.597 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@H+](CCC1CC1)CC2 ZINC000792892577 1134814491 /nfs/dbraw/zinc/81/44/91/1134814491.db2.gz PQIBERPKURBHKB-UHFFFAOYSA-N 1 1 325.206 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@@H+](CCC1CC1)CC2 ZINC000792892577 1134814501 /nfs/dbraw/zinc/81/45/01/1134814501.db2.gz PQIBERPKURBHKB-UHFFFAOYSA-N 1 1 325.206 3.516 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792909803 1134823247 /nfs/dbraw/zinc/82/32/47/1134823247.db2.gz OZJDRHWDGDUFFF-UONOGXRCSA-N 1 1 345.226 3.619 20 5 EHBDMO Cc1ccc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000793614185 1134972789 /nfs/dbraw/zinc/97/27/89/1134972789.db2.gz OPTZFIXGZKWIQD-KGLIPLIRSA-N 1 1 329.227 3.919 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1[N+](=O)[O-] ZINC000793614185 1134972791 /nfs/dbraw/zinc/97/27/91/1134972791.db2.gz OPTZFIXGZKWIQD-KGLIPLIRSA-N 1 1 329.227 3.919 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CCCC1 ZINC001194176596 1135237993 /nfs/dbraw/zinc/23/79/93/1135237993.db2.gz OMVVTGCARCXUED-CQSZACIVSA-N 1 1 328.416 3.834 20 5 EHBDMO CCC[C@H](C)CCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001194724156 1135312797 /nfs/dbraw/zinc/31/27/97/1135312797.db2.gz QXKNUERNERXFNW-INIZCTEOSA-N 1 1 347.459 3.569 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@@H](C)C(C)(C)C ZINC001197601742 1135713822 /nfs/dbraw/zinc/71/38/22/1135713822.db2.gz KHLSFVDDEDBNST-CQSZACIVSA-N 1 1 335.448 3.846 20 5 EHBDMO C[C@H](CO)[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999426 1135912433 /nfs/dbraw/zinc/91/24/33/1135912433.db2.gz HLFBNPMPKMLSDK-SNVBAGLBSA-N 1 1 347.242 3.885 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000810047242 1135915913 /nfs/dbraw/zinc/91/59/13/1135915913.db2.gz PZKAGIDGKUCBSI-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000810047242 1135915916 /nfs/dbraw/zinc/91/59/16/1135915916.db2.gz PZKAGIDGKUCBSI-LJQANCHMSA-N 1 1 342.370 3.704 20 5 EHBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2ccccc21 ZINC000776270563 1136123704 /nfs/dbraw/zinc/12/37/04/1136123704.db2.gz CTNWEHDRUXFYBE-RBUKOAKNSA-N 1 1 326.396 3.638 20 5 EHBDMO CC[N@H+](Cc1ccccc1Cl)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277499 1136126562 /nfs/dbraw/zinc/12/65/62/1136126562.db2.gz QBFIHTKVTQNQKD-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276666 1136131202 /nfs/dbraw/zinc/13/12/02/1136131202.db2.gz IRXVKSUNGNNAQF-UXHICEINSA-N 1 1 340.423 3.884 20 5 EHBDMO C[N@H+](Cc1cccc2ccccc21)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278274 1136133605 /nfs/dbraw/zinc/13/36/05/1136133605.db2.gz TTWUJJGIZSTBFB-HXUWFJFHSA-N 1 1 336.391 3.913 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000776580724 1136445114 /nfs/dbraw/zinc/44/51/14/1136445114.db2.gz ZGNAYPLDXVBUNY-UGSOOPFHSA-N 1 1 332.375 3.850 20 5 EHBDMO Cc1ccc(C(C)(C)C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776586919 1136449427 /nfs/dbraw/zinc/44/94/27/1136449427.db2.gz AJAXYPYTNQVEMC-IBGZPJMESA-N 1 1 342.439 3.846 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589713 1136452947 /nfs/dbraw/zinc/45/29/47/1136452947.db2.gz VUPNDISZUILLIL-COXVUDFISA-N 1 1 330.384 3.694 20 5 EHBDMO Cc1c(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000852484483 1136459528 /nfs/dbraw/zinc/45/95/28/1136459528.db2.gz FPZGWIOHZAEXGS-GOSISDBHSA-N 1 1 342.395 3.850 20 5 EHBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000852484483 1136459530 /nfs/dbraw/zinc/45/95/30/1136459530.db2.gz FPZGWIOHZAEXGS-GOSISDBHSA-N 1 1 342.395 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000814641831 1136488103 /nfs/dbraw/zinc/48/81/03/1136488103.db2.gz LLGDTLVAUICKSI-PKOBYXMFSA-N 1 1 326.396 3.508 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000853243199 1136521660 /nfs/dbraw/zinc/52/16/60/1136521660.db2.gz ZAUHYXVILTUQDZ-UHFFFAOYSA-N 1 1 327.375 3.843 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001135040886 1136595490 /nfs/dbraw/zinc/59/54/90/1136595490.db2.gz AJXKJKKNXUZSHJ-QGZVFWFLSA-N 1 1 327.384 3.559 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)cc1Cl ZINC000816656710 1136745589 /nfs/dbraw/zinc/74/55/89/1136745589.db2.gz BJKUDHNADSIPBZ-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO Cn1ccnc1[C@@H](Nc1cccc(C2CC2)[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000816636379 1136747238 /nfs/dbraw/zinc/74/72/38/1136747238.db2.gz SAUQTUSYRWBWTE-SFHVURJKSA-N 1 1 349.394 3.802 20 5 EHBDMO CCCC[N@H+](C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819438228 1136939372 /nfs/dbraw/zinc/93/93/72/1136939372.db2.gz RQFYSGSLTOUFRE-LJQANCHMSA-N 1 1 343.427 3.977 20 5 EHBDMO CCCC[N@@H+](C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819438228 1136939374 /nfs/dbraw/zinc/93/93/74/1136939374.db2.gz RQFYSGSLTOUFRE-LJQANCHMSA-N 1 1 343.427 3.977 20 5 EHBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738639 1137075964 /nfs/dbraw/zinc/07/59/64/1137075964.db2.gz CGGKGMVJLWTJDV-GOEBONIOSA-N 1 1 340.379 3.532 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000824820729 1137153965 /nfs/dbraw/zinc/15/39/65/1137153965.db2.gz LKGIUSCUFRFUHW-CQSZACIVSA-N 1 1 347.396 3.944 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000824820729 1137153966 /nfs/dbraw/zinc/15/39/66/1137153966.db2.gz LKGIUSCUFRFUHW-CQSZACIVSA-N 1 1 347.396 3.944 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3coc(C4CC4)n3)C2)cc1 ZINC000824820502 1137153973 /nfs/dbraw/zinc/15/39/73/1137153973.db2.gz GRJVABSXFUYNQO-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3coc(C4CC4)n3)C2)cc1 ZINC000824820502 1137153974 /nfs/dbraw/zinc/15/39/74/1137153974.db2.gz GRJVABSXFUYNQO-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CO[NH+]=C(N)CCC(F)(F)F ZINC000863489824 1137189006 /nfs/dbraw/zinc/18/90/06/1137189006.db2.gz SZUJWKFXCBFLOQ-UHFFFAOYSA-N 1 1 349.309 3.723 20 5 EHBDMO CSc1ccccc1C[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000794656987 1137224446 /nfs/dbraw/zinc/22/44/46/1137224446.db2.gz RETCFGAGVXQGCT-UHFFFAOYSA-N 1 1 342.424 3.756 20 5 EHBDMO CSc1ccccc1C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000794656987 1137224447 /nfs/dbraw/zinc/22/44/47/1137224447.db2.gz RETCFGAGVXQGCT-UHFFFAOYSA-N 1 1 342.424 3.756 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846118236 1137334042 /nfs/dbraw/zinc/33/40/42/1137334042.db2.gz WEMDMCYKWPTGED-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846118236 1137334044 /nfs/dbraw/zinc/33/40/44/1137334044.db2.gz WEMDMCYKWPTGED-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000846933902 1137376266 /nfs/dbraw/zinc/37/62/66/1137376266.db2.gz XZIOEUMSLZXKQW-CQSZACIVSA-N 1 1 348.834 3.607 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740043 1137511342 /nfs/dbraw/zinc/51/13/42/1137511342.db2.gz ARGUWPFDJFFWPP-CYBMUJFWSA-N 1 1 341.367 3.665 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1N(C)C ZINC000872024043 1137565541 /nfs/dbraw/zinc/56/55/41/1137565541.db2.gz XPHUKGNAXVTAKF-GFCCVEGCSA-N 1 1 346.456 3.629 20 5 EHBDMO COc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(Cl)cc1O ZINC000877730071 1137687101 /nfs/dbraw/zinc/68/71/01/1137687101.db2.gz LJJIAOWCSOGFCY-UHFFFAOYSA-N 1 1 336.775 3.561 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877795371 1137690168 /nfs/dbraw/zinc/69/01/68/1137690168.db2.gz IDRBXWDDQHAWNN-CYBMUJFWSA-N 1 1 346.349 3.597 20 5 EHBDMO CC1CC[NH+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1 ZINC000877934281 1137696280 /nfs/dbraw/zinc/69/62/80/1137696280.db2.gz AKFIAMJVVIAIGO-UHFFFAOYSA-N 1 1 336.779 3.530 20 5 EHBDMO CC1(C)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878132507 1137703880 /nfs/dbraw/zinc/70/38/80/1137703880.db2.gz XOBLBVZQILNYSI-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878149624 1137704483 /nfs/dbraw/zinc/70/44/83/1137704483.db2.gz ZXLJFZXZSXNQJX-KRWDZBQOSA-N 1 1 330.388 3.657 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066650 1137736901 /nfs/dbraw/zinc/73/69/01/1137736901.db2.gz QMBGXUOBVWUHQV-PYLYLYNFSA-N 1 1 342.399 3.823 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879747073 1137757494 /nfs/dbraw/zinc/75/74/94/1137757494.db2.gz AJWAIQQCRBSBHQ-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879747073 1137757495 /nfs/dbraw/zinc/75/74/95/1137757495.db2.gz AJWAIQQCRBSBHQ-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880100129 1137768085 /nfs/dbraw/zinc/76/80/85/1137768085.db2.gz SEFZSTKPXZTNHX-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000883321979 1137854694 /nfs/dbraw/zinc/85/46/94/1137854694.db2.gz RDPTYHPSHHUYNZ-VIBAHUMZSA-N 1 1 340.427 3.586 20 5 EHBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000114724229 1137918666 /nfs/dbraw/zinc/91/86/66/1137918666.db2.gz SBRXSRLWOZHFOV-UHFFFAOYSA-N 1 1 329.400 3.914 20 5 EHBDMO CC(=O)Oc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135242192 1137964971 /nfs/dbraw/zinc/96/49/71/1137964971.db2.gz NBRFQHYWDSROIV-UHFFFAOYSA-N 1 1 340.379 3.685 20 5 EHBDMO CC(=O)Oc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135242192 1137964972 /nfs/dbraw/zinc/96/49/72/1137964972.db2.gz NBRFQHYWDSROIV-UHFFFAOYSA-N 1 1 340.379 3.685 20 5 EHBDMO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885999934 1138031220 /nfs/dbraw/zinc/03/12/20/1138031220.db2.gz QBYSRTQAOYRUEW-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885999934 1138031222 /nfs/dbraw/zinc/03/12/22/1138031222.db2.gz QBYSRTQAOYRUEW-INIZCTEOSA-N 1 1 327.384 3.726 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000076650763 1138133413 /nfs/dbraw/zinc/13/34/13/1138133413.db2.gz JDGILBBULNRHCU-UHFFFAOYSA-N 1 1 332.404 3.903 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c1 ZINC000886818105 1138148714 /nfs/dbraw/zinc/14/87/14/1138148714.db2.gz ALHNLERLMDNSSR-XHDPSFHLSA-N 1 1 344.333 3.615 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091097772 1138215894 /nfs/dbraw/zinc/21/58/94/1138215894.db2.gz JIJYNMQIDYHUPF-CQSZACIVSA-N 1 1 335.429 3.823 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066266 1138224376 /nfs/dbraw/zinc/22/43/76/1138224376.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 1 1 341.455 3.557 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093337387 1138235970 /nfs/dbraw/zinc/23/59/70/1138235970.db2.gz LNPXNYORBZLKJI-CYBMUJFWSA-N 1 1 347.440 3.577 20 5 EHBDMO Cc1ccc2c(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])ccc(O)c2n1 ZINC000338236940 1138797582 /nfs/dbraw/zinc/79/75/82/1138797582.db2.gz PJCHCRHDJDRSLW-UHFFFAOYSA-N 1 1 337.379 3.789 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCCCn2cccn2)C2CC2)c1 ZINC000153290634 1139131007 /nfs/dbraw/zinc/13/10/07/1139131007.db2.gz QAUWUEQQURCAEA-UHFFFAOYSA-N 1 1 328.416 3.626 20 5 EHBDMO COC(=O)c1oc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000180399923 1139831962 /nfs/dbraw/zinc/83/19/62/1139831962.db2.gz JFKKXJUJVGFOLR-NWDGAFQWSA-N 1 1 332.356 3.695 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969225 1140070380 /nfs/dbraw/zinc/07/03/80/1140070380.db2.gz MTEKMBKLVLBYKU-JTQLQIEISA-N 1 1 325.821 3.940 20 5 EHBDMO COc1cc(C[NH2+]Cc2ccc(C(F)F)cc2)c([N+](=O)[O-])cc1O ZINC000185184414 1140139337 /nfs/dbraw/zinc/13/93/37/1140139337.db2.gz VEGAISRPHRCXMX-UHFFFAOYSA-N 1 1 338.310 3.536 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000271128441 1141311668 /nfs/dbraw/zinc/31/16/68/1141311668.db2.gz LAIZTEMBCWBCRL-HUUCEWRRSA-N 1 1 349.500 3.539 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271490621 1141378999 /nfs/dbraw/zinc/37/89/99/1141378999.db2.gz OVVIBSFXKAMMRV-BLLLJJGKSA-N 1 1 348.374 3.517 20 5 EHBDMO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271582819 1141402202 /nfs/dbraw/zinc/40/22/02/1141402202.db2.gz CLHGRDAVVKZEGS-LSDHHAIUSA-N 1 1 341.411 3.687 20 5 EHBDMO Cn1cc(C[N@@H+](C)C2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157491295 1014468670 /nfs/dbraw/zinc/46/86/70/1014468670.db2.gz SYHFBGHZGKFGMO-UHFFFAOYSA-N 1 1 328.416 3.760 20 5 EHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820336 1015016480 /nfs/dbraw/zinc/01/64/80/1015016480.db2.gz QEQGBOHBUQOJKT-YRNVUSSQSA-N 1 1 326.396 3.757 20 5 EHBDMO C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302040823 1015123484 /nfs/dbraw/zinc/12/34/84/1015123484.db2.gz HYTJPRWNDBIZAP-VXGBXAGGSA-N 1 1 339.386 3.938 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC001167707975 1016409448 /nfs/dbraw/zinc/40/94/48/1016409448.db2.gz IXFSSFGTNQFINF-GOSISDBHSA-N 1 1 340.427 3.642 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccccn2)Cc2cccnc2)cc1 ZINC000430344986 1016423728 /nfs/dbraw/zinc/42/37/28/1016423728.db2.gz PPNVUIJONLOUGB-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccn2)Cc2cccnc2)cc1 ZINC000430344986 1016423734 /nfs/dbraw/zinc/42/37/34/1016423734.db2.gz PPNVUIJONLOUGB-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC001167278940 1016982222 /nfs/dbraw/zinc/98/22/22/1016982222.db2.gz ZOKWAPXVEUEXQF-AWEZNQCLSA-N 1 1 329.425 3.862 20 5 EHBDMO Cc1cc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ncc1[N+](=O)[O-] ZINC000074744958 1032206020 /nfs/dbraw/zinc/20/60/20/1032206020.db2.gz FFQMNQASMHBQOT-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO CC[N@@H+](C[C@H]1COc2ccccc2O1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189004 1032368342 /nfs/dbraw/zinc/36/83/42/1032368342.db2.gz FKGWQLJOKCEKOP-CABCVRRESA-N 1 1 342.395 3.818 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3CS4)o2)c([N+](=O)[O-])c1 ZINC000459747956 1032443915 /nfs/dbraw/zinc/44/39/15/1032443915.db2.gz HLJJQNXGGLKXCB-FZMZJTMJSA-N 1 1 346.408 3.553 20 5 EHBDMO CC(C)O[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000593056155 1032687417 /nfs/dbraw/zinc/68/74/17/1032687417.db2.gz ZNPOXONHTCLPFL-KRWDZBQOSA-N 1 1 345.399 3.639 20 5 EHBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000593056155 1032687425 /nfs/dbraw/zinc/68/74/25/1032687425.db2.gz ZNPOXONHTCLPFL-KRWDZBQOSA-N 1 1 345.399 3.639 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947343 1017347886 /nfs/dbraw/zinc/34/78/86/1017347886.db2.gz KSHWCMUUFSKSCW-QWHCGFSZSA-N 1 1 331.441 3.553 20 5 EHBDMO C[C@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294689 1017899209 /nfs/dbraw/zinc/89/92/09/1017899209.db2.gz WYRGYSNRZZTMSP-MAUKXSAKSA-N 1 1 336.395 3.883 20 5 EHBDMO CC[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866655 1018544444 /nfs/dbraw/zinc/54/44/44/1018544444.db2.gz DJEJMQDPYMIZCT-DOTOQJQBSA-N 1 1 326.400 3.627 20 5 EHBDMO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1ccc([N+](=O)[O-])cc1 ZINC000379622588 1019002461 /nfs/dbraw/zinc/00/24/61/1019002461.db2.gz GVULMOORMNXHNO-UHFFFAOYSA-N 1 1 327.428 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1ccc([N+](=O)[O-])cc1 ZINC000379622588 1019002477 /nfs/dbraw/zinc/00/24/77/1019002477.db2.gz GVULMOORMNXHNO-UHFFFAOYSA-N 1 1 327.428 3.595 20 5 EHBDMO CN(C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116427 1019027627 /nfs/dbraw/zinc/02/76/27/1019027627.db2.gz FIAIFFAEYZQBBF-INIZCTEOSA-N 1 1 345.468 3.849 20 5 EHBDMO CN(C)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116427 1019027644 /nfs/dbraw/zinc/02/76/44/1019027644.db2.gz FIAIFFAEYZQBBF-INIZCTEOSA-N 1 1 345.468 3.849 20 5 EHBDMO CC1([NH3+])CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000592431664 1032836581 /nfs/dbraw/zinc/83/65/81/1032836581.db2.gz WRYIHMYBAWDLPF-UHFFFAOYSA-N 1 1 331.441 3.637 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1C ZINC000433787061 1019614703 /nfs/dbraw/zinc/61/47/03/1019614703.db2.gz QRCANEKPRYHQEH-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO Cc1ncc([C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000602438095 1032890405 /nfs/dbraw/zinc/89/04/05/1032890405.db2.gz AVHWEWRAZPAFMU-CYBMUJFWSA-N 1 1 326.400 3.727 20 5 EHBDMO Cc1ncc([C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000602438095 1032890421 /nfs/dbraw/zinc/89/04/21/1032890421.db2.gz AVHWEWRAZPAFMU-CYBMUJFWSA-N 1 1 326.400 3.727 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCN(c2ccccc2)C1 ZINC000602440625 1032890458 /nfs/dbraw/zinc/89/04/58/1032890458.db2.gz QNHYCXNBOCGUQN-MRXNPFEDSA-N 1 1 325.412 3.553 20 5 EHBDMO CO[C@]1(C)CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000280468642 1020409320 /nfs/dbraw/zinc/40/93/20/1020409320.db2.gz CJVSZABLCIGYTJ-QGZVFWFLSA-N 1 1 347.440 3.719 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000280468642 1020409327 /nfs/dbraw/zinc/40/93/27/1020409327.db2.gz CJVSZABLCIGYTJ-QGZVFWFLSA-N 1 1 347.440 3.719 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](C)O ZINC000513703171 1020636002 /nfs/dbraw/zinc/63/60/02/1020636002.db2.gz RIARMZNYAZXZTC-CYBMUJFWSA-N 1 1 334.441 3.915 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC001167453972 1020659139 /nfs/dbraw/zinc/65/91/39/1020659139.db2.gz PKACUIPBTDIAQD-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000326000036 1020666690 /nfs/dbraw/zinc/66/66/90/1020666690.db2.gz FPJKKVDKPRFDTG-BHIYHBOVSA-N 1 1 332.444 3.809 20 5 EHBDMO COc1ccccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602504511 1032937610 /nfs/dbraw/zinc/93/76/10/1032937610.db2.gz SAUFVADKMWLKED-UHFFFAOYSA-N 1 1 340.301 3.912 20 5 EHBDMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477787 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O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)c(C(F)F)c1 ZINC000895567680 1024623984 /nfs/dbraw/zinc/62/39/84/1024623984.db2.gz GQVFMDOQZNHBDC-UONOGXRCSA-N 1 1 343.399 3.524 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605732 1024629690 /nfs/dbraw/zinc/62/96/90/1024629690.db2.gz DIKYQIMJCRIMRE-ZFWWWQNUSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505605732 1024629695 /nfs/dbraw/zinc/62/96/95/1024629695.db2.gz DIKYQIMJCRIMRE-ZFWWWQNUSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000065535121 1024658925 /nfs/dbraw/zinc/65/89/25/1024658925.db2.gz ILUUZTHZGUAMQW-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO C[N@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435229768 1024716165 /nfs/dbraw/zinc/71/61/65/1024716165.db2.gz LDZLUXJOYBNZEO-UHFFFAOYSA-N 1 1 349.818 3.646 20 5 EHBDMO CN1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435229768 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326.396 3.763 20 5 EHBDMO C[C@H](COCc1ccccc1)C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001167548824 1025315778 /nfs/dbraw/zinc/31/57/78/1025315778.db2.gz IAPUYMLHMVFIFB-HNNXBMFYSA-N 1 1 326.396 3.763 20 5 EHBDMO CC(C)CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000046512373 1033284662 /nfs/dbraw/zinc/28/46/62/1033284662.db2.gz RNSPHXAOKQNRPB-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000185634638 1025481994 /nfs/dbraw/zinc/48/19/94/1025481994.db2.gz HAKVJWYQDCNADD-UHFFFAOYSA-N 1 1 338.411 3.815 20 5 EHBDMO Cc1ccccc1[C@@H]([C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000442998377 1025640525 /nfs/dbraw/zinc/64/05/25/1025640525.db2.gz IZQFPNYHRGZZBV-IFXJQAMLSA-N 1 1 345.418 3.823 20 5 EHBDMO Cc1c(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cccc1[N+](=O)[O-] ZINC000425547188 1025721792 /nfs/dbraw/zinc/72/17/92/1025721792.db2.gz FNZVVYYCLFFIPU-SFHVURJKSA-N 1 1 330.428 3.684 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000505855007 1025981037 /nfs/dbraw/zinc/98/10/37/1025981037.db2.gz AEDHELUDVFLGMY-INIZCTEOSA-N 1 1 342.395 3.504 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000020813831 1025984015 /nfs/dbraw/zinc/98/40/15/1025984015.db2.gz TUJZMIWHRBSYKU-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000020813831 1025984037 /nfs/dbraw/zinc/98/40/37/1025984037.db2.gz TUJZMIWHRBSYKU-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO Cc1cc(NCCc2[nH+]ccn2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000051654802 1026129625 /nfs/dbraw/zinc/12/96/25/1026129625.db2.gz DSDUROWNMKAYSV-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO CCOc1cc(C[N@@H+](C)CCc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492460727 1026131697 /nfs/dbraw/zinc/13/16/97/1026131697.db2.gz JARZEHVSUUIYQT-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475114612 1026210123 /nfs/dbraw/zinc/21/01/23/1026210123.db2.gz AHHGJOGXMCHIHL-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000451732149 1026238040 /nfs/dbraw/zinc/23/80/40/1026238040.db2.gz GDPWLDRZJWEAPV-INIZCTEOSA-N 1 1 334.807 3.672 20 5 EHBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])c(C)c2)c(N2CCCC2)[nH+]1 ZINC000302069820 1026320570 /nfs/dbraw/zinc/32/05/70/1026320570.db2.gz XTDZGUWXGUZJKU-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000339166173 1026400224 /nfs/dbraw/zinc/40/02/24/1026400224.db2.gz CVKREIBEBXZTMJ-GJZGRUSLSA-N 1 1 344.333 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c1 ZINC000339166173 1026400230 /nfs/dbraw/zinc/40/02/30/1026400230.db2.gz CVKREIBEBXZTMJ-GJZGRUSLSA-N 1 1 344.333 3.757 20 5 EHBDMO CCN(CC)[C@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475335379 1026488433 /nfs/dbraw/zinc/48/84/33/1026488433.db2.gz GSJRULCDHDXABT-CQSZACIVSA-N 1 1 331.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186438412 1026901474 /nfs/dbraw/zinc/90/14/74/1026901474.db2.gz XJQWKXHIDJBSRI-MUPIXQSSSA-N 1 1 336.391 3.739 20 5 EHBDMO CCCn1nc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1C ZINC000183807133 1027095299 /nfs/dbraw/zinc/09/52/99/1027095299.db2.gz UMMLGCRERFQYQR-UHFFFAOYSA-N 1 1 336.823 3.761 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCCOC4)o2)c1 ZINC000342836342 1027551491 /nfs/dbraw/zinc/55/14/91/1027551491.db2.gz JIGKTGMJYWKXFW-LJQANCHMSA-N 1 1 342.395 3.857 20 5 EHBDMO Cc1cc(C)cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000501897826 1027637001 /nfs/dbraw/zinc/63/70/01/1027637001.db2.gz FIPVZBOKOUUSDW-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444747554 1028235137 /nfs/dbraw/zinc/23/51/37/1028235137.db2.gz AKZFWPPVAXBZGO-AWEZNQCLSA-N 1 1 330.388 3.513 20 5 EHBDMO CCOc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289695 1028325292 /nfs/dbraw/zinc/32/52/92/1028325292.db2.gz BONIFYZXZZEDHF-ZIAGYGMSSA-N 1 1 343.427 3.864 20 5 EHBDMO COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000519917718 1028379133 /nfs/dbraw/zinc/37/91/33/1028379133.db2.gz FRSJTXCCESYBLK-MRXNPFEDSA-N 1 1 344.411 3.683 20 5 EHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592999 1028882323 /nfs/dbraw/zinc/88/23/23/1028882323.db2.gz RHUGFYJFCTXPGQ-UKRRQHHQSA-N 1 1 329.400 3.913 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000505267895 1029423927 /nfs/dbraw/zinc/42/39/27/1029423927.db2.gz XCGSVVSWHAKVAI-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO Cc1c(C[N@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042873 1029660932 /nfs/dbraw/zinc/66/09/32/1029660932.db2.gz GECBPPXFLXQJQY-LIRRHRJNSA-N 1 1 326.396 3.727 20 5 EHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059129 1029719962 /nfs/dbraw/zinc/71/99/62/1029719962.db2.gz IJGYMGYUABMCMK-GOSISDBHSA-N 1 1 328.412 3.676 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000282059892 1029721445 /nfs/dbraw/zinc/72/14/45/1029721445.db2.gz MOUVGIPNKBJTIM-INIZCTEOSA-N 1 1 340.427 3.507 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441174195 1029875767 /nfs/dbraw/zinc/87/57/67/1029875767.db2.gz DGCYMIVJYLVTLN-OAHLLOKOSA-N 1 1 344.411 3.984 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2ccccc2)CC1 ZINC000441215842 1030009795 /nfs/dbraw/zinc/00/97/95/1030009795.db2.gz GBDNGXBYHKZIFV-MRXNPFEDSA-N 1 1 325.412 3.868 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000453335137 1030116082 /nfs/dbraw/zinc/11/60/82/1030116082.db2.gz CXOLTJLIXRRPRQ-XFBWCDHKSA-N 1 1 326.400 3.809 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC000611797337 1031288935 /nfs/dbraw/zinc/28/89/35/1031288935.db2.gz UZYDNWKXJSGFCJ-ZIAGYGMSSA-N 1 1 338.835 3.887 20 5 EHBDMO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950663 1032035363 /nfs/dbraw/zinc/03/53/63/1032035363.db2.gz HTEWZVLQVWMNJN-IAGOWNOFSA-N 1 1 333.476 3.922 20 5 EHBDMO CC[NH+](CC)[C@H](CNCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000061015194 1033432505 /nfs/dbraw/zinc/43/25/05/1033432505.db2.gz JDOUJXBHRBYGJY-LJQANCHMSA-N 1 1 327.428 3.768 20 5 EHBDMO CCc1nc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000063604800 1033509921 /nfs/dbraw/zinc/50/99/21/1033509921.db2.gz XVLYRCGRVXIRBO-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO CCc1nc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000063604800 1033509931 /nfs/dbraw/zinc/50/99/31/1033509931.db2.gz XVLYRCGRVXIRBO-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](COC)Cc1ccccc1 ZINC000472344371 1033597873 /nfs/dbraw/zinc/59/78/73/1033597873.db2.gz ATQQUNDXOAIEIX-FQEVSTJZSA-N 1 1 342.439 3.717 20 5 EHBDMO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595015906 1033609746 /nfs/dbraw/zinc/60/97/46/1033609746.db2.gz VYPQFFFXAKBPHF-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054951 1033632978 /nfs/dbraw/zinc/63/29/78/1033632978.db2.gz XRZZHCUCIULDMU-UKRRQHHQSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054951 1033632987 /nfs/dbraw/zinc/63/29/87/1033632987.db2.gz XRZZHCUCIULDMU-UKRRQHHQSA-N 1 1 335.448 3.517 20 5 EHBDMO COc1cccc(OC)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595073985 1033694154 /nfs/dbraw/zinc/69/41/54/1033694154.db2.gz QIWFMXZDGHXILT-KRWDZBQOSA-N 1 1 342.395 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@@H+]2CCc3ccccc3C2)c(Cl)c1 ZINC000603500085 1033700808 /nfs/dbraw/zinc/70/08/08/1033700808.db2.gz VSSDYIJJUUEDHG-UHFFFAOYSA-N 1 1 331.803 3.718 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3ccccc3C2)c(Cl)c1 ZINC000603500085 1033700820 /nfs/dbraw/zinc/70/08/20/1033700820.db2.gz VSSDYIJJUUEDHG-UHFFFAOYSA-N 1 1 331.803 3.718 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)ccc2cnccc21 ZINC000599097333 1033732658 /nfs/dbraw/zinc/73/26/58/1033732658.db2.gz BTIBFRCCZYXRKE-NVXWUHKLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000595343394 1033736246 /nfs/dbraw/zinc/73/62/46/1033736246.db2.gz QBZXIUHVAYEXIB-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1 ZINC000592996948 1033777798 /nfs/dbraw/zinc/77/77/98/1033777798.db2.gz DYFMLSXXESUECS-LBPRGKRZSA-N 1 1 346.358 3.714 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c1 ZINC000592996948 1033777813 /nfs/dbraw/zinc/77/78/13/1033777813.db2.gz DYFMLSXXESUECS-LBPRGKRZSA-N 1 1 346.358 3.714 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC4(C3)CCCCC4)n2)c1 ZINC000129923103 1033812888 /nfs/dbraw/zinc/81/28/88/1033812888.db2.gz JKMZOBPORCKTKG-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094820 1033932619 /nfs/dbraw/zinc/93/26/19/1033932619.db2.gz IJGQHBOYITZDCI-CYBMUJFWSA-N 1 1 337.379 3.898 20 5 EHBDMO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)s1 ZINC000064029697 1033944931 /nfs/dbraw/zinc/94/49/31/1033944931.db2.gz PQTGRIYXKBGNHP-UHFFFAOYSA-N 1 1 335.404 3.872 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834321 1033959925 /nfs/dbraw/zinc/95/99/25/1033959925.db2.gz QNUWPUOEJHIVET-CZUORRHYSA-N 1 1 326.400 3.634 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000603849850 1033973161 /nfs/dbraw/zinc/97/31/61/1033973161.db2.gz WPKXTOBAPKVGLJ-UHFFFAOYSA-N 1 1 332.404 3.903 20 5 EHBDMO CCc1cc(CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)on1 ZINC000450289316 1034030796 /nfs/dbraw/zinc/03/07/96/1034030796.db2.gz UUMSUEUATJXBHH-UHFFFAOYSA-N 1 1 331.416 3.988 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1F ZINC000599599764 1034042458 /nfs/dbraw/zinc/04/24/58/1034042458.db2.gz SZTLDLYBGGRDML-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097529 1034060570 /nfs/dbraw/zinc/06/05/70/1034060570.db2.gz YSLCWDCUIXHZLA-NVXWUHKLSA-N 1 1 331.460 3.676 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@H](C)c2ccccc2Cl)c1[N+](=O)[O-] ZINC000892431417 1034165421 /nfs/dbraw/zinc/16/54/21/1034165421.db2.gz QBOVXTQKCMPSGS-SNVBAGLBSA-N 1 1 336.775 3.813 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000441425849 1034314547 /nfs/dbraw/zinc/31/45/47/1034314547.db2.gz BTLOVOUEIOEITA-AWEZNQCLSA-N 1 1 328.412 3.975 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H](CCF)C2)c1 ZINC000597212142 1034596771 /nfs/dbraw/zinc/59/67/71/1034596771.db2.gz SBZAHOWFYDDWRS-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000597212142 1034596780 /nfs/dbraw/zinc/59/67/80/1034596780.db2.gz SBZAHOWFYDDWRS-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534475662 1034601005 /nfs/dbraw/zinc/60/10/05/1034601005.db2.gz PWFNYBVTRCXBMM-CQSZACIVSA-N 1 1 338.407 3.959 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC3(COC3)C2)s1 ZINC000597230095 1034610990 /nfs/dbraw/zinc/61/09/90/1034610990.db2.gz POLBMDQBSLOLJU-UHFFFAOYSA-N 1 1 330.409 3.546 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc(F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000340898991 1035018633 /nfs/dbraw/zinc/01/86/33/1035018633.db2.gz LAAPDNVBAUHTPQ-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO CC(C)[N@H+](C)Cc1cccc(CNCc2ccc([N+](=O)[O-])cc2)c1 ZINC000236666064 1035037397 /nfs/dbraw/zinc/03/73/97/1035037397.db2.gz YTYSAQIKBMHLQY-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO CC(C)[N@@H+](C)Cc1cccc(CNCc2ccc([N+](=O)[O-])cc2)c1 ZINC000236666064 1035037404 /nfs/dbraw/zinc/03/74/04/1035037404.db2.gz YTYSAQIKBMHLQY-UHFFFAOYSA-N 1 1 327.428 3.725 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000612577378 1035072572 /nfs/dbraw/zinc/07/25/72/1035072572.db2.gz BZDOYKPCWPCTSW-LJQANCHMSA-N 1 1 326.396 3.867 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000540648373 1035536819 /nfs/dbraw/zinc/53/68/19/1035536819.db2.gz USCXHWPHPWHCSH-CQSZACIVSA-N 1 1 328.416 3.594 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573348 1035539355 /nfs/dbraw/zinc/53/93/55/1035539355.db2.gz RJBZRLUDQCVAFT-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO CN1CC[C@@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573348 1035539362 /nfs/dbraw/zinc/53/93/62/1035539362.db2.gz RJBZRLUDQCVAFT-AEFFLSMTSA-N 1 1 345.830 3.783 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588197869 1035816729 /nfs/dbraw/zinc/81/67/29/1035816729.db2.gz XBYHBVGCEHCIIP-CQSZACIVSA-N 1 1 329.400 3.808 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588197869 1035816746 /nfs/dbraw/zinc/81/67/46/1035816746.db2.gz XBYHBVGCEHCIIP-CQSZACIVSA-N 1 1 329.400 3.808 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000541070512 1035948276 /nfs/dbraw/zinc/94/82/76/1035948276.db2.gz JAYYJGXCJLHKDN-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000541070512 1035948296 /nfs/dbraw/zinc/94/82/96/1035948296.db2.gz JAYYJGXCJLHKDN-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047256 1035957466 /nfs/dbraw/zinc/95/74/66/1035957466.db2.gz YTZPWSOFVASMBX-FZMZJTMJSA-N 1 1 333.354 3.518 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000535077674 1036000049 /nfs/dbraw/zinc/00/00/49/1036000049.db2.gz XWGVQEOXAIVLJE-ZRFDWSJLSA-N 1 1 344.333 3.651 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000535077674 1036000064 /nfs/dbraw/zinc/00/00/64/1036000064.db2.gz XWGVQEOXAIVLJE-ZRFDWSJLSA-N 1 1 344.333 3.651 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)ccc1[N+](=O)[O-] ZINC000492631883 1036094490 /nfs/dbraw/zinc/09/44/90/1036094490.db2.gz QMSRNWQNWKQQFO-CQSZACIVSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cc(C)no2)ccc1[N+](=O)[O-] ZINC000492631883 1036094513 /nfs/dbraw/zinc/09/45/13/1036094513.db2.gz QMSRNWQNWKQQFO-CQSZACIVSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1cc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000492654888 1036113783 /nfs/dbraw/zinc/11/37/83/1036113783.db2.gz OLQWJGKNLHLUPK-KRWDZBQOSA-N 1 1 348.443 3.917 20 5 EHBDMO CCC(CC)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000165334908 1036413860 /nfs/dbraw/zinc/41/38/60/1036413860.db2.gz CWEZICQQSDWWSA-UHFFFAOYSA-N 1 1 339.823 3.840 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC=C(C(C)(C)C)CC2)c1 ZINC000589505974 1036430805 /nfs/dbraw/zinc/43/08/05/1036430805.db2.gz SUCIEEPOSVJZGJ-UHFFFAOYSA-N 1 1 332.400 3.560 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC=C(C(C)(C)C)CC2)c1 ZINC000589505974 1036430810 /nfs/dbraw/zinc/43/08/10/1036430810.db2.gz SUCIEEPOSVJZGJ-UHFFFAOYSA-N 1 1 332.400 3.560 20 5 EHBDMO CCCOc1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000892603954 1036545272 /nfs/dbraw/zinc/54/52/72/1036545272.db2.gz VSNBSXQPRWVSQQ-UHFFFAOYSA-N 1 1 335.791 3.722 20 5 EHBDMO O=C(C[C@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000122461610 1036583157 /nfs/dbraw/zinc/58/31/57/1036583157.db2.gz URZBMADEAQWMSS-OAHLLOKOSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000122461610 1036583167 /nfs/dbraw/zinc/58/31/67/1036583167.db2.gz URZBMADEAQWMSS-OAHLLOKOSA-N 1 1 330.409 3.894 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000180334767 1036695349 /nfs/dbraw/zinc/69/53/49/1036695349.db2.gz AKKXLMYYLJCSSV-HNNXBMFYSA-N 1 1 347.459 3.514 20 5 EHBDMO Cc1ccccc1[C@H]([C@H](C)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000443008633 1036794085 /nfs/dbraw/zinc/79/40/85/1036794085.db2.gz GZNMZXXGYBGRAL-KXBFYZLASA-N 1 1 327.428 3.684 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443651845 1036940525 /nfs/dbraw/zinc/94/05/25/1036940525.db2.gz JXVZIURJJKLCLL-IPYPFGDCSA-N 1 1 333.432 3.598 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601502 1036965660 /nfs/dbraw/zinc/96/56/60/1036965660.db2.gz CMFLOQUQYJZZCG-XJKSGUPXSA-N 1 1 328.416 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3[nH]nc4ccccc43)C2)cc1 ZINC000590659590 1036995982 /nfs/dbraw/zinc/99/59/82/1036995982.db2.gz QWZVOJQKOKWIPB-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659590 1036995994 /nfs/dbraw/zinc/99/59/94/1036995994.db2.gz QWZVOJQKOKWIPB-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3n[nH]c4ccccc43)C2)cc1 ZINC000590659590 1036996002 /nfs/dbraw/zinc/99/60/02/1036996002.db2.gz QWZVOJQKOKWIPB-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO COc1ccc(OC)c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761520361 1037098835 /nfs/dbraw/zinc/09/88/35/1037098835.db2.gz CAPJDZBFDGINTP-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO CCCC(C)(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccs1 ZINC000549080647 1037146066 /nfs/dbraw/zinc/14/60/66/1037146066.db2.gz BBDNJLQBGCNQPL-UHFFFAOYSA-N 1 1 336.461 3.934 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C ZINC000493282110 1037217270 /nfs/dbraw/zinc/21/72/70/1037217270.db2.gz SDXYCQBBINWWBQ-OLZOCXBDSA-N 1 1 325.840 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532470207 1037413892 /nfs/dbraw/zinc/41/38/92/1037413892.db2.gz CFUNJGIUYAJXOM-XCRHUMRWSA-N 1 1 345.443 3.742 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000045951468 1037583808 /nfs/dbraw/zinc/58/38/08/1037583808.db2.gz HVHXCBFHPXNIBE-OAHLLOKOSA-N 1 1 348.447 3.679 20 5 EHBDMO CC(C)CC1CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000760921134 1037792895 /nfs/dbraw/zinc/79/28/95/1037792895.db2.gz OPQQDIKVVKFSNP-UHFFFAOYSA-N 1 1 344.415 3.903 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000592144717 1037866098 /nfs/dbraw/zinc/86/60/98/1037866098.db2.gz KKJTTYCWVULQSP-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc3n(n2)CCCC3)cc1[N+](=O)[O-] ZINC000592387714 1037955074 /nfs/dbraw/zinc/95/50/74/1037955074.db2.gz IRAZPHKINDWVAK-KBPBESRZSA-N 1 1 328.416 3.848 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)cc1 ZINC000237796608 1038016080 /nfs/dbraw/zinc/01/60/80/1038016080.db2.gz WQCHAIFRFRBJKV-UHFFFAOYSA-N 1 1 329.375 3.624 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000058525627 1038045821 /nfs/dbraw/zinc/04/58/21/1038045821.db2.gz WDQKNQZWBVGHTH-GOSISDBHSA-N 1 1 326.396 3.811 20 5 EHBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115117 1038310682 /nfs/dbraw/zinc/31/06/82/1038310682.db2.gz YVOZLVAZHHZQKL-HFAKWTLXSA-N 1 1 346.349 3.595 20 5 EHBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115117 1038310696 /nfs/dbraw/zinc/31/06/96/1038310696.db2.gz YVOZLVAZHHZQKL-HFAKWTLXSA-N 1 1 346.349 3.595 20 5 EHBDMO CC(C)[N@@H+](CC[S@](=O)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000104676593 1038452759 /nfs/dbraw/zinc/45/27/59/1038452759.db2.gz DKOCPHKWANFKDK-XMMPIXPASA-N 1 1 346.452 3.613 20 5 EHBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511562608 1038731336 /nfs/dbraw/zinc/73/13/36/1038731336.db2.gz WUQAULMKRJOFIL-IRXDYDNUSA-N 1 1 336.432 3.507 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2c(C)noc2CC)cc1[N+](=O)[O-] ZINC000927139591 1039344280 /nfs/dbraw/zinc/34/42/80/1039344280.db2.gz LUTXMRPAUCNQRC-LLVKDONJSA-N 1 1 333.388 3.703 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053233620 1039533360 /nfs/dbraw/zinc/53/33/60/1039533360.db2.gz OLJCJUUBXUPHNI-LLVKDONJSA-N 1 1 347.802 3.540 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053233620 1039533365 /nfs/dbraw/zinc/53/33/65/1039533365.db2.gz OLJCJUUBXUPHNI-LLVKDONJSA-N 1 1 347.802 3.540 20 5 EHBDMO Cc1ccc(C[N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000007902851 1039732285 /nfs/dbraw/zinc/73/22/85/1039732285.db2.gz DOFZWEABJLKYFN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000007902851 1039732302 /nfs/dbraw/zinc/73/23/02/1039732302.db2.gz DOFZWEABJLKYFN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC(C)(C)C[NH+]1CCCC1 ZINC000480927669 1040178323 /nfs/dbraw/zinc/17/83/23/1040178323.db2.gz BPOIRSWGCLYQLC-WJDWOHSUSA-N 1 1 331.460 3.710 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075414 1040433767 /nfs/dbraw/zinc/43/37/67/1040433767.db2.gz PLUASMGBLMDSKW-YCPHGPKFSA-N 1 1 331.416 3.576 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(C1CC1)C1CC1 ZINC000512709740 1040589629 /nfs/dbraw/zinc/58/96/29/1040589629.db2.gz FJWXXAXLHLXYSL-UHFFFAOYSA-N 1 1 326.343 3.817 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000027554457 1040662668 /nfs/dbraw/zinc/66/26/68/1040662668.db2.gz BOFJLHKQHYKCDA-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)c1cccs1 ZINC000027554457 1040662680 /nfs/dbraw/zinc/66/26/80/1040662680.db2.gz BOFJLHKQHYKCDA-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1cccnc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000110596440 1041206228 /nfs/dbraw/zinc/20/62/28/1041206228.db2.gz CXOLOGVNABDPAQ-ALOPSCKCSA-N 1 1 338.411 3.597 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000111312522 1042260605 /nfs/dbraw/zinc/26/06/05/1042260605.db2.gz VHDOHOVGWMFTLJ-HNNXBMFYSA-N 1 1 347.440 3.878 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000111312522 1042260610 /nfs/dbraw/zinc/26/06/10/1042260610.db2.gz VHDOHOVGWMFTLJ-HNNXBMFYSA-N 1 1 347.440 3.878 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000066900060 1042277077 /nfs/dbraw/zinc/27/70/77/1042277077.db2.gz GLNBCPKYKZQMSI-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000066900060 1042277081 /nfs/dbraw/zinc/27/70/81/1042277081.db2.gz GLNBCPKYKZQMSI-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO CC1(C)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000279803978 1044676541 /nfs/dbraw/zinc/67/65/41/1044676541.db2.gz WZMZLFBIDPDVCO-UHFFFAOYSA-N 1 1 347.440 3.967 20 5 EHBDMO C[N@@H+](CCc1ccncc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183754795 1125773629 /nfs/dbraw/zinc/77/36/29/1125773629.db2.gz ZFBVXHGAQAQHLG-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[C@@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)S1 ZINC000072771186 1126877787 /nfs/dbraw/zinc/87/77/87/1126877787.db2.gz DGRNNWVMYOGKEA-BETUJISGSA-N 1 1 347.440 3.618 20 5 EHBDMO Cc1nn(C[N@@H+](C)CCCc2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764888595 1127545930 /nfs/dbraw/zinc/54/59/30/1127545930.db2.gz HFIMVEWUAQMVHU-UHFFFAOYSA-N 1 1 338.411 3.775 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000301428412 1127764846 /nfs/dbraw/zinc/76/48/46/1127764846.db2.gz HTUCVKUPYFYMKO-MRXNPFEDSA-N 1 1 343.402 3.692 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCc3sccc3C2)c1 ZINC000338644308 1127968744 /nfs/dbraw/zinc/96/87/44/1127968744.db2.gz FOAQLISWYSQFHP-GFCCVEGCSA-N 1 1 347.440 3.524 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443287 1128077058 /nfs/dbraw/zinc/07/70/58/1128077058.db2.gz VAJAUWOWVMEJHE-DOMZBBRYSA-N 1 1 332.429 3.546 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000765768410 1128148272 /nfs/dbraw/zinc/14/82/72/1128148272.db2.gz ONTGKXUJTMZPND-GFCCVEGCSA-N 1 1 345.355 3.671 20 5 EHBDMO Cc1ccnc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000301562898 1128494593 /nfs/dbraw/zinc/49/45/93/1128494593.db2.gz IWOZSXXQNCVHOU-NVXWUHKLSA-N 1 1 340.427 3.621 20 5 EHBDMO COc1cccc(CCC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554846809 1128717103 /nfs/dbraw/zinc/71/71/03/1128717103.db2.gz IZYFINAOFBNTQQ-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC001648832761 1120050396 /nfs/dbraw/zinc/05/03/96/1120050396.db2.gz LDLRYGLFWQZQHJ-XHDPSFHLSA-N 1 1 333.413 3.754 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c(F)c1 ZINC000347439987 1120617915 /nfs/dbraw/zinc/61/79/15/1120617915.db2.gz WPFZVVNTBMNBCO-INIZCTEOSA-N 1 1 338.766 3.601 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000252212276 1120819411 /nfs/dbraw/zinc/81/94/11/1120819411.db2.gz WRRBBFCFKMLGID-WMZOPIPTSA-N 1 1 331.460 3.681 20 5 EHBDMO CC(C)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCC1 ZINC000193207787 1120983337 /nfs/dbraw/zinc/98/33/37/1120983337.db2.gz AUWFFLQFAUWMFL-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000762138263 1121125939 /nfs/dbraw/zinc/12/59/39/1121125939.db2.gz LECXIYFIUCFQEN-AWEZNQCLSA-N 1 1 326.400 3.680 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000487952026 1121342884 /nfs/dbraw/zinc/34/28/84/1121342884.db2.gz CMVAFCQBSDASQH-UHFFFAOYSA-N 1 1 346.358 3.541 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000487952026 1121342889 /nfs/dbraw/zinc/34/28/89/1121342889.db2.gz CMVAFCQBSDASQH-UHFFFAOYSA-N 1 1 346.358 3.541 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC000762632412 1121389083 /nfs/dbraw/zinc/38/90/83/1121389083.db2.gz ISOBYQUINFZCMX-OALUTQOASA-N 1 1 326.396 3.855 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000542977376 1128982486 /nfs/dbraw/zinc/98/24/86/1128982486.db2.gz FSJCNUHSBLNQES-JCKWVBRZSA-N 1 1 345.443 3.742 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087090 1122490975 /nfs/dbraw/zinc/49/09/75/1122490975.db2.gz QDNOISIUONMIMZ-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000918738972 1122902106 /nfs/dbraw/zinc/90/21/06/1122902106.db2.gz RETHBZMBWIQSAI-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO Cc1c(C[NH+]2CCN(c3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000921061561 1123460411 /nfs/dbraw/zinc/46/04/11/1123460411.db2.gz YZZBYDBYDGHCFU-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000922541643 1129568824 /nfs/dbraw/zinc/56/88/24/1129568824.db2.gz RJCOMIOWYZCMIF-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccn(Cc2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000389949199 1129597726 /nfs/dbraw/zinc/59/77/26/1129597726.db2.gz WCBJVJQWFUAGMS-OAHLLOKOSA-N 1 1 336.395 3.690 20 5 EHBDMO C[N@@H+](CCn1cccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000125279316 1129676239 /nfs/dbraw/zinc/67/62/39/1129676239.db2.gz VLRWAAOWJNATJB-UHFFFAOYSA-N 1 1 342.424 3.652 20 5 EHBDMO CC(C)([NH2+]CC(=O)NCCC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000429237775 1130172443 /nfs/dbraw/zinc/17/24/43/1130172443.db2.gz OXXYNQRSNUAEEN-UHFFFAOYSA-N 1 1 347.459 3.506 20 5 EHBDMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245448544 1130209225 /nfs/dbraw/zinc/20/92/25/1130209225.db2.gz MXTWDYUMFMDDLD-GOEBONIOSA-N 1 1 326.400 3.546 20 5 EHBDMO COc1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000175131958 1130408805 /nfs/dbraw/zinc/40/88/05/1130408805.db2.gz ZBUGETZZPRJXGP-MRXNPFEDSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000175131958 1130408808 /nfs/dbraw/zinc/40/88/08/1130408808.db2.gz ZBUGETZZPRJXGP-MRXNPFEDSA-N 1 1 329.400 3.669 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892969 1130857547 /nfs/dbraw/zinc/85/75/47/1130857547.db2.gz LTSYSDOPIUKWIP-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000731892969 1130857558 /nfs/dbraw/zinc/85/75/58/1130857558.db2.gz LTSYSDOPIUKWIP-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO CC[NH+](CC)[C@@H](C(=O)OCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000731907807 1130860508 /nfs/dbraw/zinc/86/05/08/1130860508.db2.gz KSHWATCSZIEYGD-GOSISDBHSA-N 1 1 342.395 3.721 20 5 EHBDMO CO[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(F)(F)F ZINC000733329378 1131027854 /nfs/dbraw/zinc/02/78/54/1131027854.db2.gz RVESSWHJRDDJJZ-AWEZNQCLSA-N 1 1 344.289 3.522 20 5 EHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057474 1131461766 /nfs/dbraw/zinc/46/17/66/1131461766.db2.gz RJVNCKDXBOWOOH-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253924 1131464631 /nfs/dbraw/zinc/46/46/31/1131464631.db2.gz JGKOCTGGKYHMCV-HNNXBMFYSA-N 1 1 328.416 3.928 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000742430920 1131729983 /nfs/dbraw/zinc/72/99/83/1131729983.db2.gz YQXGLFNVXOLSFG-MRXNPFEDSA-N 1 1 343.402 3.692 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCOc3ccccc3C1)CC2 ZINC001172916409 1131903871 /nfs/dbraw/zinc/90/38/71/1131903871.db2.gz RMOBNOSBEUGUGA-GOSISDBHSA-N 1 1 338.407 3.737 20 5 EHBDMO CC[N@@H+](Cc1cccnc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916379 1131904119 /nfs/dbraw/zinc/90/41/19/1131904119.db2.gz RJHXDCXLJCEUAU-SFHVURJKSA-N 1 1 325.412 3.759 20 5 EHBDMO CC[C@H](C)[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011934 1131935788 /nfs/dbraw/zinc/93/57/88/1131935788.db2.gz AYZLGINLTQGOJA-NSHDSACASA-N 1 1 327.375 3.572 20 5 EHBDMO C[N@@H+](C1CCCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018352 1131936410 /nfs/dbraw/zinc/93/64/10/1131936410.db2.gz RUKJQQVJYWBAIO-UHFFFAOYSA-N 1 1 339.386 3.716 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001173181981 1131994055 /nfs/dbraw/zinc/99/40/55/1131994055.db2.gz RCLLQPDCPFFCGW-WDEREUQCSA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001173181981 1131994066 /nfs/dbraw/zinc/99/40/66/1131994066.db2.gz RCLLQPDCPFFCGW-WDEREUQCSA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC001173223477 1132004962 /nfs/dbraw/zinc/00/49/62/1132004962.db2.gz ANFJYUGABFRLNS-JXFKEZNVSA-N 1 1 339.439 3.515 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173233666 1132010581 /nfs/dbraw/zinc/01/05/81/1132010581.db2.gz XWPUUVUEXUNBAF-HNNXBMFYSA-N 1 1 340.423 3.983 20 5 EHBDMO COc1cccc(CC[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173235296 1132010872 /nfs/dbraw/zinc/01/08/72/1132010872.db2.gz VXMYHTXKUWQYSS-OAHLLOKOSA-N 1 1 328.412 3.709 20 5 EHBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccnc(C)c1 ZINC001174656688 1132440319 /nfs/dbraw/zinc/44/03/19/1132440319.db2.gz PMMGUVVTUSSFJP-UHFFFAOYSA-N 1 1 344.418 3.947 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052531 1132549985 /nfs/dbraw/zinc/54/99/85/1132549985.db2.gz HAWVDZIQYFGLBP-BAABZTOOSA-N 1 1 349.406 3.741 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@H](C)C1CCCCC1 ZINC001175229303 1132601329 /nfs/dbraw/zinc/60/13/29/1132601329.db2.gz NXYRXZVCJYAISE-OAHLLOKOSA-N 1 1 347.459 3.990 20 5 EHBDMO C[N@@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057914 1132646145 /nfs/dbraw/zinc/64/61/45/1132646145.db2.gz YXKXZQDVZAAALQ-ZFWWWQNUSA-N 1 1 330.350 3.625 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2cccc(F)c2)CC1 ZINC001175453411 1132686474 /nfs/dbraw/zinc/68/64/74/1132686474.db2.gz KRPVSDRPUMZTGJ-OAHLLOKOSA-N 1 1 343.402 3.926 20 5 EHBDMO C[N@@H+](CCc1ccc2c(c1)OCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001176184241 1132859005 /nfs/dbraw/zinc/85/90/05/1132859005.db2.gz HIRORSRPHMCHFQ-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@@H+]1CCCC[C@H]1C ZINC000804352039 1132979178 /nfs/dbraw/zinc/97/91/78/1132979178.db2.gz NEQQGUYATWCMCX-CQSZACIVSA-N 1 1 333.432 3.864 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000767430100 1133000340 /nfs/dbraw/zinc/00/03/40/1133000340.db2.gz KAJITJZZZUHUMV-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000767430100 1133000347 /nfs/dbraw/zinc/00/03/47/1133000347.db2.gz KAJITJZZZUHUMV-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766838 1133050045 /nfs/dbraw/zinc/05/00/45/1133050045.db2.gz XXEMFNDEPUFUHT-PBHICJAKSA-N 1 1 343.431 3.711 20 5 EHBDMO CCOC(=O)CC(C)(C)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181878411 1133545572 /nfs/dbraw/zinc/54/55/72/1133545572.db2.gz ACGUVXYIXMWTOM-MRXNPFEDSA-N 1 1 348.443 3.754 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1c(F)cc([N+](=O)[O-])cc1F ZINC001184874473 1134001308 /nfs/dbraw/zinc/00/13/08/1134001308.db2.gz OKRJSKAXXDPFCF-GFCCVEGCSA-N 1 1 327.375 3.940 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746707730 1134038315 /nfs/dbraw/zinc/03/83/15/1134038315.db2.gz NMUMDBXPINZIEH-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCC12CCOCC2 ZINC001170195304 1134711370 /nfs/dbraw/zinc/71/13/70/1134711370.db2.gz TXBBJNSUTTUKOQ-QGZVFWFLSA-N 1 1 332.444 3.666 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334092 1134751368 /nfs/dbraw/zinc/75/13/68/1134751368.db2.gz BDHZDVCKBOOIAA-LNSITVRQSA-N 1 1 340.370 3.512 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335138 1134752370 /nfs/dbraw/zinc/75/23/70/1134752370.db2.gz LQJLLCNQEZMEKT-NHYWBVRUSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC(F)(F)[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335138 1134752374 /nfs/dbraw/zinc/75/23/74/1134752374.db2.gz LQJLLCNQEZMEKT-NHYWBVRUSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2Cc3ccccc3C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170353119 1134753718 /nfs/dbraw/zinc/75/37/18/1134753718.db2.gz WGZOCBFUQGLFNY-CABCVRRESA-N 1 1 340.423 3.981 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCCc3ccccc3CC2)c(F)c1 ZINC001170341783 1134758653 /nfs/dbraw/zinc/75/86/53/1134758653.db2.gz FTXADWOMMCWYJN-UHFFFAOYSA-N 1 1 332.350 3.864 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCCc3ccccc3CC2)c(F)c1 ZINC001170341783 1134758656 /nfs/dbraw/zinc/75/86/56/1134758656.db2.gz FTXADWOMMCWYJN-UHFFFAOYSA-N 1 1 332.350 3.864 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2CCC(C)C)c([N+](=O)[O-])c1 ZINC001192157618 1134972086 /nfs/dbraw/zinc/97/20/86/1134972086.db2.gz HSPPPPCLWWYKRV-HNNXBMFYSA-N 1 1 336.432 3.883 20 5 EHBDMO CC(C)C[C@]1(C)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194536345 1135283044 /nfs/dbraw/zinc/28/30/44/1135283044.db2.gz ZQNQFLSDLOFSEP-SFHVURJKSA-N 1 1 333.432 3.824 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000805801790 1135334399 /nfs/dbraw/zinc/33/43/99/1135334399.db2.gz NFZQFKOQSVRCQN-IPYPFGDCSA-N 1 1 349.431 3.643 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000805801790 1135334407 /nfs/dbraw/zinc/33/44/07/1135334407.db2.gz NFZQFKOQSVRCQN-IPYPFGDCSA-N 1 1 349.431 3.643 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@]3(CCSC3)C2)cc1 ZINC001195093188 1135368624 /nfs/dbraw/zinc/36/86/24/1135368624.db2.gz IABQWOUUZVTZJY-QGZVFWFLSA-N 1 1 336.457 3.583 20 5 EHBDMO CO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809975135 1135907475 /nfs/dbraw/zinc/90/74/75/1135907475.db2.gz YJIBDVAHBFIKPM-LBPRGKRZSA-N 1 1 333.215 3.903 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809975135 1135907477 /nfs/dbraw/zinc/90/74/77/1135907477.db2.gz YJIBDVAHBFIKPM-LBPRGKRZSA-N 1 1 333.215 3.903 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000810047241 1135915803 /nfs/dbraw/zinc/91/58/03/1135915803.db2.gz PZKAGIDGKUCBSI-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000810047241 1135915805 /nfs/dbraw/zinc/91/58/05/1135915805.db2.gz PZKAGIDGKUCBSI-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO CCCC[C@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000810125324 1135923994 /nfs/dbraw/zinc/92/39/94/1135923994.db2.gz UAZLBYOOLZEISB-LBPRGKRZSA-N 1 1 325.384 3.573 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473614 1136095696 /nfs/dbraw/zinc/09/56/96/1136095696.db2.gz FMLBPMLWTSDUBB-LLVKDONJSA-N 1 1 346.258 3.866 20 5 EHBDMO C[C@@H]1CCCCN1CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473614 1136095700 /nfs/dbraw/zinc/09/57/00/1136095700.db2.gz FMLBPMLWTSDUBB-LLVKDONJSA-N 1 1 346.258 3.866 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506560 1136101733 /nfs/dbraw/zinc/10/17/33/1136101733.db2.gz AEACYQKTXFQHAQ-LLVKDONJSA-N 1 1 346.258 3.722 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274957 1136128929 /nfs/dbraw/zinc/12/89/29/1136128929.db2.gz DYSRNZCYUMMEPZ-PXAZEXFGSA-N 1 1 334.803 3.975 20 5 EHBDMO NC(CCCc1ccccc1)=[NH+]OCc1ccc([N+](=O)[O-])cc1F ZINC000747832774 1136281434 /nfs/dbraw/zinc/28/14/34/1136281434.db2.gz WLCCBKKSMIJYKT-UHFFFAOYSA-N 1 1 331.347 3.755 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585086 1136442448 /nfs/dbraw/zinc/44/24/48/1136442448.db2.gz SOJQKJJBLLGUMZ-LJHODMEESA-N 1 1 326.396 3.506 20 5 EHBDMO CCC[N@H+](Cc1ccc(F)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579113 1136444315 /nfs/dbraw/zinc/44/43/15/1136444315.db2.gz JSVSBMABOUKHCD-GOSISDBHSA-N 1 1 332.375 3.680 20 5 EHBDMO CC(C)[N@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580029 1136444542 /nfs/dbraw/zinc/44/45/42/1136444542.db2.gz QPEQVZPXECSFCO-SFHVURJKSA-N 1 1 332.375 3.678 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000814909438 1136523645 /nfs/dbraw/zinc/52/36/45/1136523645.db2.gz LMNYJUWOWWITNQ-HNNXBMFYSA-N 1 1 343.349 3.536 20 5 EHBDMO Cc1cc(C(F)(F)F)cc(N2CCc3c(cccc3[N+](=O)[O-])C2)[nH+]1 ZINC000853459167 1136534588 /nfs/dbraw/zinc/53/45/88/1136534588.db2.gz FTUADWWKYKRKJA-UHFFFAOYSA-N 1 1 337.301 3.880 20 5 EHBDMO COc1ccc([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C2CC2)cn1 ZINC000858341963 1136959960 /nfs/dbraw/zinc/95/99/60/1136959960.db2.gz IHFUOUULVWQTMZ-QGZVFWFLSA-N 1 1 347.802 3.893 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cc(F)ncc3F)C2)cc1 ZINC000824821288 1137153847 /nfs/dbraw/zinc/15/38/47/1137153847.db2.gz XQMDNTWMBLPEIP-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc(F)ncc3F)C2)cc1 ZINC000824821288 1137153848 /nfs/dbraw/zinc/15/38/48/1137153848.db2.gz XQMDNTWMBLPEIP-CYBMUJFWSA-N 1 1 333.338 3.648 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(OC)c1OC ZINC000865757923 1137309037 /nfs/dbraw/zinc/30/90/37/1137309037.db2.gz RSOIJAOVLCTUPN-MRXNPFEDSA-N 1 1 348.374 3.992 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023193 1137565392 /nfs/dbraw/zinc/56/53/92/1137565392.db2.gz CZRCRVJCVPEKQF-KBPBESRZSA-N 1 1 337.489 3.699 20 5 EHBDMO COc1ccc([C@@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C2CC2)cn1 ZINC000872090963 1137570749 /nfs/dbraw/zinc/57/07/49/1137570749.db2.gz GHBAGEIXHQUDTQ-ZMZPIMSZSA-N 1 1 345.374 3.939 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccnc2C)cc1[N+](=O)[O-] ZINC000872132424 1137573260 /nfs/dbraw/zinc/57/32/60/1137573260.db2.gz FUVGTGFHTSFFNE-YPMHNXCESA-N 1 1 330.388 3.504 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000876773506 1137660997 /nfs/dbraw/zinc/66/09/97/1137660997.db2.gz SRCCJVHHWRZPBU-XMMPIXPASA-N 1 1 346.452 3.581 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000876773506 1137660998 /nfs/dbraw/zinc/66/09/98/1137660998.db2.gz SRCCJVHHWRZPBU-XMMPIXPASA-N 1 1 346.452 3.581 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccc[nH]1 ZINC000877123965 1137670769 /nfs/dbraw/zinc/67/07/69/1137670769.db2.gz HGQZIHDRUIELKR-SSDOTTSWSA-N 1 1 330.207 3.598 20 5 EHBDMO CC(C)c1cc([C@H]2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000877783877 1137689485 /nfs/dbraw/zinc/68/94/85/1137689485.db2.gz JIAWHZLGUSCPCL-AWEZNQCLSA-N 1 1 328.416 3.821 20 5 EHBDMO CC(C)c1cc([C@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000877783877 1137689486 /nfs/dbraw/zinc/68/94/86/1137689486.db2.gz JIAWHZLGUSCPCL-AWEZNQCLSA-N 1 1 328.416 3.821 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878188203 1137706286 /nfs/dbraw/zinc/70/62/86/1137706286.db2.gz MBQNFXHBVWSJNH-AOOOYVTPSA-N 1 1 336.779 3.671 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879751667 1137758120 /nfs/dbraw/zinc/75/81/20/1137758120.db2.gz LMDLFBUUENHLHS-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cncc(C)c1 ZINC000879751667 1137758121 /nfs/dbraw/zinc/75/81/21/1137758121.db2.gz LMDLFBUUENHLHS-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO Cc1nccnc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000880108936 1137768399 /nfs/dbraw/zinc/76/83/99/1137768399.db2.gz MKUIVGZRVMWYHV-JTQLQIEISA-N 1 1 340.305 3.563 20 5 EHBDMO Cc1cnc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)s1 ZINC000332476212 1137945085 /nfs/dbraw/zinc/94/50/85/1137945085.db2.gz WTDGOMFGJADOFX-CQSZACIVSA-N 1 1 346.456 3.551 20 5 EHBDMO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885969567 1138029105 /nfs/dbraw/zinc/02/91/05/1138029105.db2.gz WONOVFTWGRAQFV-KRWDZBQOSA-N 1 1 327.384 3.508 20 5 EHBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000885969567 1138029107 /nfs/dbraw/zinc/02/91/07/1138029107.db2.gz WONOVFTWGRAQFV-KRWDZBQOSA-N 1 1 327.384 3.508 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000886112261 1138047980 /nfs/dbraw/zinc/04/79/80/1138047980.db2.gz SXMSQAAYYSOBKM-UHFFFAOYSA-N 1 1 333.338 3.827 20 5 EHBDMO COc1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000886350355 1138070204 /nfs/dbraw/zinc/07/02/04/1138070204.db2.gz RQEPKJSTVKOGGY-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO COc1cc(F)c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000089512016 1138200756 /nfs/dbraw/zinc/20/07/56/1138200756.db2.gz SKAYMQHBGFZHTI-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907111 1138207391 /nfs/dbraw/zinc/20/73/91/1138207391.db2.gz SNDGWYGRTXGGRT-OAHLLOKOSA-N 1 1 333.413 3.577 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907111 1138207393 /nfs/dbraw/zinc/20/73/93/1138207393.db2.gz SNDGWYGRTXGGRT-OAHLLOKOSA-N 1 1 333.413 3.577 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240906 /nfs/dbraw/zinc/24/09/06/1138240906.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC000263865784 1138382833 /nfs/dbraw/zinc/38/28/33/1138382833.db2.gz BMDRJFOWRICSKV-CYBMUJFWSA-N 1 1 334.416 3.710 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000131347972 1138511946 /nfs/dbraw/zinc/51/19/46/1138511946.db2.gz VLKHPJUEGYATHL-OAHLLOKOSA-N 1 1 346.383 3.550 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338011829 1138723293 /nfs/dbraw/zinc/72/32/93/1138723293.db2.gz QEOCSBDLMILIHX-RYUDHWBXSA-N 1 1 333.363 3.939 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000184009912 1140074105 /nfs/dbraw/zinc/07/41/05/1140074105.db2.gz YDISQABVBKCBEH-SNVBAGLBSA-N 1 1 325.821 3.940 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC)cc1[N+](=O)[O-] ZINC000187592006 1140263578 /nfs/dbraw/zinc/26/35/78/1140263578.db2.gz IEJUONDEXVDMDR-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO O=C(c1ccc(F)cc1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000192461899 1140533880 /nfs/dbraw/zinc/53/38/80/1140533880.db2.gz LJRNVCSDHAXYSD-UHFFFAOYSA-N 1 1 342.370 3.829 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283252594 1141579489 /nfs/dbraw/zinc/57/94/89/1141579489.db2.gz VLRSSXUGHHHZDH-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836522 1141592743 /nfs/dbraw/zinc/59/27/43/1141592743.db2.gz CTTFELHQISFOJS-MRXNPFEDSA-N 1 1 347.459 3.599 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000430195853 1014832608 /nfs/dbraw/zinc/83/26/08/1014832608.db2.gz OYRRWAZXCKIPBD-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCCC2)OC(C)(C)C1 ZINC000430195853 1014832621 /nfs/dbraw/zinc/83/26/21/1014832621.db2.gz OYRRWAZXCKIPBD-UHFFFAOYSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000430239314 1015182885 /nfs/dbraw/zinc/18/28/85/1015182885.db2.gz SFCWJUZKPXPLKM-UHFFFAOYSA-N 1 1 325.368 3.717 20 5 EHBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384731 1016122004 /nfs/dbraw/zinc/12/20/04/1016122004.db2.gz KDLXXJFYCIOTSV-LFPIHBKWSA-N 1 1 346.452 3.568 20 5 EHBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383579 1016126211 /nfs/dbraw/zinc/12/62/11/1016126211.db2.gz BCMNRSQRDHZAMW-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383579 1016126223 /nfs/dbraw/zinc/12/62/23/1016126223.db2.gz BCMNRSQRDHZAMW-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1 ZINC000340183204 1016631967 /nfs/dbraw/zinc/63/19/67/1016631967.db2.gz WTOHUPXCXNZPHT-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)c1 ZINC000340183204 1016631976 /nfs/dbraw/zinc/63/19/76/1016631976.db2.gz WTOHUPXCXNZPHT-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO C[NH+](C)[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000237030546 1016802368 /nfs/dbraw/zinc/80/23/68/1016802368.db2.gz IVDSPPCALIDVAQ-QGZVFWFLSA-N 1 1 345.468 3.753 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368979 1032251811 /nfs/dbraw/zinc/25/18/11/1032251811.db2.gz PVQVZKDNOAOGGV-KSSFIOAISA-N 1 1 345.418 3.996 20 5 EHBDMO COc1c(O)cccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449500151 1032678243 /nfs/dbraw/zinc/67/82/43/1032678243.db2.gz NKLYPTNCHVCFLC-OAHLLOKOSA-N 1 1 342.395 3.689 20 5 EHBDMO COc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(OC)c1 ZINC000123331185 1017827021 /nfs/dbraw/zinc/82/70/21/1017827021.db2.gz DUBAHIPZNZEDFU-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(OC)c1 ZINC000123331185 1017827036 /nfs/dbraw/zinc/82/70/36/1017827036.db2.gz DUBAHIPZNZEDFU-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3[nH]cnc3C2)c2ccccc2)c1 ZINC000377799749 1018394646 /nfs/dbraw/zinc/39/46/46/1018394646.db2.gz YWSRMZCRZGKJLG-UZLBHIALSA-N 1 1 348.406 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC4(CC4(F)F)CC3)co2)cc1 ZINC000593073666 1032768789 /nfs/dbraw/zinc/76/87/89/1032768789.db2.gz WCKAGZPVGKOCDX-UHFFFAOYSA-N 1 1 349.337 3.871 20 5 EHBDMO Cc1ccc(C[NH2+][C@H](CO)c2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000466385316 1018774305 /nfs/dbraw/zinc/77/43/05/1018774305.db2.gz CUOUWYWXSJMQFZ-CQSZACIVSA-N 1 1 338.766 3.519 20 5 EHBDMO CCOc1ccccc1C[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000052164286 1018851008 /nfs/dbraw/zinc/85/10/08/1018851008.db2.gz UKPPSOYQJZLJQP-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000052164286 1018851034 /nfs/dbraw/zinc/85/10/34/1018851034.db2.gz UKPPSOYQJZLJQP-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO C[C@H](N[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997947 1018935479 /nfs/dbraw/zinc/93/54/79/1018935479.db2.gz CRGBNLRVOJOOIM-TXPKVOOTSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997947 1018935485 /nfs/dbraw/zinc/93/54/85/1018935485.db2.gz CRGBNLRVOJOOIM-TXPKVOOTSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](C[C@H](C)[NH3+])NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439054 1032844547 /nfs/dbraw/zinc/84/45/47/1032844547.db2.gz YTLRXHSYSYLSJH-WDEREUQCSA-N 1 1 337.807 3.724 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001167425278 1019764946 /nfs/dbraw/zinc/76/49/46/1019764946.db2.gz PUHZMGHCBDEDTJ-CVEARBPZSA-N 1 1 347.459 3.988 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1cccc([N+](=O)[O-])c1 ZINC000610451269 1019770854 /nfs/dbraw/zinc/77/08/54/1019770854.db2.gz KOVXXJPJVVQJAI-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000513683217 1019934290 /nfs/dbraw/zinc/93/42/90/1019934290.db2.gz HYKXOMSXDOJFDK-GOSISDBHSA-N 1 1 342.443 3.978 20 5 EHBDMO COc1cc2c(cc1OC)[C@@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC000602438213 1032890531 /nfs/dbraw/zinc/89/05/31/1032890531.db2.gz CDWBHRQKKYCWQB-KRWDZBQOSA-N 1 1 342.395 3.731 20 5 EHBDMO CSc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000023815960 1020314756 /nfs/dbraw/zinc/31/47/56/1020314756.db2.gz MFSDNIIBSVEQCC-UHFFFAOYSA-N 1 1 343.452 3.639 20 5 EHBDMO CC(C)Cn1nccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000592497990 1032931268 /nfs/dbraw/zinc/93/12/68/1032931268.db2.gz RIICWJCEAHEILA-UHFFFAOYSA-N 1 1 330.432 3.858 20 5 EHBDMO CC(C)Cn1nccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000592497990 1032931282 /nfs/dbraw/zinc/93/12/82/1032931282.db2.gz RIICWJCEAHEILA-UHFFFAOYSA-N 1 1 330.432 3.858 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261148 1021284885 /nfs/dbraw/zinc/28/48/85/1021284885.db2.gz QKVDIVRMHFPURT-IBGZPJMESA-N 1 1 328.412 3.758 20 5 EHBDMO C[C@@H](CC[NH3+])NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414897592 1021516405 /nfs/dbraw/zinc/51/64/05/1021516405.db2.gz RWGCAALBHGRHMM-LBPRGKRZSA-N 1 1 349.818 3.867 20 5 EHBDMO Cn1cc(C[N@@H+](C)C[C@@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519670682 1021611461 /nfs/dbraw/zinc/61/14/61/1021611461.db2.gz LOQQJBXNYAZFBP-OAHLLOKOSA-N 1 1 340.427 3.783 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601391 1032995148 /nfs/dbraw/zinc/99/51/48/1032995148.db2.gz KSACGIJXUOUYTI-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270531656 1021714222 /nfs/dbraw/zinc/71/42/22/1021714222.db2.gz PSCSJFJANRTCLA-SFTDATJTSA-N 1 1 330.431 3.912 20 5 EHBDMO CC(C)(C)C1CC[NH+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000172904151 1033008973 /nfs/dbraw/zinc/00/89/73/1033008973.db2.gz JKPFSLCGLCIRRN-UHFFFAOYSA-N 1 1 343.431 3.569 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2sccc2Br)c1 ZINC000052926274 1022015838 /nfs/dbraw/zinc/01/58/38/1022015838.db2.gz DRLKIGMHTQDGAB-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](CCCc2ccccc2)C1 ZINC000441181639 1022040513 /nfs/dbraw/zinc/04/05/13/1022040513.db2.gz SQEWJVZXVMZLKH-KRWDZBQOSA-N 1 1 342.443 3.563 20 5 EHBDMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968576 1022520792 /nfs/dbraw/zinc/52/07/92/1022520792.db2.gz SNCIJFJQJCVWMF-QWHCGFSZSA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](CC4CC4)C3)co2)cc1 ZINC000550405561 1022813550 /nfs/dbraw/zinc/81/35/50/1022813550.db2.gz UDYKVXZHCNIJSD-CQSZACIVSA-N 1 1 327.384 3.872 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000008320671 1022947436 /nfs/dbraw/zinc/94/74/36/1022947436.db2.gz UEQFAQQQCORARX-OAHLLOKOSA-N 1 1 345.424 3.740 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000008320671 1022947445 /nfs/dbraw/zinc/94/74/45/1022947445.db2.gz UEQFAQQQCORARX-OAHLLOKOSA-N 1 1 345.424 3.740 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000509573908 1023071826 /nfs/dbraw/zinc/07/18/26/1023071826.db2.gz WBFUMSOYDPMNPZ-HNNXBMFYSA-N 1 1 349.475 3.594 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)N1CCC[C@H](C)C1 ZINC000509573908 1023071836 /nfs/dbraw/zinc/07/18/36/1023071836.db2.gz WBFUMSOYDPMNPZ-HNNXBMFYSA-N 1 1 349.475 3.594 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000426201168 1023084808 /nfs/dbraw/zinc/08/48/08/1023084808.db2.gz MQVKFLVAAKLZJU-UHFFFAOYSA-N 1 1 326.824 3.765 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCCO1 ZINC000506438193 1023140189 /nfs/dbraw/zinc/14/01/89/1023140189.db2.gz HAWNXVDHYGHUJC-OAHLLOKOSA-N 1 1 332.425 3.934 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2c(C)n[nH]c2C)ccc1[N+](=O)[O-] ZINC000276960195 1023478304 /nfs/dbraw/zinc/47/83/04/1023478304.db2.gz VIOOYRKPWKFGGN-INIZCTEOSA-N 1 1 344.415 3.671 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000602768222 1033164644 /nfs/dbraw/zinc/16/46/44/1033164644.db2.gz YCFYFOJAHQNBSX-HNNXBMFYSA-N 1 1 334.807 3.590 20 5 EHBDMO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602804535 1033177297 /nfs/dbraw/zinc/17/72/97/1033177297.db2.gz JGNYGJVHXWESPF-INIZCTEOSA-N 1 1 346.431 3.604 20 5 EHBDMO C[N@@H+](CCCCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435051760 1024581622 /nfs/dbraw/zinc/58/16/22/1024581622.db2.gz YGWNPTLZLXLXBI-UHFFFAOYSA-N 1 1 334.441 3.918 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895581233 1024638290 /nfs/dbraw/zinc/63/82/90/1024638290.db2.gz MNEWZKZQSMPCEW-CTXBLAANSA-N 1 1 329.425 3.944 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cncs1 ZINC000897931392 1033230138 /nfs/dbraw/zinc/23/01/38/1033230138.db2.gz YMTMTVQRQAXNPL-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000514892759 1024839154 /nfs/dbraw/zinc/83/91/54/1024839154.db2.gz BAPUVPWRCTZNCY-KBPBESRZSA-N 1 1 348.447 3.542 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2cc(F)c(OC)cc21 ZINC000281327109 1024903151 /nfs/dbraw/zinc/90/31/51/1024903151.db2.gz SYLFBYYDJQKANO-MRXNPFEDSA-N 1 1 346.358 3.528 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001168403614 1033248324 /nfs/dbraw/zinc/24/83/24/1033248324.db2.gz OKKXDRKYBTXSNA-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO COC1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000265216815 1025133569 /nfs/dbraw/zinc/13/35/69/1025133569.db2.gz NLKVEYJLYLOVEX-UHFFFAOYSA-N 1 1 336.432 3.771 20 5 EHBDMO COc1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000551407118 1025290704 /nfs/dbraw/zinc/29/07/04/1025290704.db2.gz UHTFGXVSDQBBKP-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@H]1CSCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425446071 1025306418 /nfs/dbraw/zinc/30/64/18/1025306418.db2.gz OPXURFOVKCNGQR-SNVBAGLBSA-N 1 1 345.262 3.542 20 5 EHBDMO C[C@H]1CSCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425446071 1025306428 /nfs/dbraw/zinc/30/64/28/1025306428.db2.gz OPXURFOVKCNGQR-SNVBAGLBSA-N 1 1 345.262 3.542 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467874 1025467169 /nfs/dbraw/zinc/46/71/69/1025467169.db2.gz OHVOOXVKXRUJFQ-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO O=C(C[N@@H+]1CCCC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000515722116 1025519243 /nfs/dbraw/zinc/51/92/43/1025519243.db2.gz JWHCCEOFARVXPR-QGZVFWFLSA-N 1 1 339.395 3.761 20 5 EHBDMO O=C(C[N@H+]1CCCC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000515722116 1025519256 /nfs/dbraw/zinc/51/92/56/1025519256.db2.gz JWHCCEOFARVXPR-QGZVFWFLSA-N 1 1 339.395 3.761 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)o1 ZINC000934338649 1025527388 /nfs/dbraw/zinc/52/73/88/1025527388.db2.gz DRCQEDKJOUAMPP-GWCFXTLKSA-N 1 1 348.790 3.673 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000185678364 1025587323 /nfs/dbraw/zinc/58/73/23/1025587323.db2.gz XRULGWYPFCLTJP-QGZVFWFLSA-N 1 1 330.384 3.980 20 5 EHBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2s1 ZINC000051590154 1025820816 /nfs/dbraw/zinc/82/08/16/1025820816.db2.gz RDQJUCOROVJNEP-UHFFFAOYSA-N 1 1 343.408 3.715 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2s1 ZINC000051590154 1025820836 /nfs/dbraw/zinc/82/08/36/1025820836.db2.gz RDQJUCOROVJNEP-UHFFFAOYSA-N 1 1 343.408 3.715 20 5 EHBDMO Cc1cccc([C@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)c1C ZINC000472220185 1025915364 /nfs/dbraw/zinc/91/53/64/1025915364.db2.gz BNULGDLOLJITSW-GOSISDBHSA-N 1 1 328.416 3.635 20 5 EHBDMO Cc1nnc([C@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542843 1026086743 /nfs/dbraw/zinc/08/67/43/1026086743.db2.gz AJYGJHLIPRTLGI-FZMZJTMJSA-N 1 1 332.429 3.695 20 5 EHBDMO Cc1nnc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542843 1026086760 /nfs/dbraw/zinc/08/67/60/1026086760.db2.gz AJYGJHLIPRTLGI-FZMZJTMJSA-N 1 1 332.429 3.695 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000103465715 1026090223 /nfs/dbraw/zinc/09/02/23/1026090223.db2.gz LPTDOZIXDUTCIE-UHFFFAOYSA-N 1 1 330.359 3.819 20 5 EHBDMO CCc1nc(C)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543465 1026090702 /nfs/dbraw/zinc/09/07/02/1026090702.db2.gz BWBWRMHGOSQJMI-OAHLLOKOSA-N 1 1 329.400 3.833 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C2CC2)cc1 ZINC000478430602 1026116104 /nfs/dbraw/zinc/11/61/04/1026116104.db2.gz GZBHKSIWFOPJCM-UHFFFAOYSA-N 1 1 328.416 3.579 20 5 EHBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C2 ZINC000530631213 1026135827 /nfs/dbraw/zinc/13/58/27/1026135827.db2.gz LEFARBJRXGZLJU-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C2 ZINC000530631213 1026135836 /nfs/dbraw/zinc/13/58/36/1026135836.db2.gz LEFARBJRXGZLJU-UHFFFAOYSA-N 1 1 330.359 3.691 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCCC[C@@H]1C ZINC000530855958 1026355520 /nfs/dbraw/zinc/35/55/20/1026355520.db2.gz XNTOVWNKPHESMM-KBPBESRZSA-N 1 1 328.416 3.818 20 5 EHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccccc3[N+](=O)[O-])c2C1 ZINC000158357162 1026359381 /nfs/dbraw/zinc/35/93/81/1026359381.db2.gz XVCSHNIMVVXLHS-UHFFFAOYSA-N 1 1 339.395 3.819 20 5 EHBDMO Cn1nccc1C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000475331258 1026482509 /nfs/dbraw/zinc/48/25/09/1026482509.db2.gz CBGZRUINNQBSIY-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1nccc1C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000475331258 1026482513 /nfs/dbraw/zinc/48/25/13/1026482513.db2.gz CBGZRUINNQBSIY-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO COc1cccc(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354947 1026510085 /nfs/dbraw/zinc/51/00/85/1026510085.db2.gz SYEYGSMTLNSUBY-ZBFHGGJFSA-N 1 1 341.411 3.851 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000129709541 1027595607 /nfs/dbraw/zinc/59/56/07/1027595607.db2.gz XAIZTKFCACXELK-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000129709541 1027595611 /nfs/dbraw/zinc/59/56/11/1027595611.db2.gz XAIZTKFCACXELK-LRDDRELGSA-N 1 1 334.807 3.528 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501899951 1027628658 /nfs/dbraw/zinc/62/86/58/1027628658.db2.gz PJZDRZUPGAQQQB-AWEZNQCLSA-N 1 1 333.432 3.682 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174537 1027911887 /nfs/dbraw/zinc/91/18/87/1027911887.db2.gz FTRCTTWJOZAUOI-ACJLOTCBSA-N 1 1 330.359 3.948 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000612404320 1028071312 /nfs/dbraw/zinc/07/13/12/1028071312.db2.gz DOKKAPMHWBHEAB-AWEZNQCLSA-N 1 1 342.443 3.863 20 5 EHBDMO COC(=O)c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)o1 ZINC000143485565 1028106059 /nfs/dbraw/zinc/10/60/59/1028106059.db2.gz GEVACPBGCFOPAA-UHFFFAOYSA-N 1 1 346.383 3.693 20 5 EHBDMO COC(=O)c1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)o1 ZINC000143485565 1028106064 /nfs/dbraw/zinc/10/60/64/1028106064.db2.gz GEVACPBGCFOPAA-UHFFFAOYSA-N 1 1 346.383 3.693 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000523449325 1028344094 /nfs/dbraw/zinc/34/40/94/1028344094.db2.gz FQBZTLIPAHCQKL-INIZCTEOSA-N 1 1 342.370 3.829 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000523449325 1028344114 /nfs/dbraw/zinc/34/41/14/1028344114.db2.gz FQBZTLIPAHCQKL-INIZCTEOSA-N 1 1 342.370 3.829 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H](CCO)CC3)o2)c1 ZINC000421392489 1028366407 /nfs/dbraw/zinc/36/64/07/1028366407.db2.gz BYTZVBVWPFDEAJ-OAHLLOKOSA-N 1 1 344.411 3.839 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)cc1N(C)C ZINC000178730139 1028379934 /nfs/dbraw/zinc/37/99/34/1028379934.db2.gz GHAKCIYIYWUKLJ-LBPRGKRZSA-N 1 1 347.390 3.659 20 5 EHBDMO CC[C@H]1C[C@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697751 1028382684 /nfs/dbraw/zinc/38/26/84/1028382684.db2.gz SIPRZQUQFUHMJU-ZFWWWQNUSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@@H](NC[C@@H]1[NH2+]CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437951 1028446384 /nfs/dbraw/zinc/44/63/84/1028446384.db2.gz URCVDPDIFXEXQY-MOPGFXCFSA-N 1 1 325.412 3.523 20 5 EHBDMO CCc1ccccc1[C@H]([NH3+])CN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498599 1028464182 /nfs/dbraw/zinc/46/41/82/1028464182.db2.gz IHTHBDVDRFCBNK-KBXCAEBGSA-N 1 1 327.428 3.816 20 5 EHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000074994027 1028777553 /nfs/dbraw/zinc/77/75/53/1028777553.db2.gz KOFXMAHYUWMVHJ-ZDUSSCGKSA-N 1 1 330.388 3.513 20 5 EHBDMO Cc1ccc(C(=O)CC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000583191915 1029178491 /nfs/dbraw/zinc/17/84/91/1029178491.db2.gz NKBMFJHRLYUCIX-UHFFFAOYSA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1cccc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000614977219 1029180624 /nfs/dbraw/zinc/18/06/24/1029180624.db2.gz GFYDJQFAYYLAJK-QGZVFWFLSA-N 1 1 325.412 3.614 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000524757222 1029488778 /nfs/dbraw/zinc/48/87/78/1029488778.db2.gz PLEHPLUSESAAIB-KXBFYZLASA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000524757222 1029488785 /nfs/dbraw/zinc/48/87/85/1029488785.db2.gz PLEHPLUSESAAIB-KXBFYZLASA-N 1 1 326.396 3.865 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533247935 1029524527 /nfs/dbraw/zinc/52/45/27/1029524527.db2.gz WZPCOCSTAQVODS-MRXNPFEDSA-N 1 1 329.400 3.913 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195852 1029739111 /nfs/dbraw/zinc/73/91/11/1029739111.db2.gz SQTLWCSNZPSIRZ-ZIAGYGMSSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195852 1029739118 /nfs/dbraw/zinc/73/91/18/1029739118.db2.gz SQTLWCSNZPSIRZ-ZIAGYGMSSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195852 1029739124 /nfs/dbraw/zinc/73/91/24/1029739124.db2.gz SQTLWCSNZPSIRZ-ZIAGYGMSSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195852 1029739132 /nfs/dbraw/zinc/73/91/32/1029739132.db2.gz SQTLWCSNZPSIRZ-ZIAGYGMSSA-N 1 1 345.468 3.896 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCOCCc1ccccc1)CC2 ZINC000446736513 1029784092 /nfs/dbraw/zinc/78/40/92/1029784092.db2.gz VEFPPHMWYAJUER-UHFFFAOYSA-N 1 1 340.423 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccn(-c3ccccc3)n1)CCC2 ZINC000447548752 1030279793 /nfs/dbraw/zinc/27/97/93/1030279793.db2.gz IIHMNWQWDSDLPG-HXUWFJFHSA-N 1 1 348.406 3.948 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000482383412 1030372899 /nfs/dbraw/zinc/37/28/99/1030372899.db2.gz UPZDIKJLUHNUQI-HXUWFJFHSA-N 1 1 338.407 3.925 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000447732153 1030441524 /nfs/dbraw/zinc/44/15/24/1030441524.db2.gz VOBVSSXUHPARCY-CQSZACIVSA-N 1 1 346.818 3.638 20 5 EHBDMO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1F ZINC000532275864 1030520234 /nfs/dbraw/zinc/52/02/34/1030520234.db2.gz NAZKDRLKHDXDRF-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1F ZINC000532275864 1030520244 /nfs/dbraw/zinc/52/02/44/1030520244.db2.gz NAZKDRLKHDXDRF-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCc3ccccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000482846942 1030749247 /nfs/dbraw/zinc/74/92/47/1030749247.db2.gz VIUMTGNZROYDAR-CQSZACIVSA-N 1 1 342.395 3.602 20 5 EHBDMO CCC(CC)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000482858551 1030766921 /nfs/dbraw/zinc/76/69/21/1030766921.db2.gz PMOYZFUHQQGVPY-UHFFFAOYSA-N 1 1 335.448 3.704 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H](OC)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551275503 1031172192 /nfs/dbraw/zinc/17/21/92/1031172192.db2.gz UNLGLAKUKGGSBJ-RBUKOAKNSA-N 1 1 344.411 3.854 20 5 EHBDMO C[C@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000161119011 1031336401 /nfs/dbraw/zinc/33/64/01/1031336401.db2.gz OYIGLBRRJYIXCG-JQWIXIFHSA-N 1 1 331.338 3.533 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000536183622 1031350760 /nfs/dbraw/zinc/35/07/60/1031350760.db2.gz SQSBDIFZYDRUFS-GDBMZVCRSA-N 1 1 326.400 3.546 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ccsc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000052803848 1031700206 /nfs/dbraw/zinc/70/02/06/1031700206.db2.gz VQNLZJHPJKCVAH-MRXNPFEDSA-N 1 1 345.424 3.822 20 5 EHBDMO COc1cc(F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000584117314 1031751634 /nfs/dbraw/zinc/75/16/34/1031751634.db2.gz CHKMZJXVPONBFX-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898067668 1033311294 /nfs/dbraw/zinc/31/12/94/1033311294.db2.gz HGHGPALUTAZFCT-CQSZACIVSA-N 1 1 331.441 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c2ncccc12 ZINC000594596673 1033443993 /nfs/dbraw/zinc/44/39/93/1033443993.db2.gz BAYAFLHWZJROQO-YOEHRIQHSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000059372105 1033588970 /nfs/dbraw/zinc/58/89/70/1033588970.db2.gz PVBGRNJSXJXQEA-QGZVFWFLSA-N 1 1 342.395 3.819 20 5 EHBDMO CCCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595016635 1033609251 /nfs/dbraw/zinc/60/92/51/1033609251.db2.gz HYZRNUARANNFNT-CYBMUJFWSA-N 1 1 345.399 3.638 20 5 EHBDMO CC(C)[C@@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000594990431 1033621290 /nfs/dbraw/zinc/62/12/90/1033621290.db2.gz QMAGQUQLOMQTSO-ZWKOTPCHSA-N 1 1 332.375 3.582 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081033 1033697166 /nfs/dbraw/zinc/69/71/66/1033697166.db2.gz PIOLWKHWNACIJD-KSSFIOAISA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCN(C2CCCCC2)C1 ZINC000595081033 1033697178 /nfs/dbraw/zinc/69/71/78/1033697178.db2.gz PIOLWKHWNACIJD-KSSFIOAISA-N 1 1 329.444 3.579 20 5 EHBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595293668 1033720610 /nfs/dbraw/zinc/72/06/10/1033720610.db2.gz RXKATAGHNJJEDA-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595293668 1033720624 /nfs/dbraw/zinc/72/06/24/1033720624.db2.gz RXKATAGHNJJEDA-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO COc1ccc(C[N@H+](Cc2onc(C)c2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000595295822 1033721356 /nfs/dbraw/zinc/72/13/56/1033721356.db2.gz SZJIXHYTQOSFLJ-CYBMUJFWSA-N 1 1 345.399 3.701 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000595295822 1033721369 /nfs/dbraw/zinc/72/13/69/1033721369.db2.gz SZJIXHYTQOSFLJ-CYBMUJFWSA-N 1 1 345.399 3.701 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000595330989 1033728235 /nfs/dbraw/zinc/72/82/35/1033728235.db2.gz GXUWIPXFDQODRF-HOCLYGCPSA-N 1 1 329.400 3.907 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000592996993 1033777749 /nfs/dbraw/zinc/77/77/49/1033777749.db2.gz PAGYXHZLHPASGZ-ZDUSSCGKSA-N 1 1 328.368 3.574 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000592996993 1033777765 /nfs/dbraw/zinc/77/77/65/1033777765.db2.gz PAGYXHZLHPASGZ-ZDUSSCGKSA-N 1 1 328.368 3.574 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)c2ccncc21 ZINC000599164779 1033780019 /nfs/dbraw/zinc/78/00/19/1033780019.db2.gz MJYXGYLMZZXPDS-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599163639 1033780215 /nfs/dbraw/zinc/78/02/15/1033780215.db2.gz GEZCCEDGVMLISK-CYBMUJFWSA-N 1 1 325.359 3.961 20 5 EHBDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000595409484 1033787218 /nfs/dbraw/zinc/78/72/18/1033787218.db2.gz RAKLNOPLPGEJAM-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]1CCO ZINC000595696274 1033950491 /nfs/dbraw/zinc/95/04/91/1033950491.db2.gz KAVRNQYCQWUPBP-XHDPSFHLSA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1cccnc1[N+](=O)[O-] ZINC000603859490 1033982991 /nfs/dbraw/zinc/98/29/91/1033982991.db2.gz CILHSLDGXYRRLB-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](C4CCC4)C3)n2)c1 ZINC000595832137 1034016918 /nfs/dbraw/zinc/01/69/18/1034016918.db2.gz IRDHUXBRTKASBD-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590224 1034029805 /nfs/dbraw/zinc/02/98/05/1034029805.db2.gz VWYRBWFEUOOVTH-XJKSGUPXSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594358 1034035215 /nfs/dbraw/zinc/03/52/15/1034035215.db2.gz GGPISTBYGQZJIB-KEYYUXOJSA-N 1 1 348.443 3.956 20 5 EHBDMO CC[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095282 1034078762 /nfs/dbraw/zinc/07/87/62/1034078762.db2.gz OOSGJCXCQWEPIK-QFBILLFUSA-N 1 1 331.460 3.758 20 5 EHBDMO CC[C@@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095282 1034078781 /nfs/dbraw/zinc/07/87/81/1034078781.db2.gz OOSGJCXCQWEPIK-QFBILLFUSA-N 1 1 331.460 3.758 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690701 1034095946 /nfs/dbraw/zinc/09/59/46/1034095946.db2.gz PGUAFRYWOSCHOY-SFAKSCPVSA-N 1 1 342.399 3.823 20 5 EHBDMO CC(C)[N@@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000179320687 1034108777 /nfs/dbraw/zinc/10/87/77/1034108777.db2.gz DTRFERPFTCWAOV-UHFFFAOYSA-N 1 1 330.432 3.957 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000596168106 1034115427 /nfs/dbraw/zinc/11/54/27/1034115427.db2.gz KREUFOZHKROQKL-FZMZJTMJSA-N 1 1 343.349 3.534 20 5 EHBDMO C[C@H]1[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1(C)C ZINC000537624161 1034260861 /nfs/dbraw/zinc/26/08/61/1034260861.db2.gz RWTUPPGNMRGOLB-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1(C)C ZINC000537624161 1034260875 /nfs/dbraw/zinc/26/08/75/1034260875.db2.gz RWTUPPGNMRGOLB-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO CCC[C@H]([NH2+]Cc1c(CC)nn(C)c1OC)c1cccc([N+](=O)[O-])c1 ZINC000089212674 1034268580 /nfs/dbraw/zinc/26/85/80/1034268580.db2.gz PEQMUKVAOACHJU-KRWDZBQOSA-N 1 1 346.431 3.530 20 5 EHBDMO CCOc1cc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596570733 1034294493 /nfs/dbraw/zinc/29/44/93/1034294493.db2.gz NEFSGXSKHWQAEY-HNNXBMFYSA-N 1 1 333.432 3.527 20 5 EHBDMO Cc1ccccc1C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604492697 1034399690 /nfs/dbraw/zinc/39/96/90/1034399690.db2.gz ZPGAGRQZOWVGOV-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1ccccc1C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604492697 1034399698 /nfs/dbraw/zinc/39/96/98/1034399698.db2.gz ZPGAGRQZOWVGOV-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)[C@H]1O ZINC000597206461 1034591204 /nfs/dbraw/zinc/59/12/04/1034591204.db2.gz RZQCLBRYFWZIPB-MCBXIFIFSA-N 1 1 346.452 3.772 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000597257608 1034630387 /nfs/dbraw/zinc/63/03/87/1034630387.db2.gz HDWQWBINSMRLQQ-VGOFMYFVSA-N 1 1 340.427 3.806 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c(Cl)c1 ZINC000612402215 1034893164 /nfs/dbraw/zinc/89/31/64/1034893164.db2.gz VNGCYPZIWRSNMD-CQSZACIVSA-N 1 1 331.803 3.708 20 5 EHBDMO CCc1ccc([C@H]([NH2+]CCOC(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612574885 1035069284 /nfs/dbraw/zinc/06/92/84/1035069284.db2.gz QEUUVKISTWVODG-GOSISDBHSA-N 1 1 332.400 3.854 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000612578796 1035074787 /nfs/dbraw/zinc/07/47/87/1035074787.db2.gz JVLZQHKOGIZSFI-FQEVSTJZSA-N 1 1 339.439 3.610 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@@H]2/C=C\c2cccs2)n1 ZINC000542131643 1035075922 /nfs/dbraw/zinc/07/59/22/1035075922.db2.gz NKZDUSHJMZKCTR-ZPIQOJFGSA-N 1 1 346.456 3.811 20 5 EHBDMO CCc1ccc(-c2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)cc1[N+](=O)[O-] ZINC000612954108 1035322925 /nfs/dbraw/zinc/32/29/25/1035322925.db2.gz BQQPBRJMZGQIJN-GOOCMWNKSA-N 1 1 342.399 3.547 20 5 EHBDMO Cc1cc(NC[C@H]2CCC[N@H+](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000580866991 1035465364 /nfs/dbraw/zinc/46/53/64/1035465364.db2.gz DALRKDSHCADPIF-LLVKDONJSA-N 1 1 331.338 3.676 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936041 1035673104 /nfs/dbraw/zinc/67/31/04/1035673104.db2.gz VDSZQKCASXEWDV-NVXWUHKLSA-N 1 1 326.396 3.852 20 5 EHBDMO C[C@@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000414180689 1035934148 /nfs/dbraw/zinc/93/41/48/1035934148.db2.gz LREOZIFPUHWLEU-FUEDEBDSSA-N 1 1 348.424 3.580 20 5 EHBDMO Cc1ccccc1[C@@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000541053863 1035947194 /nfs/dbraw/zinc/94/71/94/1035947194.db2.gz JBKRAAAUECICNB-GOSISDBHSA-N 1 1 344.411 3.514 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c2c(c1)COCO2 ZINC000016397222 1035953732 /nfs/dbraw/zinc/95/37/32/1035953732.db2.gz BWXRUFHEZFRAFT-GUYCJALGSA-N 1 1 332.400 3.616 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541390327 1036251375 /nfs/dbraw/zinc/25/13/75/1036251375.db2.gz POVAFUWKWGWJNL-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541390327 1036251388 /nfs/dbraw/zinc/25/13/88/1036251388.db2.gz POVAFUWKWGWJNL-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589111659 1036257567 /nfs/dbraw/zinc/25/75/67/1036257567.db2.gz MYGIDEIQNNQWEM-GFCCVEGCSA-N 1 1 345.365 3.782 20 5 EHBDMO CCn1c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)nc2c1cccc2F ZINC000180459185 1036860373 /nfs/dbraw/zinc/86/03/73/1036860373.db2.gz CKCSWXNKKQBQKT-GFCCVEGCSA-N 1 1 342.374 3.954 20 5 EHBDMO CCC[C@]1(C)CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000464858621 1036915494 /nfs/dbraw/zinc/91/54/94/1036915494.db2.gz XEQWPHIVBAENHQ-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000464858621 1036915513 /nfs/dbraw/zinc/91/55/13/1036915513.db2.gz XEQWPHIVBAENHQ-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169681 1036918534 /nfs/dbraw/zinc/91/85/34/1036918534.db2.gz VLZICBROBABZKZ-FZKQIMNGSA-N 1 1 349.406 3.575 20 5 EHBDMO Cc1nn(C[N@@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537385 1037042874 /nfs/dbraw/zinc/04/28/74/1037042874.db2.gz IDKLLCCPWLDPFB-CJNGLKHVSA-N 1 1 328.416 3.552 20 5 EHBDMO CC[C@H](O)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850727 1037281226 /nfs/dbraw/zinc/28/12/26/1037281226.db2.gz OVBWTWHPUMFJCJ-ICEKFOEVSA-N 1 1 340.423 3.881 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)o2)cc1 ZINC000539891306 1037316365 /nfs/dbraw/zinc/31/63/65/1037316365.db2.gz RUDYXGBYVIUFIZ-YJBOKZPZSA-N 1 1 342.395 3.856 20 5 EHBDMO CC[N@H+]1CCC[C@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423957 1037451631 /nfs/dbraw/zinc/45/16/31/1037451631.db2.gz QGJNIIPLHOMHMM-PMACEKPBSA-N 1 1 339.439 3.758 20 5 EHBDMO CCN1CCC[C@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423957 1037451646 /nfs/dbraw/zinc/45/16/46/1037451646.db2.gz QGJNIIPLHOMHMM-PMACEKPBSA-N 1 1 339.439 3.758 20 5 EHBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789395 1037531299 /nfs/dbraw/zinc/53/12/99/1037531299.db2.gz MCQOUCOXQPPUKP-QWQRMKEZSA-N 1 1 344.411 3.836 20 5 EHBDMO CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290423578 1037600999 /nfs/dbraw/zinc/60/09/99/1037600999.db2.gz KWRKYSCHXFUODI-UHFFFAOYSA-N 1 1 330.432 3.574 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](O)[C@@H]2CCc2ccccc2)cs1 ZINC000592165647 1037908831 /nfs/dbraw/zinc/90/88/31/1037908831.db2.gz DIOPGRXXXQOAPK-DLBZAZTESA-N 1 1 346.452 3.614 20 5 EHBDMO O=C(CC[N@H+]1CCCC[C@H]1C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000592199118 1037944389 /nfs/dbraw/zinc/94/43/89/1037944389.db2.gz XABHQHLEECZCAS-INIZCTEOSA-N 1 1 331.416 3.578 20 5 EHBDMO Cc1ccc(C[N@@H+](CCCO)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000538798250 1038533295 /nfs/dbraw/zinc/53/32/95/1038533295.db2.gz VKFVBDQOVVVAHC-UHFFFAOYSA-N 1 1 348.830 3.941 20 5 EHBDMO COC(C)(C)C[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538828155 1038555783 /nfs/dbraw/zinc/55/57/83/1038555783.db2.gz NQKPENBMFMRJKE-UHFFFAOYSA-N 1 1 335.429 3.575 20 5 EHBDMO COC(C)(C)C[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538828155 1038555788 /nfs/dbraw/zinc/55/57/88/1038555788.db2.gz NQKPENBMFMRJKE-UHFFFAOYSA-N 1 1 335.429 3.575 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000182356054 1038587664 /nfs/dbraw/zinc/58/76/64/1038587664.db2.gz OOZQBERVYYPXTJ-RDTXWAMCSA-N 1 1 349.862 3.697 20 5 EHBDMO C[C@H]([NH3+])C[C@H](C)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593644 1039350950 /nfs/dbraw/zinc/35/09/50/1039350950.db2.gz KIRTVSKWOUTVJY-STQMWFEESA-N 1 1 347.390 3.742 20 5 EHBDMO CC(C)N1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316983 1039657725 /nfs/dbraw/zinc/65/77/25/1039657725.db2.gz VMFYWFSWELJXCT-LJQANCHMSA-N 1 1 331.460 3.825 20 5 EHBDMO Cc1c(C[NH2+]Cc2conc2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000549815973 1039946597 /nfs/dbraw/zinc/94/65/97/1039946597.db2.gz DXBRLPFFVILXTL-UHFFFAOYSA-N 1 1 337.379 3.772 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H](CC)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000573409969 1040091513 /nfs/dbraw/zinc/09/15/13/1040091513.db2.gz XDFGUFWQSMDZRS-SJLPKXTDSA-N 1 1 332.400 3.854 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000105455487 1040344085 /nfs/dbraw/zinc/34/40/85/1040344085.db2.gz IGBUYTSWROQLHJ-UHFFFAOYSA-N 1 1 329.381 3.910 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069277 1040431246 /nfs/dbraw/zinc/43/12/46/1040431246.db2.gz GNHRALPPEIRXMF-GDBMZVCRSA-N 1 1 333.432 3.824 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2n[nH]cc2c1 ZINC000513022620 1041395222 /nfs/dbraw/zinc/39/52/22/1041395222.db2.gz WIODFPZCMILGOG-SNVBAGLBSA-N 1 1 330.775 3.975 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112077768 1042332452 /nfs/dbraw/zinc/33/24/52/1042332452.db2.gz HJGAIVBZNOQZSU-AWEZNQCLSA-N 1 1 328.416 3.675 20 5 EHBDMO CC1(C)CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000112702139 1042420994 /nfs/dbraw/zinc/42/09/94/1042420994.db2.gz NZUIMFKHEJDXLH-UHFFFAOYSA-N 1 1 329.400 3.914 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000278918706 1042944995 /nfs/dbraw/zinc/94/49/95/1042944995.db2.gz WNJLOHKCQXIRIN-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765588 1043029318 /nfs/dbraw/zinc/02/93/18/1043029318.db2.gz XKIDBMLUNRPZKI-AWEZNQCLSA-N 1 1 338.411 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c(F)c1 ZINC000279069760 1043296099 /nfs/dbraw/zinc/29/60/99/1043296099.db2.gz LMYRACSVHSHWNS-UHFFFAOYSA-N 1 1 344.390 3.651 20 5 EHBDMO CC[N@@H+](Cc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896778 1043541714 /nfs/dbraw/zinc/54/17/14/1043541714.db2.gz ULZKLWDEYNOJOX-UHFFFAOYSA-N 1 1 336.395 3.938 20 5 EHBDMO CC[N@H+](Cc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896778 1043541724 /nfs/dbraw/zinc/54/17/24/1043541724.db2.gz ULZKLWDEYNOJOX-UHFFFAOYSA-N 1 1 336.395 3.938 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160848 /nfs/dbraw/zinc/16/08/48/1044160848.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 1 1 331.460 3.681 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000072965823 1126953491 /nfs/dbraw/zinc/95/34/91/1126953491.db2.gz YSPVVGMTBGPNRQ-HUUCEWRRSA-N 1 1 337.489 3.743 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000131207434 1126969192 /nfs/dbraw/zinc/96/91/92/1126969192.db2.gz SJZNSVZRHQAOCW-QGZVFWFLSA-N 1 1 346.383 3.550 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3cccs3)C3CC3)nc2c1 ZINC000083134007 1127211413 /nfs/dbraw/zinc/21/14/13/1127211413.db2.gz MIKWGMAFFJVCTR-UHFFFAOYSA-N 1 1 329.381 3.962 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3cccs3)C3CC3)nc2c1 ZINC000083134007 1127211415 /nfs/dbraw/zinc/21/14/15/1127211415.db2.gz MIKWGMAFFJVCTR-UHFFFAOYSA-N 1 1 329.381 3.962 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000301280861 1127729374 /nfs/dbraw/zinc/72/93/74/1127729374.db2.gz ODWABDAHJNTDDM-LBPRGKRZSA-N 1 1 326.828 3.567 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302455 1127735704 /nfs/dbraw/zinc/73/57/04/1127735704.db2.gz VWTSCTYGMWVORQ-HUUCEWRRSA-N 1 1 335.423 3.825 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488451 1127758384 /nfs/dbraw/zinc/75/83/84/1127758384.db2.gz BUHOVWSTAQUONE-NSHDSACASA-N 1 1 344.358 3.683 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301443288 1127936085 /nfs/dbraw/zinc/93/60/85/1127936085.db2.gz VAJAUWOWVMEJHE-IUODEOHRSA-N 1 1 332.429 3.546 20 5 EHBDMO COc1cc(C[N@H+]2CCC3(CCC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000123121387 1128611035 /nfs/dbraw/zinc/61/10/35/1128611035.db2.gz XJNCLSXLHVYEER-UHFFFAOYSA-N 1 1 342.342 3.581 20 5 EHBDMO CC[N@@H+](CC(C)C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737822 1128661318 /nfs/dbraw/zinc/66/13/18/1128661318.db2.gz JAKKLFPIYPWRSH-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]Cc1ccccc1F ZINC000162116229 1120197901 /nfs/dbraw/zinc/19/79/01/1120197901.db2.gz WYYHXNPYOLIBFS-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO CCCCCC[N@@H+](C)Cc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000761637952 1120659896 /nfs/dbraw/zinc/65/98/96/1120659896.db2.gz HDLQAXWPZWSZIC-UHFFFAOYSA-N 1 1 332.404 3.965 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2ccc(F)c(F)c2)C2CC2)c1 ZINC000153260002 1120928592 /nfs/dbraw/zinc/92/85/92/1120928592.db2.gz PLKDHQPJVLEGND-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2c(F)cccc2F)C2CC2)c1 ZINC000153273346 1120933517 /nfs/dbraw/zinc/93/35/17/1120933517.db2.gz NUNMYXXLCUQYKX-QGZVFWFLSA-N 1 1 348.349 3.571 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@H]12 ZINC000915210189 1121255088 /nfs/dbraw/zinc/25/50/88/1121255088.db2.gz WUHGRNYEGJIRFI-QBIMZIAESA-N 1 1 328.416 3.803 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000122743035 1121667420 /nfs/dbraw/zinc/66/74/20/1121667420.db2.gz OEWLRVLEYBEWHV-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000122743035 1121667424 /nfs/dbraw/zinc/66/74/24/1121667424.db2.gz OEWLRVLEYBEWHV-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272528933 1121675810 /nfs/dbraw/zinc/67/58/10/1121675810.db2.gz MOICMSLEFYDDKU-KRWDZBQOSA-N 1 1 328.416 3.588 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2OC(C)C)cc1[N+](=O)[O-] ZINC000324618888 1121946776 /nfs/dbraw/zinc/94/67/76/1121946776.db2.gz QUFKASMROHIPSG-AWEZNQCLSA-N 1 1 329.400 3.936 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1C(F)(F)F ZINC000301117822 1121954388 /nfs/dbraw/zinc/95/43/88/1121954388.db2.gz WIJNNLUEHXPMQI-OCCSQVGLSA-N 1 1 329.322 3.652 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCC[C@H]1O ZINC000497144531 1122351324 /nfs/dbraw/zinc/35/13/24/1122351324.db2.gz KMWNSQBAZLRDGV-MAUKXSAKSA-N 1 1 344.411 3.838 20 5 EHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000497445804 1122554649 /nfs/dbraw/zinc/55/46/49/1122554649.db2.gz UCYFIAUODXDTLA-IBGZPJMESA-N 1 1 341.411 3.862 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000497464081 1122561734 /nfs/dbraw/zinc/56/17/34/1122561734.db2.gz MWVZMVZEJHGPDP-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO CC1CCC([N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C2CC2)CC1 ZINC000917437305 1122602386 /nfs/dbraw/zinc/60/23/86/1122602386.db2.gz JYKVKSUIQAHKJV-UHFFFAOYSA-N 1 1 328.416 3.945 20 5 EHBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000917481008 1122614286 /nfs/dbraw/zinc/61/42/86/1122614286.db2.gz WLPYGSVJCCMEEX-OAHLLOKOSA-N 1 1 345.399 3.505 20 5 EHBDMO COc1ccc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000609744680 1123654861 /nfs/dbraw/zinc/65/48/61/1123654861.db2.gz SDXZOLFXZNMZGS-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000064641007 1123693485 /nfs/dbraw/zinc/69/34/85/1123693485.db2.gz MGMNOTLBAWHEJC-FQEVSTJZSA-N 1 1 340.423 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnn(-c3ccccc3)c2)C2CC2)cc1 ZINC000195677466 1123734075 /nfs/dbraw/zinc/73/40/75/1123734075.db2.gz LNMWHFKRMWHOIO-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnn(-c3ccccc3)c2)C2CC2)cc1 ZINC000195677466 1123734078 /nfs/dbraw/zinc/73/40/78/1123734078.db2.gz LNMWHFKRMWHOIO-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(-n3cccn3)cc2)C2CC2)cc1 ZINC000195677476 1123734103 /nfs/dbraw/zinc/73/41/03/1123734103.db2.gz JMJKGSGGPJHSBF-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000615837655 1123884684 /nfs/dbraw/zinc/88/46/84/1123884684.db2.gz SNGNOTOVPMBHPH-SKTWIKFTSA-N 1 1 337.423 3.958 20 5 EHBDMO CCn1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000616737760 1124028721 /nfs/dbraw/zinc/02/87/21/1124028721.db2.gz SBCWBCXHHJEZSN-UHFFFAOYSA-N 1 1 339.342 3.650 20 5 EHBDMO CCn1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000616737760 1124028726 /nfs/dbraw/zinc/02/87/26/1124028726.db2.gz SBCWBCXHHJEZSN-UHFFFAOYSA-N 1 1 339.342 3.650 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000446843444 1125334966 /nfs/dbraw/zinc/33/49/66/1125334966.db2.gz NNLUWKOSCRDPHK-HKBKRHGFSA-N 1 1 340.427 3.611 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000619531593 1125358682 /nfs/dbraw/zinc/35/86/82/1125358682.db2.gz LAPGWZWBUGQTCX-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000619531593 1125358683 /nfs/dbraw/zinc/35/86/83/1125358683.db2.gz LAPGWZWBUGQTCX-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ncccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000301859698 1129218078 /nfs/dbraw/zinc/21/80/78/1129218078.db2.gz DDPDIHBRKGKUCE-UKRRQHHQSA-N 1 1 332.791 3.501 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000301859698 1129218080 /nfs/dbraw/zinc/21/80/80/1129218080.db2.gz DDPDIHBRKGKUCE-UKRRQHHQSA-N 1 1 332.791 3.501 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000117345600 1129434949 /nfs/dbraw/zinc/43/49/49/1129434949.db2.gz NDZJMPULANTXPX-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000091960526 1129529075 /nfs/dbraw/zinc/52/90/75/1129529075.db2.gz MVSOINKKYRPZFS-BEFAXECRSA-N 1 1 342.443 3.998 20 5 EHBDMO Cc1ccn2c(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cnc2c1 ZINC000154259169 1129543494 /nfs/dbraw/zinc/54/34/94/1129543494.db2.gz ZLIGIWARCNIXLD-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1ccn2c(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)cnc2c1 ZINC000154259169 1129543498 /nfs/dbraw/zinc/54/34/98/1129543498.db2.gz ZLIGIWARCNIXLD-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1c(C[NH2+][C@@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000499950293 1129586499 /nfs/dbraw/zinc/58/64/99/1129586499.db2.gz FLVTUUSKEQGMGP-AWEZNQCLSA-N 1 1 338.766 3.519 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482610 1129590409 /nfs/dbraw/zinc/59/04/09/1129590409.db2.gz IJKAJLKDYVRGLE-KGLIPLIRSA-N 1 1 330.384 3.590 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235622 1129672483 /nfs/dbraw/zinc/67/24/83/1129672483.db2.gz QCRDQFUORISOLM-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513985 1129699496 /nfs/dbraw/zinc/69/94/96/1129699496.db2.gz FSZHYAAOAMYHLE-GFCCVEGCSA-N 1 1 341.367 3.505 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429033018 1129714360 /nfs/dbraw/zinc/71/43/60/1129714360.db2.gz YZWPIRXXCCQZSJ-NQUFMGSDSA-N 1 1 331.460 3.626 20 5 EHBDMO C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302045565 1129764608 /nfs/dbraw/zinc/76/46/08/1129764608.db2.gz KILYNVKOMMVPCN-RYUDHWBXSA-N 1 1 338.839 3.708 20 5 EHBDMO Cc1cc(N[C@H]2CCC[C@@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302087606 1129767092 /nfs/dbraw/zinc/76/70/92/1129767092.db2.gz OAHDQMBRHPHEQD-UONOGXRCSA-N 1 1 328.416 3.736 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000302974459 1129803830 /nfs/dbraw/zinc/80/38/30/1129803830.db2.gz JCLQEEJFKIHNNI-KRWDZBQOSA-N 1 1 326.396 3.853 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303655731 1129861924 /nfs/dbraw/zinc/86/19/24/1129861924.db2.gz UZPSIHLCSQCQIK-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO CC[C@H](C(=O)Oc1cc([N+](=O)[O-])c(Cl)cc1C)[NH+](CC)CC ZINC000736021950 1131404676 /nfs/dbraw/zinc/40/46/76/1131404676.db2.gz KOJNDWLLIJMNND-GFCCVEGCSA-N 1 1 328.796 3.582 20 5 EHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000030002470 1129910017 /nfs/dbraw/zinc/91/00/17/1129910017.db2.gz WTBJLUFGVZFCJJ-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000030002470 1129910018 /nfs/dbraw/zinc/91/00/18/1129910018.db2.gz WTBJLUFGVZFCJJ-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000058562986 1129948562 /nfs/dbraw/zinc/94/85/62/1129948562.db2.gz IDOPBMIYCMRFKC-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132137 1129981384 /nfs/dbraw/zinc/98/13/84/1129981384.db2.gz YOPFZZMUHCVHHI-HNNXBMFYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132361 1129981559 /nfs/dbraw/zinc/98/15/59/1129981559.db2.gz YOPFZZMUHCVHHI-OAHLLOKOSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000172019485 1130100366 /nfs/dbraw/zinc/10/03/66/1130100366.db2.gz SFNQOLHNBCFKCJ-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000172864394 1130165242 /nfs/dbraw/zinc/16/52/42/1130165242.db2.gz QAQHGOUQEAQKCA-UONOGXRCSA-N 1 1 329.400 3.913 20 5 EHBDMO CCN(C(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000429252914 1130388859 /nfs/dbraw/zinc/38/88/59/1130388859.db2.gz IUIJYSJGMLNPPL-UHFFFAOYSA-N 1 1 347.459 3.601 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@H](c4ccccc4F)C3)c2c1 ZINC000730455256 1130712734 /nfs/dbraw/zinc/71/27/34/1130712734.db2.gz RPIUAEUZGJZKGY-AWEZNQCLSA-N 1 1 340.358 3.531 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCc3cc(O)ccc3C1)CC2 ZINC001172906196 1131888514 /nfs/dbraw/zinc/88/85/14/1131888514.db2.gz WOFJQQVFJAJCLT-GOSISDBHSA-N 1 1 338.407 3.606 20 5 EHBDMO CCC[N@H+](CCCN(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914062 1131902983 /nfs/dbraw/zinc/90/29/83/1131902983.db2.gz YSDCBOREFJZZCY-GOSISDBHSA-N 1 1 333.476 3.506 20 5 EHBDMO CCC[N@@H+](CCCN(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914062 1131902991 /nfs/dbraw/zinc/90/29/91/1131902991.db2.gz YSDCBOREFJZZCY-GOSISDBHSA-N 1 1 333.476 3.506 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(CC2CCC2)CC1 ZINC001173224817 1132005478 /nfs/dbraw/zinc/00/54/78/1132005478.db2.gz PDZWTEQGXUFXNM-OAHLLOKOSA-N 1 1 331.460 3.509 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001173231062 1132009252 /nfs/dbraw/zinc/00/92/52/1132009252.db2.gz JGKGABKPWVFJSP-DNVCBOLYSA-N 1 1 332.444 3.807 20 5 EHBDMO COc1cc2c(cc1OC)C[NH+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173237108 1132025822 /nfs/dbraw/zinc/02/58/22/1132025822.db2.gz HPWUFKRIGLKECX-CYBMUJFWSA-N 1 1 342.395 3.559 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000744399624 1132088200 /nfs/dbraw/zinc/08/82/00/1132088200.db2.gz ULBVBPCFIUOOPX-CQSZACIVSA-N 1 1 349.431 3.599 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000744399624 1132088208 /nfs/dbraw/zinc/08/82/08/1132088208.db2.gz ULBVBPCFIUOOPX-CQSZACIVSA-N 1 1 349.431 3.599 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](CCc1ccccc1)C1CC1 ZINC000746114881 1132376760 /nfs/dbraw/zinc/37/67/60/1132376760.db2.gz YWNJYBHUWYKVFX-UHFFFAOYSA-N 1 1 326.396 3.681 20 5 EHBDMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169045718 1132641696 /nfs/dbraw/zinc/64/16/96/1132641696.db2.gz JTISPAKFDIDFTR-ZFWWWQNUSA-N 1 1 330.350 3.973 20 5 EHBDMO COCC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccccc1[N+](=O)[O-] ZINC001176203136 1132871730 /nfs/dbraw/zinc/87/17/30/1132871730.db2.gz XNFJWWKOYIMTBS-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO COCC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ccccc1[N+](=O)[O-] ZINC001176203136 1132871739 /nfs/dbraw/zinc/87/17/39/1132871739.db2.gz XNFJWWKOYIMTBS-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccsc1)[NH+](C)C ZINC000804345728 1132929095 /nfs/dbraw/zinc/92/90/95/1132929095.db2.gz QXAWTAYLZJVXGI-INIZCTEOSA-N 1 1 333.413 3.574 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762595 1133048250 /nfs/dbraw/zinc/04/82/50/1133048250.db2.gz IZLCKWBJZUCAEW-LRDDRELGSA-N 1 1 331.420 3.506 20 5 EHBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765819 1133049830 /nfs/dbraw/zinc/04/98/30/1133049830.db2.gz PNXDKXPOYAXMQC-INIZCTEOSA-N 1 1 343.431 3.711 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1[N+](=O)[O-] ZINC000768337457 1133126411 /nfs/dbraw/zinc/12/64/11/1133126411.db2.gz OXEYIPDGYIEPIV-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1[N+](=O)[O-] ZINC000768337457 1133126412 /nfs/dbraw/zinc/12/64/12/1133126412.db2.gz OXEYIPDGYIEPIV-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2scnc2c1 ZINC001178295481 1133153818 /nfs/dbraw/zinc/15/38/18/1133153818.db2.gz RCIDTHFLPGVSCP-UHFFFAOYSA-N 1 1 329.381 3.503 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000746662746 1133975314 /nfs/dbraw/zinc/97/53/14/1133975314.db2.gz IBRZLMIVPAJIPH-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000746662746 1133975321 /nfs/dbraw/zinc/97/53/21/1133975321.db2.gz IBRZLMIVPAJIPH-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000746670334 1133989610 /nfs/dbraw/zinc/98/96/10/1133989610.db2.gz FSQHXKKSJSATCM-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000746670334 1133989614 /nfs/dbraw/zinc/98/96/14/1133989614.db2.gz FSQHXKKSJSATCM-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998596 1134018124 /nfs/dbraw/zinc/01/81/24/1134018124.db2.gz FIDYFXUKQMUMRD-ZNMIVQPWSA-N 1 1 342.443 3.921 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)cc1 ZINC000775061524 1134274050 /nfs/dbraw/zinc/27/40/50/1134274050.db2.gz WQWWSMKJFDFJSZ-OAHLLOKOSA-N 1 1 341.367 3.801 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190977 1134307972 /nfs/dbraw/zinc/30/79/72/1134307972.db2.gz WWCKNDGWGXYITH-HNNXBMFYSA-N 1 1 331.441 3.960 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327191 1134748329 /nfs/dbraw/zinc/74/83/29/1134748329.db2.gz FMLUCGAMKMCSCZ-OAHLLOKOSA-N 1 1 340.423 3.901 20 5 EHBDMO CO[C@H](C)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC001191099316 1134792767 /nfs/dbraw/zinc/79/27/67/1134792767.db2.gz LQCOJHIWYBBKLI-LLVKDONJSA-N 1 1 345.237 3.603 20 5 EHBDMO CO[C@H](C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC001191099316 1134792771 /nfs/dbraw/zinc/79/27/71/1134792771.db2.gz LQCOJHIWYBBKLI-LLVKDONJSA-N 1 1 345.237 3.603 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c([N+](=O)[O-])c1 ZINC000792874864 1134809367 /nfs/dbraw/zinc/80/93/67/1134809367.db2.gz YNGGAFBTRYLOOQ-UHFFFAOYSA-N 1 1 345.330 3.811 20 5 EHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001191201920 1134814336 /nfs/dbraw/zinc/81/43/36/1134814336.db2.gz CGIGKFCTQOBPFV-ZDUSSCGKSA-N 1 1 327.222 3.978 20 5 EHBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204363 1134814894 /nfs/dbraw/zinc/81/48/94/1134814894.db2.gz SQTXHELUKBAAOM-GDBMZVCRSA-N 1 1 326.824 3.884 20 5 EHBDMO C[C@]12CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@H]1C2(Cl)Cl ZINC000792910959 1134822860 /nfs/dbraw/zinc/82/28/60/1134822860.db2.gz WNJSQZOHFSHFMK-OLZOCXBDSA-N 1 1 333.190 3.750 20 5 EHBDMO C[C@]12CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@H]1C2(Cl)Cl ZINC000792910959 1134822867 /nfs/dbraw/zinc/82/28/67/1134822867.db2.gz WNJSQZOHFSHFMK-OLZOCXBDSA-N 1 1 333.190 3.750 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@H]3CCCC[C@H]32)cc1 ZINC001191368241 1134858513 /nfs/dbraw/zinc/85/85/13/1134858513.db2.gz YYKXFLVXSSLJKS-SJORKVTESA-N 1 1 336.457 3.724 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001193325019 1135125487 /nfs/dbraw/zinc/12/54/87/1135125487.db2.gz XWUXQFHVHMVVFK-KRWDZBQOSA-N 1 1 326.396 3.772 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nsc2ccccc21 ZINC001194260526 1135251314 /nfs/dbraw/zinc/25/13/14/1135251314.db2.gz DKVMSTCFOQOWNC-UHFFFAOYSA-N 1 1 327.409 3.879 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nsc2ccccc21 ZINC001194260526 1135251318 /nfs/dbraw/zinc/25/13/18/1135251318.db2.gz DKVMSTCFOQOWNC-UHFFFAOYSA-N 1 1 327.409 3.879 20 5 EHBDMO CC(C)[N@@H+](CC[C@H](O)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000808711909 1135719135 /nfs/dbraw/zinc/71/91/35/1135719135.db2.gz WARZSMLYAYRFFG-IBGZPJMESA-N 1 1 328.412 3.929 20 5 EHBDMO C[C@@]1(Cc2cccs2)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301958 1135796595 /nfs/dbraw/zinc/79/65/95/1135796595.db2.gz ZCKWGIQDQIPLQM-MSOLQXFVSA-N 1 1 346.452 3.787 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001198707212 1135851588 /nfs/dbraw/zinc/85/15/88/1135851588.db2.gz SRNCGIFDTBMSOU-GDBMZVCRSA-N 1 1 345.443 3.824 20 5 EHBDMO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000809946249 1135903103 /nfs/dbraw/zinc/90/31/03/1135903103.db2.gz AUTOMRUIIQAPGX-UHFFFAOYSA-N 1 1 346.258 3.675 20 5 EHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812853112 1136262804 /nfs/dbraw/zinc/26/28/04/1136262804.db2.gz AOSLJJQSAGCMBL-HNAYVOBHSA-N 1 1 328.412 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCC[N@@H+](CC4CC4)C3)sc2c1 ZINC000853999655 1136579208 /nfs/dbraw/zinc/57/92/08/1136579208.db2.gz NPXBWHOOSIQRKT-ZDUSSCGKSA-N 1 1 346.456 3.738 20 5 EHBDMO Cc1cc(Cl)c(C(=O)OCC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000815405708 1136592815 /nfs/dbraw/zinc/59/28/15/1136592815.db2.gz GLUSLVZYABPPFM-LBPRGKRZSA-N 1 1 340.807 3.588 20 5 EHBDMO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000339000367 1136825182 /nfs/dbraw/zinc/82/51/82/1136825182.db2.gz LRNAODBBBOLARG-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1ccc([C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C2CC2)cn1 ZINC000860206158 1137049453 /nfs/dbraw/zinc/04/94/53/1137049453.db2.gz BHPCZIGLJMFHRP-QGZVFWFLSA-N 1 1 347.802 3.893 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1Br ZINC000844469021 1137226798 /nfs/dbraw/zinc/22/67/98/1137226798.db2.gz TYGQHJBLEGMOOF-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1Br ZINC000844469021 1137226799 /nfs/dbraw/zinc/22/67/99/1137226799.db2.gz TYGQHJBLEGMOOF-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc4[nH]cnc4c3[N+](=O)[O-])c2c1 ZINC001171167540 1137278381 /nfs/dbraw/zinc/27/83/81/1137278381.db2.gz HNVZERKCNDKZDX-LBPRGKRZSA-N 1 1 349.394 3.613 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)c1 ZINC000846979774 1137381965 /nfs/dbraw/zinc/38/19/65/1137381965.db2.gz QQXVZXLDBLFXKX-ZDUSSCGKSA-N 1 1 331.803 3.941 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001649160325 1137479534 /nfs/dbraw/zinc/47/95/34/1137479534.db2.gz XEZRRVDWFPADKS-QGZVFWFLSA-N 1 1 348.406 3.829 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCCC2)CC1 ZINC001171911649 1137518102 /nfs/dbraw/zinc/51/81/02/1137518102.db2.gz TWRAJFFSTYZJCP-OAHLLOKOSA-N 1 1 345.443 3.968 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc2c1OCO2 ZINC000872025083 1137565731 /nfs/dbraw/zinc/56/57/31/1137565731.db2.gz YTNFQOPWDOVPII-NSHDSACASA-N 1 1 346.408 3.896 20 5 EHBDMO CCN(CC)c1ncc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000873184188 1137593013 /nfs/dbraw/zinc/59/30/13/1137593013.db2.gz FLQYQPCGKJTVMO-GFCCVEGCSA-N 1 1 334.445 3.748 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878114435 1137702868 /nfs/dbraw/zinc/70/28/68/1137702868.db2.gz XHQVBZPJCIPHBR-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC3(CCC3)C2)o1 ZINC000878187512 1137706325 /nfs/dbraw/zinc/70/63/25/1137706325.db2.gz BSYPDKFBFVTCQC-UHFFFAOYSA-N 1 1 348.790 3.674 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690530 1137755410 /nfs/dbraw/zinc/75/54/10/1137755410.db2.gz XVTKUSFISZLCQM-ZBFHGGJFSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690530 1137755411 /nfs/dbraw/zinc/75/54/11/1137755411.db2.gz XVTKUSFISZLCQM-ZBFHGGJFSA-N 1 1 338.411 3.535 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000879731136 1137756919 /nfs/dbraw/zinc/75/69/19/1137756919.db2.gz IGGZMOORCVILPO-CQSZACIVSA-N 1 1 345.399 3.670 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CCCn2nccc21 ZINC000879788091 1137758765 /nfs/dbraw/zinc/75/87/65/1137758765.db2.gz QRKCLXQHLOPPNV-LBPRGKRZSA-N 1 1 341.198 3.723 20 5 EHBDMO CCC[C@H](C)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000883257590 1137850848 /nfs/dbraw/zinc/85/08/48/1137850848.db2.gz GDLJUUALKIRHIV-YOEHRIQHSA-N 1 1 330.432 3.834 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128109 1137932626 /nfs/dbraw/zinc/93/26/26/1137932626.db2.gz MYNZGYISBVNNQF-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1OC ZINC000885927808 1138025579 /nfs/dbraw/zinc/02/55/79/1138025579.db2.gz YRMWCFBQGIYVTA-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000886049406 1138035081 /nfs/dbraw/zinc/03/50/81/1138035081.db2.gz LRNYSNMEYAGOEH-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000075998851 1138129600 /nfs/dbraw/zinc/12/96/00/1138129600.db2.gz XJQFUVYSWRDGGI-KRWDZBQOSA-N 1 1 330.388 3.657 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000075998850 1138129718 /nfs/dbraw/zinc/12/97/18/1138129718.db2.gz XJQFUVYSWRDGGI-QGZVFWFLSA-N 1 1 330.388 3.657 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000091099426 1138215920 /nfs/dbraw/zinc/21/59/20/1138215920.db2.gz INYPQYYTFFJMNE-CQSZACIVSA-N 1 1 349.456 3.866 20 5 EHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336973206 1138438558 /nfs/dbraw/zinc/43/85/58/1138438558.db2.gz RRNYTIZUPFYTIA-CYBMUJFWSA-N 1 1 345.374 3.756 20 5 EHBDMO COc1cc(C[N@H+]2CCC(C)=C(c3ccco3)C2)ccc1[N+](=O)[O-] ZINC000338360062 1138854863 /nfs/dbraw/zinc/85/48/63/1138854863.db2.gz WETBWNIDPVCEBI-UHFFFAOYSA-N 1 1 328.368 3.876 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969239 1140070314 /nfs/dbraw/zinc/07/03/14/1140070314.db2.gz MTEKMBKLVLBYKU-SNVBAGLBSA-N 1 1 325.821 3.940 20 5 EHBDMO CCOc1cccc([C@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000184305399 1140094418 /nfs/dbraw/zinc/09/44/18/1140094418.db2.gz UENNVPXHFSIPOI-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1cc(C[NH2+]C2(c3cccc(F)c3)CC2)c([N+](=O)[O-])cc1F ZINC000184309235 1140094957 /nfs/dbraw/zinc/09/49/57/1140094957.db2.gz NIVYDZVAWLCHIW-UHFFFAOYSA-N 1 1 334.322 3.661 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cs1 ZINC000267468767 1140795060 /nfs/dbraw/zinc/79/50/60/1140795060.db2.gz WPHUEEAETYBLSX-CHWSQXEVSA-N 1 1 338.454 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cs1 ZINC000267468767 1140795066 /nfs/dbraw/zinc/79/50/66/1140795066.db2.gz WPHUEEAETYBLSX-CHWSQXEVSA-N 1 1 338.454 3.806 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636323 1141130139 /nfs/dbraw/zinc/13/01/39/1141130139.db2.gz AOPCBQVRUAMYFF-DIFFPNOSSA-N 1 1 336.338 3.599 20 5 EHBDMO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000271177733 1141318684 /nfs/dbraw/zinc/31/86/84/1141318684.db2.gz XRQJVBWXAKLUEL-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000271177733 1141318688 /nfs/dbraw/zinc/31/86/88/1141318688.db2.gz XRQJVBWXAKLUEL-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1cccnc1 ZINC000349005712 1141620900 /nfs/dbraw/zinc/62/09/00/1141620900.db2.gz LAIDCCRBEXSYQB-LFIBNONCSA-N 1 1 341.411 3.542 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000430197055 1014830232 /nfs/dbraw/zinc/83/02/32/1014830232.db2.gz TZHMJCWARIIYSC-HNNXBMFYSA-N 1 1 342.395 3.504 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000430211151 1014988972 /nfs/dbraw/zinc/98/89/72/1014988972.db2.gz HINNZPGHOIZYCI-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000430211151 1014988986 /nfs/dbraw/zinc/98/89/86/1014988986.db2.gz HINNZPGHOIZYCI-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1cccc(O)c1 ZINC000430212114 1015007504 /nfs/dbraw/zinc/00/75/04/1015007504.db2.gz ZKFPKLJJSGXFFL-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1cccc(O)c1 ZINC000430212114 1015007517 /nfs/dbraw/zinc/00/75/17/1015007517.db2.gz ZKFPKLJJSGXFFL-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000430221112 1015079220 /nfs/dbraw/zinc/07/92/20/1015079220.db2.gz BQFXFIMSGJABLA-UHFFFAOYSA-N 1 1 348.443 3.917 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc([C@H]3CCC[N@H+]3C3CCCC3)n2)c1 ZINC000275420256 1016733513 /nfs/dbraw/zinc/73/35/13/1016733513.db2.gz HHCPFBBMBUCEME-OAHLLOKOSA-N 1 1 328.372 3.724 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000175716534 1016898899 /nfs/dbraw/zinc/89/88/99/1016898899.db2.gz MRCVOGZYVBWHRL-HNNXBMFYSA-N 1 1 345.443 3.805 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000449453420 1032569788 /nfs/dbraw/zinc/56/97/88/1032569788.db2.gz MVZABNRCWVNIBJ-WZYPUGOLSA-N 1 1 330.428 3.624 20 5 EHBDMO CCc1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449497661 1032667696 /nfs/dbraw/zinc/66/76/96/1032667696.db2.gz IXXNZFDQZFXQIH-CQSZACIVSA-N 1 1 331.441 3.993 20 5 EHBDMO CCc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449497661 1032667706 /nfs/dbraw/zinc/66/77/06/1032667706.db2.gz IXXNZFDQZFXQIH-CQSZACIVSA-N 1 1 331.441 3.993 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cc4n(n3)CCCC4)C2)cc1 ZINC000593031036 1032668442 /nfs/dbraw/zinc/66/84/42/1032668442.db2.gz YEIRVDYBEWDSPZ-MRXNPFEDSA-N 1 1 340.427 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc4n(n3)CCCC4)C2)cc1 ZINC000593031036 1032668443 /nfs/dbraw/zinc/66/84/43/1032668443.db2.gz YEIRVDYBEWDSPZ-MRXNPFEDSA-N 1 1 340.427 3.507 20 5 EHBDMO COCc1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501945 1032677680 /nfs/dbraw/zinc/67/76/80/1032677680.db2.gz QNPANMIQKOLNCY-CQSZACIVSA-N 1 1 347.440 3.577 20 5 EHBDMO COCc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501945 1032677687 /nfs/dbraw/zinc/67/76/87/1032677687.db2.gz QNPANMIQKOLNCY-CQSZACIVSA-N 1 1 347.440 3.577 20 5 EHBDMO COCc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502976 1032684112 /nfs/dbraw/zinc/68/41/12/1032684112.db2.gz SKXOIUCLSDJHTH-OAHLLOKOSA-N 1 1 330.384 3.714 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449503710 1032686757 /nfs/dbraw/zinc/68/67/57/1032686757.db2.gz POYAAWOOLDDRTH-SUMWQHHRSA-N 1 1 330.384 3.712 20 5 EHBDMO NC1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840525 1017232557 /nfs/dbraw/zinc/23/25/57/1017232557.db2.gz KLPJAGSMMDDKII-NVXWUHKLSA-N 1 1 331.460 3.557 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892730068 1017240473 /nfs/dbraw/zinc/24/04/73/1017240473.db2.gz DLCPEHQSPLDYCW-GFCCVEGCSA-N 1 1 348.834 3.574 20 5 EHBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(-c2ccccc2)cc1 ZINC000341073503 1018384785 /nfs/dbraw/zinc/38/47/85/1018384785.db2.gz VPDGAVZSKZWVJG-CQSZACIVSA-N 1 1 336.395 3.846 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CCO)c1ccccc1F ZINC000592402407 1032798105 /nfs/dbraw/zinc/79/81/05/1032798105.db2.gz GSWLBVZOKMYWAF-FZKQIMNGSA-N 1 1 332.375 3.817 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637261 1019011281 /nfs/dbraw/zinc/01/12/81/1019011281.db2.gz SHBRLPZFBRZXLD-VQIMIIECSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000379637261 1019011295 /nfs/dbraw/zinc/01/12/95/1019011295.db2.gz SHBRLPZFBRZXLD-VQIMIIECSA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@H]1C ZINC000419379863 1019012244 /nfs/dbraw/zinc/01/22/44/1019012244.db2.gz XEZWWNMHLYQYCG-RDBSUJKOSA-N 1 1 329.400 3.769 20 5 EHBDMO CN(C(=O)C[N@H+]1CCC[C@H](C(C)(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC001167405763 1019425113 /nfs/dbraw/zinc/42/51/13/1019425113.db2.gz JYBFXFOQKMKBMZ-HNNXBMFYSA-N 1 1 347.459 3.706 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nccnc2c1 ZINC000602438603 1032889684 /nfs/dbraw/zinc/88/96/84/1032889684.db2.gz GIAJZBMHPDHUOC-UHFFFAOYSA-N 1 1 336.395 3.949 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000084137793 1021005927 /nfs/dbraw/zinc/00/59/27/1021005927.db2.gz KDVQNXBEHYIRIR-UHFFFAOYSA-N 1 1 332.322 3.638 20 5 EHBDMO Cc1ncsc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602539680 1032953445 /nfs/dbraw/zinc/95/34/45/1032953445.db2.gz HIWVFBMQZCUPAG-UHFFFAOYSA-N 1 1 331.319 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CO)CC3)s2)cc1 ZINC000581599302 1021132535 /nfs/dbraw/zinc/13/25/35/1021132535.db2.gz ZUTQKCNKURPPEE-AWEZNQCLSA-N 1 1 346.452 3.918 20 5 EHBDMO CC[N@@H+](CCC1CC1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000546230112 1021379312 /nfs/dbraw/zinc/37/93/12/1021379312.db2.gz SSKWKZUPDRIBKM-LLVKDONJSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000506755388 1021942992 /nfs/dbraw/zinc/94/29/92/1021942992.db2.gz DVSZWQKGIGDTIB-UHFFFAOYSA-N 1 1 338.367 3.670 20 5 EHBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613101 1033029992 /nfs/dbraw/zinc/02/99/92/1033029992.db2.gz OVUPSKDMDRLDTL-BLLLJJGKSA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613101 1033030003 /nfs/dbraw/zinc/03/00/03/1033030003.db2.gz OVUPSKDMDRLDTL-BLLLJJGKSA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cccc(Cl)c1 ZINC000016632095 1033031186 /nfs/dbraw/zinc/03/11/86/1033031186.db2.gz RFTYQXBHGGCFGC-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000016632095 1033031198 /nfs/dbraw/zinc/03/11/98/1033031198.db2.gz RFTYQXBHGGCFGC-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000187517788 1022277655 /nfs/dbraw/zinc/27/76/55/1022277655.db2.gz ILFORVQHCLXOQP-AWEZNQCLSA-N 1 1 328.416 3.617 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468225 1033054406 /nfs/dbraw/zinc/05/44/06/1033054406.db2.gz UUHSYJINJVXCEZ-WCQYABFASA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccccc1[N+](=O)[O-] ZINC000303804917 1022511509 /nfs/dbraw/zinc/51/15/09/1022511509.db2.gz HKEQZMYNLDXXGI-MRXNPFEDSA-N 1 1 325.412 3.696 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000441433476 1022587357 /nfs/dbraw/zinc/58/73/57/1022587357.db2.gz GPAOPVDDPSRWHO-LJQANCHMSA-N 1 1 348.443 3.787 20 5 EHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccnc1 ZINC000602668896 1033067665 /nfs/dbraw/zinc/06/76/65/1033067665.db2.gz VHLGIAWDNMKPOQ-GFCCVEGCSA-N 1 1 326.356 3.714 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccnc1 ZINC000602668896 1033067673 /nfs/dbraw/zinc/06/76/73/1033067673.db2.gz VHLGIAWDNMKPOQ-GFCCVEGCSA-N 1 1 326.356 3.714 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccsc2Br)cc1 ZINC000337865139 1022867358 /nfs/dbraw/zinc/86/73/58/1022867358.db2.gz NVSVJTBFSYQWHI-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO C[NH+](C)[C@H](CNCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000060774003 1022913364 /nfs/dbraw/zinc/91/33/64/1022913364.db2.gz AEIJURWKNADNGA-QGZVFWFLSA-N 1 1 333.819 3.641 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@]1(CO)CCCc2ccccc21 ZINC000440481068 1023031507 /nfs/dbraw/zinc/03/15/07/1023031507.db2.gz MBIHHQQWPOBPGC-GOSISDBHSA-N 1 1 346.814 3.562 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761042715 1033102980 /nfs/dbraw/zinc/10/29/80/1033102980.db2.gz QLMINZSUNUBBBN-GFCCVEGCSA-N 1 1 332.322 3.766 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761042715 1033102988 /nfs/dbraw/zinc/10/29/88/1033102988.db2.gz QLMINZSUNUBBBN-GFCCVEGCSA-N 1 1 332.322 3.766 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002494 1023098182 /nfs/dbraw/zinc/09/81/82/1023098182.db2.gz ZFKSRTKKPUJPJE-MRXNPFEDSA-N 1 1 344.436 3.936 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310201109 1023103886 /nfs/dbraw/zinc/10/38/86/1023103886.db2.gz SIMCCXTVQDBFQW-CYBMUJFWSA-N 1 1 333.338 3.559 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cc(C3CC3)ccc2F)cc1[N+](=O)[O-] ZINC000295202813 1023188057 /nfs/dbraw/zinc/18/80/57/1023188057.db2.gz YXRIIXVQAAAQEK-UHFFFAOYSA-N 1 1 330.359 3.910 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729738 1033117353 /nfs/dbraw/zinc/11/73/53/1033117353.db2.gz CAHQMEWWSUYBLG-MJGOQNOKSA-N 1 1 326.396 3.601 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276872536 1023270987 /nfs/dbraw/zinc/27/09/87/1023270987.db2.gz HRCDZQIRSLRSLG-KRWDZBQOSA-N 1 1 344.411 3.549 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000277100781 1023763155 /nfs/dbraw/zinc/76/31/55/1023763155.db2.gz VELJVULTMBXKHZ-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO CO[C@@H](C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000514078274 1024108587 /nfs/dbraw/zinc/10/85/87/1024108587.db2.gz IRMHRCOOWJIESN-SFHVURJKSA-N 1 1 346.814 3.994 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000611252208 1024322265 /nfs/dbraw/zinc/32/22/65/1024322265.db2.gz OLPXBTQRGJNIDE-SOFGYWHQSA-N 1 1 342.395 3.757 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000430112703 1024381489 /nfs/dbraw/zinc/38/14/89/1024381489.db2.gz DZMVXDRVKUWYJT-PMAWGNDNSA-N 1 1 343.471 3.660 20 5 EHBDMO COCC[N@@H+](C)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000505585141 1024548539 /nfs/dbraw/zinc/54/85/39/1024548539.db2.gz LJTSTDVQPSBZJL-LJQANCHMSA-N 1 1 343.427 3.716 20 5 EHBDMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368574 1024882070 /nfs/dbraw/zinc/88/20/70/1024882070.db2.gz FDTPUMWNZKDBSX-SFHVURJKSA-N 1 1 330.428 3.684 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])C1 ZINC000071954823 1024884753 /nfs/dbraw/zinc/88/47/53/1024884753.db2.gz LAUVKELLUGVSFX-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO Nc1c(F)c(NC[C@@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435591228 1025022647 /nfs/dbraw/zinc/02/26/47/1025022647.db2.gz DABCVGSRMJOLCH-ZDUSSCGKSA-N 1 1 336.411 3.525 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039194 1025073445 /nfs/dbraw/zinc/07/34/45/1025073445.db2.gz CNZJESPUWZGWOK-HOCLYGCPSA-N 1 1 347.459 3.693 20 5 EHBDMO COc1cc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000185479665 1025183149 /nfs/dbraw/zinc/18/31/49/1025183149.db2.gz LJENOLWDBIZPCJ-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174814 1025248088 /nfs/dbraw/zinc/24/80/88/1025248088.db2.gz MXGLGVITLYKVHV-MRXNPFEDSA-N 1 1 333.476 3.893 20 5 EHBDMO CC[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174814 1025248100 /nfs/dbraw/zinc/24/81/00/1025248100.db2.gz MXGLGVITLYKVHV-MRXNPFEDSA-N 1 1 333.476 3.893 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccco2)n1 ZINC000511083179 1025408632 /nfs/dbraw/zinc/40/86/32/1025408632.db2.gz XKGONHZOXLLTNA-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccco2)n1 ZINC000511083179 1025408640 /nfs/dbraw/zinc/40/86/40/1025408640.db2.gz XKGONHZOXLLTNA-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO Cc1ccccc1[C@@H]([C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000442998374 1025639355 /nfs/dbraw/zinc/63/93/55/1025639355.db2.gz IZQFPNYHRGZZBV-AUUYWEPGSA-N 1 1 345.418 3.823 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425557012 1025725355 /nfs/dbraw/zinc/72/53/55/1025725355.db2.gz VNOWHFQQZBIYKM-KDOFPFPSSA-N 1 1 330.428 3.937 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)c(F)c1 ZINC000505838244 1025806283 /nfs/dbraw/zinc/80/62/83/1025806283.db2.gz HOOFGXBYCIZNGD-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c(F)c1 ZINC000505838244 1025806300 /nfs/dbraw/zinc/80/63/00/1025806300.db2.gz HOOFGXBYCIZNGD-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCO[C@@H]3CCCCO3)C2)cc1 ZINC000451550476 1026102537 /nfs/dbraw/zinc/10/25/37/1026102537.db2.gz RWDMXBSULQQXDV-IEBWSBKVSA-N 1 1 348.443 3.708 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])nc1 ZINC000339029422 1026355341 /nfs/dbraw/zinc/35/53/41/1026355341.db2.gz LDKPVVDMGKQMNK-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C(C)C)C1CC(C)(C)C1 ZINC000452102636 1026497000 /nfs/dbraw/zinc/49/70/00/1026497000.db2.gz IORCYVBQAORZIL-UHFFFAOYSA-N 1 1 333.432 3.741 20 5 EHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000531105060 1026572247 /nfs/dbraw/zinc/57/22/47/1026572247.db2.gz KUZVLGIOOKZOHT-INIZCTEOSA-N 1 1 334.441 3.736 20 5 EHBDMO CCC(C)(C)[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000548755529 1027015723 /nfs/dbraw/zinc/01/57/23/1027015723.db2.gz JQFSPDBZNQVCCP-UHFFFAOYSA-N 1 1 332.347 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c2cccnc21 ZINC000413151966 1027135744 /nfs/dbraw/zinc/13/57/44/1027135744.db2.gz HABJKBDFTLEBGS-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO Cc1c(NC(=O)NCCC[N@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000501584187 1027372320 /nfs/dbraw/zinc/37/23/20/1027372320.db2.gz XIWZXYZQZXJZRS-UHFFFAOYSA-N 1 1 348.447 3.679 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000024203558 1027571182 /nfs/dbraw/zinc/57/11/82/1027571182.db2.gz MGCKLVQKFOSAGG-UHFFFAOYSA-N 1 1 340.358 3.633 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@H](Oc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001225611866 1027633505 /nfs/dbraw/zinc/63/35/05/1027633505.db2.gz XSDBUHHNNCRWAU-NSHDSACASA-N 1 1 343.221 3.609 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](Oc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001225611866 1027633516 /nfs/dbraw/zinc/63/35/16/1027633516.db2.gz XSDBUHHNNCRWAU-NSHDSACASA-N 1 1 343.221 3.609 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@@H]1C ZINC000444676938 1028145474 /nfs/dbraw/zinc/14/54/74/1028145474.db2.gz OUDUGSSSDXMYDO-GUYCJALGSA-N 1 1 334.416 3.862 20 5 EHBDMO Cc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000444739558 1028225337 /nfs/dbraw/zinc/22/53/37/1028225337.db2.gz RXFXMPQEBAGLTH-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000444739558 1028225350 /nfs/dbraw/zinc/22/53/50/1028225350.db2.gz RXFXMPQEBAGLTH-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764444 1028251279 /nfs/dbraw/zinc/25/12/79/1028251279.db2.gz BESVWZLVJPCVKH-SFHVURJKSA-N 1 1 336.432 3.509 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613179308 1028578168 /nfs/dbraw/zinc/57/81/68/1028578168.db2.gz SLKYQLLHTDNKSB-WBVHZDCISA-N 1 1 325.412 3.924 20 5 EHBDMO CN(C(=O)C[N@@H+](CC1CC1)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000533276130 1029556356 /nfs/dbraw/zinc/55/63/56/1029556356.db2.gz MIOKWMBJUILOBS-UHFFFAOYSA-N 1 1 345.443 3.602 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288260 1029580609 /nfs/dbraw/zinc/58/06/09/1029580609.db2.gz WUFPQVPSYZPABD-JSGCOSHPSA-N 1 1 333.432 3.741 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)CCC[C@H]1C ZINC000533293610 1029587285 /nfs/dbraw/zinc/58/72/85/1029587285.db2.gz WASKHZUVYVWYTL-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000525121299 1029693077 /nfs/dbraw/zinc/69/30/77/1029693077.db2.gz FYBMBCMPMYTQHM-KRWDZBQOSA-N 1 1 326.396 3.538 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCC[C@H]1O ZINC000428456271 1029834322 /nfs/dbraw/zinc/83/43/22/1029834322.db2.gz IAHXXBYFHWJHKE-IAGOWNOFSA-N 1 1 330.384 3.590 20 5 EHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525410914 1029840450 /nfs/dbraw/zinc/84/04/50/1029840450.db2.gz PNTGINFIEMKSLV-KBAYOESNSA-N 1 1 348.443 3.629 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367733 1030183025 /nfs/dbraw/zinc/18/30/25/1030183025.db2.gz MKRZPQMBHNLCGY-ILZDJORESA-N 1 1 344.455 3.809 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000052510339 1030432294 /nfs/dbraw/zinc/43/22/94/1030432294.db2.gz ZJQVTUNYOXAQEI-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO Cn1nccc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000171049765 1030546019 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3.602 20 5 EHBDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343458383 1030974582 /nfs/dbraw/zinc/97/45/82/1030974582.db2.gz CRRKQLGESBGNNC-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368402 1031017818 /nfs/dbraw/zinc/01/78/18/1031017818.db2.gz UUHUZWZUHKMIIL-CABCVRRESA-N 1 1 344.411 3.980 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000063551553 1033447119 /nfs/dbraw/zinc/44/71/19/1033447119.db2.gz MEIGGUNSUAUMTD-SFHVURJKSA-N 1 1 345.443 3.886 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000595042571 1033659846 /nfs/dbraw/zinc/65/98/46/1033659846.db2.gz AMMSCGCNPPPKCZ-SJKOYZFVSA-N 1 1 328.368 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000173985906 1033664018 /nfs/dbraw/zinc/66/40/18/1033664018.db2.gz HECFSHWGWYJIHU-INIZCTEOSA-N 1 1 344.386 3.773 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CCCC[N@H+]2C2CC2)ccc2cnccc21 ZINC000599072320 1033713974 /nfs/dbraw/zinc/71/39/74/1033713974.db2.gz BVQCUCOPMPAYTG-HNNXBMFYSA-N 1 1 326.400 3.572 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599074507 1033718023 /nfs/dbraw/zinc/71/80/23/1033718023.db2.gz SWWDEZRYOIBCJQ-QAPCUYQASA-N 1 1 340.427 3.754 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000595297391 1033722093 /nfs/dbraw/zinc/72/20/93/1033722093.db2.gz FCHMUUYWGIAZSB-MRXNPFEDSA-N 1 1 329.400 3.654 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)c2ncccc12 ZINC000599164091 1033779744 /nfs/dbraw/zinc/77/97/44/1033779744.db2.gz JLABLQRTNPNSKM-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000595430830 1033799414 /nfs/dbraw/zinc/79/94/14/1033799414.db2.gz ORJRDLRWMDTXPK-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000595430830 1033799432 /nfs/dbraw/zinc/79/94/32/1033799432.db2.gz ORJRDLRWMDTXPK-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)C1 ZINC000046934148 1033893699 /nfs/dbraw/zinc/89/36/99/1033893699.db2.gz YTTKYRGZUUVAED-ZDUSSCGKSA-N 1 1 343.383 3.672 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccsc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000595599762 1033916135 /nfs/dbraw/zinc/91/61/35/1033916135.db2.gz BWIYAVMPKCMCPL-UHFFFAOYSA-N 1 1 347.440 3.556 20 5 EHBDMO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000595599762 1033916148 /nfs/dbraw/zinc/91/61/48/1033916148.db2.gz BWIYAVMPKCMCPL-UHFFFAOYSA-N 1 1 347.440 3.556 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000603836727 1033961303 /nfs/dbraw/zinc/96/13/03/1033961303.db2.gz OEIAEDDIYKNPTI-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])C1 ZINC000603859506 1033986038 /nfs/dbraw/zinc/98/60/38/1033986038.db2.gz FVDLNYXLOGYQFE-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000603867319 1033993142 /nfs/dbraw/zinc/99/31/42/1033993142.db2.gz KTTHHODWFGWYMR-IBGZPJMESA-N 1 1 326.396 3.983 20 5 EHBDMO COc1cccc(C2([NH2+]Cc3c(F)cccc3[N+](=O)[O-])CCC2)c1 ZINC000595859828 1034009411 /nfs/dbraw/zinc/00/94/11/1034009411.db2.gz NJVWYWOONOSTDZ-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CO)c1ccc(F)cc1F ZINC000595867410 1034012763 /nfs/dbraw/zinc/01/27/63/1034012763.db2.gz MVPSVXFMKDUUEL-APPDUMDISA-N 1 1 336.338 3.566 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000603905618 1034025249 /nfs/dbraw/zinc/02/52/49/1034025249.db2.gz JRYAVEBKPNFMDJ-NXHRZFHOSA-N 1 1 337.423 3.724 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC4CC3(c3ccccc3)C4)nc2c1 ZINC000595910842 1034027974 /nfs/dbraw/zinc/02/79/74/1034027974.db2.gz YIOSPTGJPFOMGW-UHFFFAOYSA-N 1 1 334.379 3.592 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC4CC3(c3ccccc3)C4)nc2c1 ZINC000595910842 1034027987 /nfs/dbraw/zinc/02/79/87/1034027987.db2.gz YIOSPTGJPFOMGW-UHFFFAOYSA-N 1 1 334.379 3.592 20 5 EHBDMO O=[N+]([O-])c1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1C(F)(F)F ZINC000596082050 1034074396 /nfs/dbraw/zinc/07/43/96/1034074396.db2.gz FIWGYAYUNMGDTK-RYUDHWBXSA-N 1 1 329.322 3.652 20 5 EHBDMO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093693 1034078881 /nfs/dbraw/zinc/07/88/81/1034078881.db2.gz DPIRGJCUGCTNFT-NVXWUHKLSA-N 1 1 331.460 3.676 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690699 1034096276 /nfs/dbraw/zinc/09/62/76/1034096276.db2.gz PGUAFRYWOSCHOY-HSWBROFVSA-N 1 1 342.399 3.823 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691150 1034096331 /nfs/dbraw/zinc/09/63/31/1034096331.db2.gz QSLZBPZLRWGHBB-SFAKSCPVSA-N 1 1 342.399 3.823 20 5 EHBDMO COc1ccc([C@@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1F ZINC000599679751 1034110195 /nfs/dbraw/zinc/11/01/95/1034110195.db2.gz OGVWQRBXDGADIA-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1F ZINC000599679751 1034110203 /nfs/dbraw/zinc/11/02/03/1034110203.db2.gz OGVWQRBXDGADIA-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000604012565 1034135541 /nfs/dbraw/zinc/13/55/41/1034135541.db2.gz QDMNZCXPSCWWHS-IBGZPJMESA-N 1 1 326.396 3.983 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141114 1034145514 /nfs/dbraw/zinc/14/55/14/1034145514.db2.gz BKZIGRNOIQSMRG-NFBGWVBBSA-N 1 1 344.333 3.651 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141114 1034145527 /nfs/dbraw/zinc/14/55/27/1034145527.db2.gz BKZIGRNOIQSMRG-NFBGWVBBSA-N 1 1 344.333 3.651 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000596308793 1034162046 /nfs/dbraw/zinc/16/20/46/1034162046.db2.gz VGYMOKPSNZQJMT-CYBMUJFWSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000596307368 1034162839 /nfs/dbraw/zinc/16/28/39/1034162839.db2.gz LHXKNXWFJWTTEU-CYBMUJFWSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620059 1034197000 /nfs/dbraw/zinc/19/70/00/1034197000.db2.gz OTKPILRHYDIZJA-HNNXBMFYSA-N 1 1 328.412 3.914 20 5 EHBDMO COCc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000179520729 1034467541 /nfs/dbraw/zinc/46/75/41/1034467541.db2.gz SXQKLUBFSBILGN-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)s1 ZINC000597231199 1034613625 /nfs/dbraw/zinc/61/36/25/1034613625.db2.gz OHBOIKSYPMEDCS-KBPBESRZSA-N 1 1 344.436 3.792 20 5 EHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1=CC[N@@H+](C)CC1 ZINC000511367841 1035181889 /nfs/dbraw/zinc/18/18/89/1035181889.db2.gz ADKQOYVNDUFAFY-SNVBAGLBSA-N 1 1 329.322 3.676 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CN(C)C)c1ccc(Cl)cc1 ZINC000548991602 1035405179 /nfs/dbraw/zinc/40/51/79/1035405179.db2.gz KFOLMEAFDBFBQY-SFHVURJKSA-N 1 1 347.846 3.949 20 5 EHBDMO CC[C@@H](C)[N@@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592926 1035650007 /nfs/dbraw/zinc/65/00/07/1035650007.db2.gz KXJKTUIYUOBWSH-SNVBAGLBSA-N 1 1 332.347 3.825 20 5 EHBDMO CCOc1cc(C[N@H+](C)Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492355483 1035691910 /nfs/dbraw/zinc/69/19/10/1035691910.db2.gz HITLMSQBCGFKIB-UHFFFAOYSA-N 1 1 336.338 3.904 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492355483 1035691921 /nfs/dbraw/zinc/69/19/21/1035691921.db2.gz HITLMSQBCGFKIB-UHFFFAOYSA-N 1 1 336.338 3.904 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000463967295 1036014531 /nfs/dbraw/zinc/01/45/31/1036014531.db2.gz WJAGQGAEVONHBZ-OAHLLOKOSA-N 1 1 348.447 3.598 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200170 1036306929 /nfs/dbraw/zinc/30/69/29/1036306929.db2.gz VQUVAWFZZFZSGV-GGVHLCNSSA-N 1 1 330.428 3.747 20 5 EHBDMO CSc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000589495901 1036437735 /nfs/dbraw/zinc/43/77/35/1036437735.db2.gz JJEDFCHSUNLBJW-UHFFFAOYSA-N 1 1 349.481 3.700 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@H]1c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000026231490 1036443196 /nfs/dbraw/zinc/44/31/96/1036443196.db2.gz SGDPODCFBIMYLW-HNNXBMFYSA-N 1 1 345.424 3.822 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1csnn1 ZINC000414295547 1036507992 /nfs/dbraw/zinc/50/79/92/1036507992.db2.gz FLEAVQOKEQGDGR-QWRGUYRKSA-N 1 1 338.458 3.668 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000557522251 1036677737 /nfs/dbraw/zinc/67/77/37/1036677737.db2.gz SFHCMVZBNGOKTR-SECBINFHSA-N 1 1 330.215 3.798 20 5 EHBDMO CCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000590155834 1036777945 /nfs/dbraw/zinc/77/79/45/1036777945.db2.gz DUMMZANFKNUDAJ-UHFFFAOYSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1)N(C)C ZINC000443012252 1036794367 /nfs/dbraw/zinc/79/43/67/1036794367.db2.gz IQYHPLFWDOGUSL-GUYCJALGSA-N 1 1 333.457 3.746 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000464838373 1036853878 /nfs/dbraw/zinc/85/38/78/1036853878.db2.gz VLLSUFCBEVSJAC-KXBFYZLASA-N 1 1 326.396 3.599 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000464842665 1036878430 /nfs/dbraw/zinc/87/84/30/1036878430.db2.gz KGIZDQKFFCSGJJ-SFHVURJKSA-N 1 1 333.432 3.826 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@@H](C)C1 ZINC000443663763 1036976018 /nfs/dbraw/zinc/97/60/18/1036976018.db2.gz YVLVVXCRERNYMZ-UONOGXRCSA-N 1 1 333.432 3.600 20 5 EHBDMO CC1(C)COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000511509214 1037060481 /nfs/dbraw/zinc/06/04/81/1037060481.db2.gz VOQUZYSWFBBULE-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CC1(C)COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000511509214 1037060494 /nfs/dbraw/zinc/06/04/94/1037060494.db2.gz VOQUZYSWFBBULE-UHFFFAOYSA-N 1 1 332.425 3.934 20 5 EHBDMO CCOc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)ccc1[N+](=O)[O-] ZINC000470950062 1037132439 /nfs/dbraw/zinc/13/24/39/1037132439.db2.gz YPKAFEBOSXHPKI-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)ccc1[N+](=O)[O-] ZINC000470950062 1037132448 /nfs/dbraw/zinc/13/24/48/1037132448.db2.gz YPKAFEBOSXHPKI-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2OC)cc1[N+](=O)[O-] ZINC000188779293 1037245711 /nfs/dbraw/zinc/24/57/11/1037245711.db2.gz DIRKXTDRARJQON-STQMWFEESA-N 1 1 345.399 3.809 20 5 EHBDMO COc1ccc2oc(C[N@@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2c1 ZINC000539829669 1037255043 /nfs/dbraw/zinc/25/50/43/1037255043.db2.gz UDCPMKNDTHDVFM-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO COc1ccc2oc(C[N@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2c1 ZINC000539829669 1037255053 /nfs/dbraw/zinc/25/50/53/1037255053.db2.gz UDCPMKNDTHDVFM-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+](C)CC(C)(C)OC)o2)c([N+](=O)[O-])c1 ZINC000539927306 1037366479 /nfs/dbraw/zinc/36/64/79/1037366479.db2.gz MSYMWGYNPAVUEP-UHFFFAOYSA-N 1 1 348.399 3.720 20 5 EHBDMO Cc1c(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cnn1C ZINC000181026888 1037398232 /nfs/dbraw/zinc/39/82/32/1037398232.db2.gz VHMZEZOHVWKKTQ-IBGZPJMESA-N 1 1 336.395 3.516 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000462862128 1037487513 /nfs/dbraw/zinc/48/75/13/1037487513.db2.gz LMAQECXBLITDOQ-AAEUAGOBSA-N 1 1 345.365 3.780 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000532489210 1037527369 /nfs/dbraw/zinc/52/73/69/1037527369.db2.gz KAFPBFAMFHJHPD-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000532489210 1037527383 /nfs/dbraw/zinc/52/73/83/1037527383.db2.gz KAFPBFAMFHJHPD-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790587 1037538555 /nfs/dbraw/zinc/53/85/55/1037538555.db2.gz PFZNVOGXPLJXBL-GLJUWKHASA-N 1 1 344.411 3.836 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000463009651 1037643081 /nfs/dbraw/zinc/64/30/81/1037643081.db2.gz LUUMUOXDEQYGGJ-OAHLLOKOSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000463051946 1037702968 /nfs/dbraw/zinc/70/29/68/1037702968.db2.gz GEIYGLTWTPCUBT-HNNXBMFYSA-N 1 1 345.468 3.844 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000341220460 1037783645 /nfs/dbraw/zinc/78/36/45/1037783645.db2.gz NDARNKACNAVDPM-NSHDSACASA-N 1 1 327.340 3.595 20 5 EHBDMO C[C@@H]1C[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730126 1038497159 /nfs/dbraw/zinc/49/71/59/1038497159.db2.gz IGCPDLKCHAJVQI-GFCCVEGCSA-N 1 1 349.818 3.644 20 5 EHBDMO C[C@@H]1CN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730126 1038497171 /nfs/dbraw/zinc/49/71/71/1038497171.db2.gz IGCPDLKCHAJVQI-GFCCVEGCSA-N 1 1 349.818 3.644 20 5 EHBDMO C[C@@H]1CN(C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730126 1038497178 /nfs/dbraw/zinc/49/71/78/1038497178.db2.gz IGCPDLKCHAJVQI-GFCCVEGCSA-N 1 1 349.818 3.644 20 5 EHBDMO C/C(=C\c1ccccc1)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737320 1038500769 /nfs/dbraw/zinc/50/07/69/1038500769.db2.gz VVQCPKXQVUSWFV-JMPLCFMRSA-N 1 1 338.411 3.580 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777580 1038603637 /nfs/dbraw/zinc/60/36/37/1038603637.db2.gz GAZOAXQHFAARTN-JTQLQIEISA-N 1 1 329.322 3.571 20 5 EHBDMO Cc1cc(N[C@H]2CCn3cc[nH+]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461932014 1038680778 /nfs/dbraw/zinc/68/07/78/1038680778.db2.gz APEUBZJHUONCMI-JTQLQIEISA-N 1 1 340.305 3.545 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2c(c(Cl)c1)OCO2 ZINC000552142444 1039021043 /nfs/dbraw/zinc/02/10/43/1039021043.db2.gz FOKNMMYHHIHIHX-UHFFFAOYSA-N 1 1 348.786 3.651 20 5 EHBDMO CC[NH+](CC)[C@@H](CNCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000236848826 1039046508 /nfs/dbraw/zinc/04/65/08/1039046508.db2.gz MLOKIEYPTBOQRI-IBGZPJMESA-N 1 1 327.428 3.768 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000478012754 1039117808 /nfs/dbraw/zinc/11/78/08/1039117808.db2.gz BUIPEOWQQPTXDH-UHFFFAOYSA-N 1 1 346.406 3.765 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@H](O)Cc1ccccc1 ZINC000552293347 1039164115 /nfs/dbraw/zinc/16/41/15/1039164115.db2.gz YZTYMNPUWAZWHW-TUOAVLBBSA-N 1 1 340.423 3.534 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000480505404 1039616142 /nfs/dbraw/zinc/61/61/42/1039616142.db2.gz MHUQWBVZLKEVKS-QGZVFWFLSA-N 1 1 340.427 3.541 20 5 EHBDMO Cc1cc(NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000480500570 1039625850 /nfs/dbraw/zinc/62/58/50/1039625850.db2.gz LEZCPHOJSCMCQO-SFHVURJKSA-N 1 1 340.427 3.621 20 5 EHBDMO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000489256469 1039777552 /nfs/dbraw/zinc/77/75/52/1039777552.db2.gz SMBVFGYWMZUVRJ-ZDUSSCGKSA-N 1 1 328.368 3.574 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000489256469 1039777565 /nfs/dbraw/zinc/77/75/65/1039777565.db2.gz SMBVFGYWMZUVRJ-ZDUSSCGKSA-N 1 1 328.368 3.574 20 5 EHBDMO COc1cccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192953282 1040159469 /nfs/dbraw/zinc/15/94/69/1040159469.db2.gz GVZBZLREKJGBJR-INIZCTEOSA-N 1 1 341.411 3.537 20 5 EHBDMO CCC(=O)c1ccc(NCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000479362948 1040183571 /nfs/dbraw/zinc/18/35/71/1040183571.db2.gz FMDFIRONJLCVAO-UHFFFAOYSA-N 1 1 341.411 3.731 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1cccc(O)c1 ZINC000490065042 1040331411 /nfs/dbraw/zinc/33/14/11/1040331411.db2.gz DGKNWTAUYQUIJC-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO C[C@H]1C[C@@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@H+]1Cc1ccccc1 ZINC000511649211 1040399673 /nfs/dbraw/zinc/39/96/73/1040399673.db2.gz WCRKZIVYPNTJCS-DOTOQJQBSA-N 1 1 340.427 3.702 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000092626527 1040457998 /nfs/dbraw/zinc/45/79/98/1040457998.db2.gz RHJIZPGORRXMRC-LBPRGKRZSA-N 1 1 343.374 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc(C4CC4)o3)C2)cc1 ZINC000600170021 1040756289 /nfs/dbraw/zinc/75/62/89/1040756289.db2.gz VIGNWJSKSUVHCU-HNNXBMFYSA-N 1 1 327.384 3.840 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837881 1041685116 /nfs/dbraw/zinc/68/51/16/1041685116.db2.gz JZMPEAWVCHWUJS-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837881 1041685119 /nfs/dbraw/zinc/68/51/19/1041685119.db2.gz JZMPEAWVCHWUJS-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837883 1041685171 /nfs/dbraw/zinc/68/51/71/1041685171.db2.gz JZMPEAWVCHWUJS-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837883 1041685175 /nfs/dbraw/zinc/68/51/75/1041685175.db2.gz JZMPEAWVCHWUJS-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO CCN(CC)[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000236871537 1042108587 /nfs/dbraw/zinc/10/85/87/1042108587.db2.gz IAFYEEBEPXGKEN-CQSZACIVSA-N 1 1 331.416 3.675 20 5 EHBDMO Cc1[nH+]c(N)ccc1CNc1nc(-c2ccccc2)ccc1[N+](=O)[O-] ZINC001167784655 1042403014 /nfs/dbraw/zinc/40/30/14/1042403014.db2.gz AETLHZLKLLBTHY-UHFFFAOYSA-N 1 1 335.367 3.555 20 5 EHBDMO CSC[C@@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000093760903 1042485872 /nfs/dbraw/zinc/48/58/72/1042485872.db2.gz YSXMIDOAWLVEOR-NSHDSACASA-N 1 1 345.262 3.685 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000093760903 1042485874 /nfs/dbraw/zinc/48/58/74/1042485874.db2.gz YSXMIDOAWLVEOR-NSHDSACASA-N 1 1 345.262 3.685 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000481763714 1042819770 /nfs/dbraw/zinc/81/97/70/1042819770.db2.gz ONNGHFDZOMRNFU-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000481763714 1042819776 /nfs/dbraw/zinc/81/97/76/1042819776.db2.gz ONNGHFDZOMRNFU-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO C[C@@H]1CCSCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549610229 1042835863 /nfs/dbraw/zinc/83/58/63/1042835863.db2.gz KAAAGISYQJWPTB-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@@H]1CCSCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549610229 1042835870 /nfs/dbraw/zinc/83/58/70/1042835870.db2.gz KAAAGISYQJWPTB-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000344030524 1043125001 /nfs/dbraw/zinc/12/50/01/1043125001.db2.gz BUJRFLLTAWBUPM-ZIAGYGMSSA-N 1 1 342.399 3.994 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCC[C@H](C)C1 ZINC000301382742 1127741172 /nfs/dbraw/zinc/74/11/72/1127741172.db2.gz VGTHVIIEVNFOKO-RYUDHWBXSA-N 1 1 343.374 3.729 20 5 EHBDMO CC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1C ZINC001307703131 1128455407 /nfs/dbraw/zinc/45/54/07/1128455407.db2.gz OMQOOHXQGCZZCN-GHMZBOCLSA-N 1 1 327.222 3.978 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 ZINC000301669341 1128872231 /nfs/dbraw/zinc/87/22/31/1128872231.db2.gz PTXJFOTWWXMCCT-GFCCVEGCSA-N 1 1 337.383 3.965 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(CC[NH+](C)C)CC1 ZINC000609203745 1120558702 /nfs/dbraw/zinc/55/87/02/1120558702.db2.gz QYLZTJBCYSOKLO-UHFFFAOYSA-N 1 1 349.475 3.546 20 5 EHBDMO Cn1cc([C@@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000494821120 1120868223 /nfs/dbraw/zinc/86/82/23/1120868223.db2.gz GHBWCWLNEMJRCY-OAHLLOKOSA-N 1 1 336.823 3.859 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)CCc1ccccc1 ZINC000542519350 1120885271 /nfs/dbraw/zinc/88/52/71/1120885271.db2.gz ROPJHBHQIWMFHB-HXUWFJFHSA-N 1 1 342.439 3.799 20 5 EHBDMO Cc1nn(C[N@H+](CC(C)C)CC(C)(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000761830875 1120975404 /nfs/dbraw/zinc/97/54/04/1120975404.db2.gz KJFFFEAIFCBIOB-UHFFFAOYSA-N 1 1 333.436 3.610 20 5 EHBDMO COc1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000112978556 1128963678 /nfs/dbraw/zinc/96/36/78/1128963678.db2.gz BYBZLDGDOSISDW-UHFFFAOYSA-N 1 1 342.395 3.721 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000301075502 1121359433 /nfs/dbraw/zinc/35/94/33/1121359433.db2.gz FCUUQZBLNYAFTN-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000301088569 1121539429 /nfs/dbraw/zinc/53/94/29/1121539429.db2.gz MRDZMHOJCXBRJY-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000917088570 1122486466 /nfs/dbraw/zinc/48/64/66/1122486466.db2.gz MLZZWMVMMTVTQC-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000556896395 1123173337 /nfs/dbraw/zinc/17/33/37/1123173337.db2.gz VWVFKWYFGVRFAG-NXHRZFHOSA-N 1 1 332.444 3.929 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000609489645 1123591280 /nfs/dbraw/zinc/59/12/80/1123591280.db2.gz XLDAFUBPWGBZHZ-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000609560436 1123609066 /nfs/dbraw/zinc/60/90/66/1123609066.db2.gz VLMOCUMZOCFUMD-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000609631773 1123634744 /nfs/dbraw/zinc/63/47/44/1123634744.db2.gz WFDQFRPVCDOBBW-NUEKZKHPSA-N 1 1 345.443 3.742 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@H]1c1ccccc1 ZINC000301823522 1129141036 /nfs/dbraw/zinc/14/10/36/1129141036.db2.gz CMIYZSKDHAOAIF-LSDHHAIUSA-N 1 1 332.791 3.501 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000255641247 1129169064 /nfs/dbraw/zinc/16/90/64/1129169064.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 1 1 341.455 3.557 20 5 EHBDMO C[C@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCCCCC1 ZINC000734779479 1131278032 /nfs/dbraw/zinc/27/80/32/1131278032.db2.gz FWYDZZXSPGCJIO-GFCCVEGCSA-N 1 1 340.807 3.556 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569538 1125363949 /nfs/dbraw/zinc/36/39/49/1125363949.db2.gz GGUGPPOWGDJJQL-JZGRTCEGSA-N 1 1 332.444 3.746 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920390 1129367944 /nfs/dbraw/zinc/36/79/44/1129367944.db2.gz DUNUAIVXJGJKQZ-VXGBXAGGSA-N 1 1 343.374 3.729 20 5 EHBDMO CCC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494519 1129492528 /nfs/dbraw/zinc/49/25/28/1129492528.db2.gz DFTCOBWYXOJIAK-HUUCEWRRSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301993134 1129509402 /nfs/dbraw/zinc/50/94/02/1129509402.db2.gz GRVFUSKWVFTLFV-LBPRGKRZSA-N 1 1 334.807 3.576 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092485398 1129548513 /nfs/dbraw/zinc/54/85/13/1129548513.db2.gz OHBGQELCUQLXGE-KDOFPFPSSA-N 1 1 340.427 3.760 20 5 EHBDMO Cc1cc(N[C@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555207673 1129577863 /nfs/dbraw/zinc/57/78/63/1129577863.db2.gz PGFMLQUCRBSJKQ-VIFPVBQESA-N 1 1 340.305 3.615 20 5 EHBDMO Cc1cc(N[C@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555207673 1129577866 /nfs/dbraw/zinc/57/78/66/1129577866.db2.gz PGFMLQUCRBSJKQ-VIFPVBQESA-N 1 1 340.305 3.615 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802847 1129590743 /nfs/dbraw/zinc/59/07/43/1129590743.db2.gz YFWXURGDCNIZEK-LRDDRELGSA-N 1 1 346.818 3.576 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CCOC4)C3)s2)cc1 ZINC000093820049 1129604912 /nfs/dbraw/zinc/60/49/12/1129604912.db2.gz FJYDYGYNCSNHLK-GOSISDBHSA-N 1 1 344.436 3.936 20 5 EHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000093870958 1129606624 /nfs/dbraw/zinc/60/66/24/1129606624.db2.gz IVSKNOBZTSCLSP-GFCCVEGCSA-N 1 1 342.461 3.576 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000330640048 1129642312 /nfs/dbraw/zinc/64/23/12/1129642312.db2.gz HLCAUZVKNFNEBD-WVCIDPQESA-N 1 1 347.459 3.575 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000331075868 1129652540 /nfs/dbraw/zinc/65/25/40/1129652540.db2.gz WDVWGTMYWVFDSU-GJZGRUSLSA-N 1 1 348.447 3.548 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000766027345 1129828313 /nfs/dbraw/zinc/82/83/13/1129828313.db2.gz GKDUOVRAZWLABT-UHFFFAOYSA-N 1 1 344.440 3.918 20 5 EHBDMO CCc1ccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429227863 1130090028 /nfs/dbraw/zinc/09/00/28/1130090028.db2.gz AMNNMYDIOOXBEN-UHFFFAOYSA-N 1 1 341.411 3.621 20 5 EHBDMO CC(C)CCC[C@H](C)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429227937 1130090648 /nfs/dbraw/zinc/09/06/48/1130090648.db2.gz QQSVHUMRYWIPPS-HNNXBMFYSA-N 1 1 349.475 3.751 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C(C)(C)c1ccccc1F ZINC000429234807 1130153514 /nfs/dbraw/zinc/15/35/14/1130153514.db2.gz CUFRCAOAAQHRPP-UHFFFAOYSA-N 1 1 345.374 3.506 20 5 EHBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987150 1130394724 /nfs/dbraw/zinc/39/47/24/1130394724.db2.gz ILYCMPHIXDWONU-KUHUBIRLSA-N 1 1 339.395 3.616 20 5 EHBDMO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCCC[C@@H]1C ZINC000731206205 1130779172 /nfs/dbraw/zinc/77/91/72/1130779172.db2.gz BHKMWMZJYNVBEX-RYUDHWBXSA-N 1 1 334.445 3.879 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794892 1131082745 /nfs/dbraw/zinc/08/27/45/1131082745.db2.gz HITFVLDUVBCBSW-HOTGVXAUSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@]4(CC=CCC4)C3)c2c1 ZINC000733991508 1131180065 /nfs/dbraw/zinc/18/00/65/1131180065.db2.gz FYUQSLQCDUYBOQ-SFHVURJKSA-N 1 1 326.400 3.724 20 5 EHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059328 1131462051 /nfs/dbraw/zinc/46/20/51/1131462051.db2.gz XKSQBTZGXBOLFE-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC(F)(F)[C@@H](F)C1)CC2 ZINC001172902668 1131885185 /nfs/dbraw/zinc/88/51/85/1131885185.db2.gz BNIHHPWTUTVLRW-ZFWWWQNUSA-N 1 1 328.334 3.521 20 5 EHBDMO O=C1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@@H]12 ZINC001172908395 1131887376 /nfs/dbraw/zinc/88/73/76/1131887376.db2.gz MDOITLZGSHBJDY-BHIYHBOVSA-N 1 1 342.439 3.676 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](C(F)(F)F)C1)CC2 ZINC001172914273 1131903024 /nfs/dbraw/zinc/90/30/24/1131903024.db2.gz GFDYQZACDTXDLG-KGLIPLIRSA-N 1 1 328.334 3.726 20 5 EHBDMO CC(C)[N@@H+](C1CCN(C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911753 1131917778 /nfs/dbraw/zinc/91/77/78/1131917778.db2.gz FRFPFYKIEAZMRD-GOSISDBHSA-N 1 1 345.487 3.647 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1F ZINC001173183477 1131993620 /nfs/dbraw/zinc/99/36/20/1131993620.db2.gz YTRTVRFUIPNBQQ-MCIONIFRSA-N 1 1 336.407 3.796 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001173189248 1131995466 /nfs/dbraw/zinc/99/54/66/1131995466.db2.gz JXACYPBALGSAIC-MNOVXSKESA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](OCc2ccccc2)C1 ZINC001173225455 1132007158 /nfs/dbraw/zinc/00/71/58/1132007158.db2.gz CGAYBEKHFCWWEH-OXJNMPFZSA-N 1 1 340.423 3.817 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001173228222 1132007889 /nfs/dbraw/zinc/00/78/89/1132007889.db2.gz UQFRABYZHQUGCF-GDBMZVCRSA-N 1 1 348.443 3.580 20 5 EHBDMO CC(C)C1CC[NH+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000744406657 1132089516 /nfs/dbraw/zinc/08/95/16/1132089516.db2.gz LNLNJIFWWHJHES-UHFFFAOYSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](c2ccc(F)cc2)C1(C)C ZINC001175231031 1132602668 /nfs/dbraw/zinc/60/26/68/1132602668.db2.gz ZQKVSDZEWUUWLZ-MRXNPFEDSA-N 1 1 346.406 3.507 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009408 1132631716 /nfs/dbraw/zinc/63/17/16/1132631716.db2.gz WCMXKLXGHJCEBU-MJGOQNOKSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030291 1132635991 /nfs/dbraw/zinc/63/59/91/1132635991.db2.gz YCUIASDNTPVIHF-HKUYNNGSSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038401 1132636986 /nfs/dbraw/zinc/63/69/86/1132636986.db2.gz YLFGDRTXIUVSHS-IVMMDQJWSA-N 1 1 342.361 3.940 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041701 1132638168 /nfs/dbraw/zinc/63/81/68/1132638168.db2.gz CBNJSOPBCHCETQ-WMZOPIPTSA-N 1 1 334.485 3.830 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048730 1132641424 /nfs/dbraw/zinc/64/14/24/1132641424.db2.gz BCEVZSGTKCSIOT-MFKMUULPSA-N 1 1 329.227 3.797 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@]3(CCc4c3cccc4F)C2)C1 ZINC001169051289 1132643052 /nfs/dbraw/zinc/64/30/52/1132643052.db2.gz CTWPQZDOQGJCSE-CLCXKQKWSA-N 1 1 332.419 3.551 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714360 1132741329 /nfs/dbraw/zinc/74/13/29/1132741329.db2.gz HAEDTJJUXFPHAU-OAHLLOKOSA-N 1 1 329.400 3.968 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000804352038 1132979208 /nfs/dbraw/zinc/97/92/08/1132979208.db2.gz NEQQGUYATWCMCX-AWEZNQCLSA-N 1 1 333.432 3.864 20 5 EHBDMO O=C1CC[C@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769204913 1133244463 /nfs/dbraw/zinc/24/44/63/1133244463.db2.gz BGTUFCXCKIOOAP-SFHVURJKSA-N 1 1 330.431 3.800 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246255 1133250644 /nfs/dbraw/zinc/25/06/44/1133250644.db2.gz YOWMXNWIGUYFLE-ICSRJNTNSA-N 1 1 340.423 3.991 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001180011670 1133316262 /nfs/dbraw/zinc/31/62/62/1133316262.db2.gz SHFUZFZLIVODMQ-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001180011670 1133316267 /nfs/dbraw/zinc/31/62/67/1133316267.db2.gz SHFUZFZLIVODMQ-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000746661980 1133970918 /nfs/dbraw/zinc/97/09/18/1133970918.db2.gz QGFSJLFJUZKFEJ-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000746661980 1133970919 /nfs/dbraw/zinc/97/09/19/1133970919.db2.gz QGFSJLFJUZKFEJ-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO Cc1cc(F)ccc1[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000746663145 1133974139 /nfs/dbraw/zinc/97/41/39/1133974139.db2.gz OHWXUJJTGLIRPD-LJQANCHMSA-N 1 1 346.402 3.986 20 5 EHBDMO C[C@H]1CCSCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000792195779 1134666246 /nfs/dbraw/zinc/66/62/46/1134666246.db2.gz FOYHWNRSCYQQAX-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000792195779 1134666248 /nfs/dbraw/zinc/66/62/48/1134666248.db2.gz FOYHWNRSCYQQAX-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCC12CCOCC2 ZINC001170195303 1134711087 /nfs/dbraw/zinc/71/10/87/1134711087.db2.gz TXBBJNSUTTUKOQ-KRWDZBQOSA-N 1 1 332.444 3.666 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335493 1134752020 /nfs/dbraw/zinc/75/20/20/1134752020.db2.gz OOKZWXWHLAQASX-LBPRGKRZSA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350559 1134760752 /nfs/dbraw/zinc/76/07/52/1134760752.db2.gz BCKOBKZPJAPXAH-RDTXWAMCSA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 ZINC001191184186 1134821693 /nfs/dbraw/zinc/82/16/93/1134821693.db2.gz VEFYAGDIAVMLPU-DNVCBOLYSA-N 1 1 342.443 3.881 20 5 EHBDMO CC(C)Oc1cccc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001192954795 1135076091 /nfs/dbraw/zinc/07/60/91/1135076091.db2.gz BTJKCCTVHRGMCK-UHFFFAOYSA-N 1 1 344.411 3.893 20 5 EHBDMO CN(c1ccc([N+](=O)[O-])cc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000804814595 1135202044 /nfs/dbraw/zinc/20/20/44/1135202044.db2.gz FBTCCCGIHPUUGE-QYJAPNMZSA-N 1 1 343.349 3.675 20 5 EHBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195015076 1135349663 /nfs/dbraw/zinc/34/96/63/1135349663.db2.gz RSCJUZDDHUGWIJ-CQSZACIVSA-N 1 1 332.375 3.676 20 5 EHBDMO CCCC[N@@H+](CCCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809972153 1135906890 /nfs/dbraw/zinc/90/68/90/1135906890.db2.gz CXZZEJKRAGKOEL-UHFFFAOYSA-N 1 1 335.231 3.886 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473615 1136095761 /nfs/dbraw/zinc/09/57/61/1136095761.db2.gz FMLBPMLWTSDUBB-NSHDSACASA-N 1 1 346.258 3.866 20 5 EHBDMO C[C@H]1CCCCN1CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473615 1136095763 /nfs/dbraw/zinc/09/57/63/1136095763.db2.gz FMLBPMLWTSDUBB-NSHDSACASA-N 1 1 346.258 3.866 20 5 EHBDMO C[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCCCC1 ZINC000811474815 1136096404 /nfs/dbraw/zinc/09/64/04/1136096404.db2.gz BVUZLGBVOKIRRS-NSHDSACASA-N 1 1 346.258 3.866 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476108 1136096486 /nfs/dbraw/zinc/09/64/86/1136096486.db2.gz FLYYLAUNFFWELN-NSHDSACASA-N 1 1 346.258 3.723 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274473 1136129485 /nfs/dbraw/zinc/12/94/85/1136129485.db2.gz DHHTXZGLEQQZPK-YVEFUNNKSA-N 1 1 334.803 3.975 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276597 1136130862 /nfs/dbraw/zinc/13/08/62/1136130862.db2.gz KUIQHEYPXLVLRI-DIFFPNOSSA-N 1 1 336.338 3.599 20 5 EHBDMO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812848509 1136259692 /nfs/dbraw/zinc/25/96/92/1136259692.db2.gz COILRPFHUGTIRW-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812848509 1136259696 /nfs/dbraw/zinc/25/96/96/1136259696.db2.gz COILRPFHUGTIRW-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)[C@H](O)c1ccccc1 ZINC000812853797 1136261943 /nfs/dbraw/zinc/26/19/43/1136261943.db2.gz KGVWDAXGXDUWDJ-KUHUBIRLSA-N 1 1 344.411 3.547 20 5 EHBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000776580720 1136445409 /nfs/dbraw/zinc/44/54/09/1136445409.db2.gz ZGNAYPLDXVBUNY-FZKQIMNGSA-N 1 1 332.375 3.850 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccsc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000852312004 1136447779 /nfs/dbraw/zinc/44/77/79/1136447779.db2.gz RQGRNQVDTLDTAK-MRXNPFEDSA-N 1 1 334.441 3.990 20 5 EHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588699 1136453015 /nfs/dbraw/zinc/45/30/15/1136453015.db2.gz NXTNMRJAGUIMAG-UYAOXDASSA-N 1 1 342.439 3.890 20 5 EHBDMO Cc1c(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000852484484 1136459764 /nfs/dbraw/zinc/45/97/64/1136459764.db2.gz FPZGWIOHZAEXGS-SFHVURJKSA-N 1 1 342.395 3.850 20 5 EHBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000852484484 1136459766 /nfs/dbraw/zinc/45/97/66/1136459766.db2.gz FPZGWIOHZAEXGS-SFHVURJKSA-N 1 1 342.395 3.850 20 5 EHBDMO Cc1ccc2c(c1)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C2 ZINC000815186724 1136563688 /nfs/dbraw/zinc/56/36/88/1136563688.db2.gz XBGJVTQPLYRKSI-LJQANCHMSA-N 1 1 340.423 3.774 20 5 EHBDMO C[N@@H+](CCc1nccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339051814 1137170700 /nfs/dbraw/zinc/17/07/00/1137170700.db2.gz WENGOPWLUGEMTE-UHFFFAOYSA-N 1 1 345.346 3.745 20 5 EHBDMO Cc1c(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000864005479 1137211283 /nfs/dbraw/zinc/21/12/83/1137211283.db2.gz YEDZRNRXCBIXPA-SFHVURJKSA-N 1 1 337.423 3.888 20 5 EHBDMO CCC(=O)C(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001143967960 1137219721 /nfs/dbraw/zinc/21/97/21/1137219721.db2.gz ALUYUGIJPYCPBD-UHFFFAOYSA-N 1 1 335.407 3.680 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794703078 1137236271 /nfs/dbraw/zinc/23/62/71/1137236271.db2.gz HUULDCARRMMYHY-HNNXBMFYSA-N 1 1 343.431 3.569 20 5 EHBDMO CCOc1cc(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001171635691 1137504345 /nfs/dbraw/zinc/50/43/45/1137504345.db2.gz GEZGFJFOHDBRIB-HNNXBMFYSA-N 1 1 348.443 3.917 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@H](C)OC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001171635691 1137504346 /nfs/dbraw/zinc/50/43/46/1137504346.db2.gz GEZGFJFOHDBRIB-HNNXBMFYSA-N 1 1 348.443 3.917 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000872020705 1137565036 /nfs/dbraw/zinc/56/50/36/1137565036.db2.gz KLRAFGWEQROKDB-QWRGUYRKSA-N 1 1 332.331 3.874 20 5 EHBDMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000872020698 1137565097 /nfs/dbraw/zinc/56/50/97/1137565097.db2.gz KLRAFGWEQROKDB-GHMZBOCLSA-N 1 1 332.331 3.874 20 5 EHBDMO C[C@@H](NCC1CC[NH+](CC2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089333 1137570797 /nfs/dbraw/zinc/57/07/97/1137570797.db2.gz XDIIKMRXMWGHAT-CYBMUJFWSA-N 1 1 335.423 3.507 20 5 EHBDMO CC[N@H+](c1ccc(NC2CC(n3cc([N+](=O)[O-])cn3)C2)cc1)C(C)C ZINC000876820577 1137662719 /nfs/dbraw/zinc/66/27/19/1137662719.db2.gz QGWOZTCJIFGRMS-UHFFFAOYSA-N 1 1 343.431 3.842 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674380 1137685315 /nfs/dbraw/zinc/68/53/15/1137685315.db2.gz UZEFZZFBFXQWCS-PKOBYXMFSA-N 1 1 326.396 3.601 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674377 1137685340 /nfs/dbraw/zinc/68/53/40/1137685340.db2.gz UZEFZZFBFXQWCS-IEBWSBKVSA-N 1 1 326.396 3.601 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877936028 1137696263 /nfs/dbraw/zinc/69/62/63/1137696263.db2.gz QLYJIGUVYYNEDL-JTQLQIEISA-N 1 1 336.779 3.673 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128346 1137703590 /nfs/dbraw/zinc/70/35/90/1137703590.db2.gz CNZLIJAJKLBCMY-STQMWFEESA-N 1 1 330.388 3.655 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@](C)(C(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000880002853 1137764582 /nfs/dbraw/zinc/76/45/82/1137764582.db2.gz RXCICPOMJYEFGX-ZDUSSCGKSA-N 1 1 336.285 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@](C)(C(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000880002853 1137764583 /nfs/dbraw/zinc/76/45/83/1137764583.db2.gz RXCICPOMJYEFGX-ZDUSSCGKSA-N 1 1 336.285 3.517 20 5 EHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccnc(F)c1[N+](=O)[O-] ZINC000881810155 1137815736 /nfs/dbraw/zinc/81/57/36/1137815736.db2.gz CQKQXFIGIQOXCH-UHFFFAOYSA-N 1 1 332.379 3.581 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1cncs1 ZINC000883294811 1137853342 /nfs/dbraw/zinc/85/33/42/1137853342.db2.gz MALNCIBOYXYDPD-QMMMGPOBSA-N 1 1 342.218 3.665 20 5 EHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287540 1137900108 /nfs/dbraw/zinc/90/01/08/1137900108.db2.gz UUPQLSVEJGNSPO-WCBMZHEXSA-N 1 1 329.278 3.509 20 5 EHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287540 1137900109 /nfs/dbraw/zinc/90/01/09/1137900109.db2.gz UUPQLSVEJGNSPO-WCBMZHEXSA-N 1 1 329.278 3.509 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000332323335 1137939911 /nfs/dbraw/zinc/93/99/11/1137939911.db2.gz NYZKVZSQMMVONP-CABCVRRESA-N 1 1 328.416 3.577 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1OC ZINC000886010091 1138031985 /nfs/dbraw/zinc/03/19/85/1138031985.db2.gz DIDSQZPENIFSDH-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000886109999 1138047819 /nfs/dbraw/zinc/04/78/19/1138047819.db2.gz WGXXWMRGCMBZTD-UHFFFAOYSA-N 1 1 348.200 3.531 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C)CC1 ZINC000063308695 1138069890 /nfs/dbraw/zinc/06/98/90/1138069890.db2.gz RXSDBQYYTWVLNO-STQMWFEESA-N 1 1 330.388 3.828 20 5 EHBDMO CS[C@@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089924791 1138207850 /nfs/dbraw/zinc/20/78/50/1138207850.db2.gz YCTOIVGIYGJQBY-MRXNPFEDSA-N 1 1 347.440 3.967 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000336940208 1138431652 /nfs/dbraw/zinc/43/16/52/1138431652.db2.gz XPIFSGVIJOJUEG-OAHLLOKOSA-N 1 1 340.427 3.820 20 5 EHBDMO C[NH+](C)Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000337264337 1138513174 /nfs/dbraw/zinc/51/31/74/1138513174.db2.gz ZQMIMAGBRDDKMV-UHFFFAOYSA-N 1 1 333.775 3.562 20 5 EHBDMO Cc1cnc(CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000182363855 1139968030 /nfs/dbraw/zinc/96/80/30/1139968030.db2.gz FFGOQQZPDOXLLS-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO Cc1cnc(CC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000182363855 1139968032 /nfs/dbraw/zinc/96/80/32/1139968032.db2.gz FFGOQQZPDOXLLS-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO Cc1noc([C@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685667 1139986210 /nfs/dbraw/zinc/98/62/10/1139986210.db2.gz RLFWDKNBSQVDCM-OCCSQVGLSA-N 1 1 330.388 3.535 20 5 EHBDMO CO[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@H]1C ZINC000188301088 1140291482 /nfs/dbraw/zinc/29/14/82/1140291482.db2.gz ZWAAEZHNAAQICB-WBMJQRKESA-N 1 1 347.440 3.575 20 5 EHBDMO CO[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@H]1C ZINC000188301088 1140291484 /nfs/dbraw/zinc/29/14/84/1140291484.db2.gz ZWAAEZHNAAQICB-WBMJQRKESA-N 1 1 347.440 3.575 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309594 1140918703 /nfs/dbraw/zinc/91/87/03/1140918703.db2.gz XAKOPLIAXABHPX-NVXWUHKLSA-N 1 1 330.384 3.584 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636326 1141129662 /nfs/dbraw/zinc/12/96/62/1141129662.db2.gz AOPCBQVRUAMYFF-GTNSWQLSSA-N 1 1 336.338 3.599 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025753 1141296566 /nfs/dbraw/zinc/29/65/66/1141296566.db2.gz BCQKHZXNUIZQRZ-CQSZACIVSA-N 1 1 347.459 3.661 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)Cc1cc(C)[nH]n1 ZINC000271482963 1141378211 /nfs/dbraw/zinc/37/82/11/1141378211.db2.gz JFHSMLHENLXTFT-GXTWGEPZSA-N 1 1 348.472 3.718 20 5 EHBDMO C[N@@H+]1CCC12CN(C(=O)CCc1c3ccccc3cc3ccccc31)C2 ZINC001274657865 1141581369 /nfs/dbraw/zinc/58/13/69/1141581369.db2.gz ZNPOVBUICRHJTJ-UHFFFAOYSA-N 1 1 344.458 3.842 20 5 EHBDMO C[N@H+]1CCC12CN(C(=O)CCc1c3ccccc3cc3ccccc31)C2 ZINC001274657865 1141581372 /nfs/dbraw/zinc/58/13/72/1141581372.db2.gz ZNPOVBUICRHJTJ-UHFFFAOYSA-N 1 1 344.458 3.842 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000536672116 1032105644 /nfs/dbraw/zinc/10/56/44/1032105644.db2.gz ABRRICAXJBPNFX-WMLDXEAASA-N 1 1 326.396 3.981 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223784 1015100421 /nfs/dbraw/zinc/10/04/21/1015100421.db2.gz VTTHHIFAUUVUNQ-AWEZNQCLSA-N 1 1 342.395 3.602 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cc2ccccc2o1 ZINC000430234761 1015165713 /nfs/dbraw/zinc/16/57/13/1015165713.db2.gz BTOLIQNQVDIVRD-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cc2ccccc2o1 ZINC000430234761 1015165720 /nfs/dbraw/zinc/16/57/20/1015165720.db2.gz BTOLIQNQVDIVRD-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000134796584 1015805912 /nfs/dbraw/zinc/80/59/12/1015805912.db2.gz VZFNFTRZJMLAMS-MOPGFXCFSA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432095 1016240513 /nfs/dbraw/zinc/24/05/13/1016240513.db2.gz RDKJEEDLWGEHKI-CHWSQXEVSA-N 1 1 336.823 3.569 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)c1 ZINC000066696106 1016424440 /nfs/dbraw/zinc/42/44/40/1016424440.db2.gz FSVJFQOYXBYQQM-INIZCTEOSA-N 1 1 332.425 3.838 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)c1 ZINC000066696106 1016424444 /nfs/dbraw/zinc/42/44/44/1016424444.db2.gz FSVJFQOYXBYQQM-INIZCTEOSA-N 1 1 332.425 3.838 20 5 EHBDMO CC[C@@H](CSC)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416845 1034880646 /nfs/dbraw/zinc/88/06/46/1034880646.db2.gz LTIQHKJPUSWSSO-NSHDSACASA-N 1 1 347.278 3.931 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2cccc3c2OCCO3)c1 ZINC000340183205 1016631936 /nfs/dbraw/zinc/63/19/36/1016631936.db2.gz WTOHUPXCXNZPHT-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)c1 ZINC000340183205 1016631941 /nfs/dbraw/zinc/63/19/41/1016631941.db2.gz WTOHUPXCXNZPHT-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO CC[C@](C)(O)C[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000189737426 1016697809 /nfs/dbraw/zinc/69/78/09/1016697809.db2.gz JBDSUJGBJGPVEV-KRWDZBQOSA-N 1 1 334.441 3.820 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000189737426 1016697817 /nfs/dbraw/zinc/69/78/17/1016697817.db2.gz JBDSUJGBJGPVEV-KRWDZBQOSA-N 1 1 334.441 3.820 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283535 1016857542 /nfs/dbraw/zinc/85/75/42/1016857542.db2.gz YTWMDWGSDRCURK-IEBWSBKVSA-N 1 1 325.412 3.520 20 5 EHBDMO CN1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283535 1016857557 /nfs/dbraw/zinc/85/75/57/1016857557.db2.gz YTWMDWGSDRCURK-IEBWSBKVSA-N 1 1 325.412 3.520 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnc(C2CC2)s1 ZINC000414551367 1016972122 /nfs/dbraw/zinc/97/21/22/1016972122.db2.gz FMVNZURFBWQBOM-XFFZJAGNSA-N 1 1 330.413 3.517 20 5 EHBDMO COC(=O)c1cccc2c1CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540349 1032257936 /nfs/dbraw/zinc/25/79/36/1032257936.db2.gz DKUMPJNODICKMM-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1cccc2c1CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540349 1032257952 /nfs/dbraw/zinc/25/79/52/1032257952.db2.gz DKUMPJNODICKMM-ZDUSSCGKSA-N 1 1 340.379 3.501 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536835053 1032331233 /nfs/dbraw/zinc/33/12/33/1032331233.db2.gz ZGSGKAUHUBYGMZ-IRXDYDNUSA-N 1 1 333.476 3.922 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157750 1032336590 /nfs/dbraw/zinc/33/65/90/1032336590.db2.gz ZBYHMKAHFXCVDO-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157750 1032336607 /nfs/dbraw/zinc/33/66/07/1032336607.db2.gz ZBYHMKAHFXCVDO-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000536987856 1032463794 /nfs/dbraw/zinc/46/37/94/1032463794.db2.gz NMYZJZFVXJBNRI-CQSZACIVSA-N 1 1 335.448 3.916 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000536987855 1032464122 /nfs/dbraw/zinc/46/41/22/1032464122.db2.gz NMYZJZFVXJBNRI-AWEZNQCLSA-N 1 1 335.448 3.916 20 5 EHBDMO CC(C)n1nccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449501593 1032682617 /nfs/dbraw/zinc/68/26/17/1032682617.db2.gz QCDRCNXWEFFFIL-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449503709 1032686865 /nfs/dbraw/zinc/68/68/65/1032686865.db2.gz POYAAWOOLDDRTH-GUYCJALGSA-N 1 1 330.384 3.712 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000190052615 1017263322 /nfs/dbraw/zinc/26/33/22/1017263322.db2.gz KEKKBGWERSCMSZ-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000340993068 1017398812 /nfs/dbraw/zinc/39/88/12/1017398812.db2.gz HNWRTLRIKNNNAF-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000340993068 1017398819 /nfs/dbraw/zinc/39/88/19/1017398819.db2.gz HNWRTLRIKNNNAF-ZDUSSCGKSA-N 1 1 342.395 3.731 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351919 1017971734 /nfs/dbraw/zinc/97/17/34/1017971734.db2.gz ADDQDXSPZZGJQF-JSGCOSHPSA-N 1 1 326.824 3.764 20 5 EHBDMO CC(=O)N1CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000408046546 1018209288 /nfs/dbraw/zinc/20/92/88/1018209288.db2.gz LSWULIHCQDOTJH-OAHLLOKOSA-N 1 1 345.443 3.523 20 5 EHBDMO CC(=O)N1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000408046546 1018209303 /nfs/dbraw/zinc/20/93/03/1018209303.db2.gz LSWULIHCQDOTJH-OAHLLOKOSA-N 1 1 345.443 3.523 20 5 EHBDMO CC[N@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000517550817 1018301530 /nfs/dbraw/zinc/30/15/30/1018301530.db2.gz NFGLJAFFIFWELE-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CC[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000517550817 1018301542 /nfs/dbraw/zinc/30/15/42/1018301542.db2.gz NFGLJAFFIFWELE-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000449550997 1032771609 /nfs/dbraw/zinc/77/16/09/1032771609.db2.gz FEIPREZFTDINMT-BRWVUGGUSA-N 1 1 332.444 3.701 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000379637250 1019011801 /nfs/dbraw/zinc/01/18/01/1019011801.db2.gz SHBRLPZFBRZXLD-APWZRJJASA-N 1 1 339.439 3.738 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000379637250 1019011815 /nfs/dbraw/zinc/01/18/15/1019011815.db2.gz SHBRLPZFBRZXLD-APWZRJJASA-N 1 1 339.439 3.738 20 5 EHBDMO COC(=O)c1cc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)oc1C ZINC000182587219 1019714594 /nfs/dbraw/zinc/71/45/94/1019714594.db2.gz VIVDXFFFYUZDPU-LBPRGKRZSA-N 1 1 346.383 3.784 20 5 EHBDMO COC(=O)c1cc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)oc1C ZINC000182587219 1019714611 /nfs/dbraw/zinc/71/46/11/1019714611.db2.gz VIVDXFFFYUZDPU-LBPRGKRZSA-N 1 1 346.383 3.784 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169796 1020498962 /nfs/dbraw/zinc/49/89/62/1020498962.db2.gz MGICBUAQHOGBFX-SUMWQHHRSA-N 1 1 328.416 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]CCOC3CCCCCC3)nc2c1 ZINC000602546952 1032956884 /nfs/dbraw/zinc/95/68/84/1032956884.db2.gz NKFZZHHAKHFZSJ-UHFFFAOYSA-N 1 1 333.388 3.565 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)C1 ZINC000127275141 1021670330 /nfs/dbraw/zinc/67/03/30/1021670330.db2.gz SUSAXAMKTUKPHK-QWHCGFSZSA-N 1 1 330.388 3.513 20 5 EHBDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000519076395 1021818480 /nfs/dbraw/zinc/81/84/80/1021818480.db2.gz WYWARRUBFIQXSP-SJORKVTESA-N 1 1 330.428 3.684 20 5 EHBDMO CCOc1cc(C[N@@H+]2CC(C)(C)O[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000440963335 1021895329 /nfs/dbraw/zinc/89/53/29/1021895329.db2.gz WCRNUMLBLCJYRO-GDBMZVCRSA-N 1 1 334.416 3.525 20 5 EHBDMO CCOc1cc(C[N@H+]2CC(C)(C)O[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000440963335 1021895341 /nfs/dbraw/zinc/89/53/41/1021895341.db2.gz WCRNUMLBLCJYRO-GDBMZVCRSA-N 1 1 334.416 3.525 20 5 EHBDMO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)sn1 ZINC000602638737 1033050391 /nfs/dbraw/zinc/05/03/91/1033050391.db2.gz HFTHOEBQSMSUOV-UHFFFAOYSA-N 1 1 331.319 3.668 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H](CCO)c3ccco3)o2)c1 ZINC000184517763 1022573662 /nfs/dbraw/zinc/57/36/62/1022573662.db2.gz PUOIXLXSHPYYSS-INIZCTEOSA-N 1 1 342.351 3.661 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000602704177 1033093271 /nfs/dbraw/zinc/09/32/71/1033093271.db2.gz GFYWRZHYQZIAOA-GFCCVEGCSA-N 1 1 336.260 3.845 20 5 EHBDMO Cc1cccn2c(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cnc12 ZINC000507119513 1023138347 /nfs/dbraw/zinc/13/83/47/1023138347.db2.gz HWUHMZBLZNDUBY-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO C[N@H+](Cc1ccc2c(c1)CC(C)(C)O2)Cc1ccccc1[N+](=O)[O-] ZINC000507144154 1023149127 /nfs/dbraw/zinc/14/91/27/1023149127.db2.gz OEPGONSBDLQGEM-UHFFFAOYSA-N 1 1 326.396 3.940 20 5 EHBDMO C[N@@H+](Cc1ccc2c(c1)CC(C)(C)O2)Cc1ccccc1[N+](=O)[O-] ZINC000507144154 1023149130 /nfs/dbraw/zinc/14/91/30/1023149130.db2.gz OEPGONSBDLQGEM-UHFFFAOYSA-N 1 1 326.396 3.940 20 5 EHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000507315834 1023242260 /nfs/dbraw/zinc/24/22/60/1023242260.db2.gz KRCYFDRZHFAFSE-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000507315834 1023242265 /nfs/dbraw/zinc/24/22/65/1023242265.db2.gz KRCYFDRZHFAFSE-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO Cc1c([C@@H](C)[NH2+]Cc2cccnc2OC(C)C)cccc1[N+](=O)[O-] ZINC000610800046 1023692459 /nfs/dbraw/zinc/69/24/59/1023692459.db2.gz MTXMOOJYRDCUSV-CQSZACIVSA-N 1 1 329.400 3.936 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000065202263 1023892159 /nfs/dbraw/zinc/89/21/59/1023892159.db2.gz QRHLCXDCNNNIIC-KRWDZBQOSA-N 1 1 325.412 3.919 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)cs1 ZINC000449765506 1033179610 /nfs/dbraw/zinc/17/96/10/1033179610.db2.gz ISFLVWYKTUQXPZ-CQSZACIVSA-N 1 1 338.454 3.711 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000443643643 1024306269 /nfs/dbraw/zinc/30/62/69/1024306269.db2.gz SEOLYIDDGLRGJV-ZIAGYGMSSA-N 1 1 333.432 3.600 20 5 EHBDMO COc1c(O)ccc(C[NH2+]C2(c3cccc(F)c3)CCC2)c1[N+](=O)[O-] ZINC000895098786 1024346253 /nfs/dbraw/zinc/34/62/53/1024346253.db2.gz BTMICPGNAOPUQG-UHFFFAOYSA-N 1 1 346.358 3.617 20 5 EHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC(C)(C)C1 ZINC000449780548 1033207608 /nfs/dbraw/zinc/20/76/08/1033207608.db2.gz GKCHVDYTVLZQSO-UHFFFAOYSA-N 1 1 334.416 3.860 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2ccccc2C1 ZINC000520748292 1024608305 /nfs/dbraw/zinc/60/83/05/1024608305.db2.gz KBAWLNSBGNDMRQ-CYBMUJFWSA-N 1 1 329.375 3.593 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H](CCCO)C2)s1 ZINC000449793070 1033237151 /nfs/dbraw/zinc/23/71/51/1033237151.db2.gz VPWVPXFNZVQOJH-AWEZNQCLSA-N 1 1 346.452 3.918 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000514892762 1024838793 /nfs/dbraw/zinc/83/87/93/1024838793.db2.gz BAPUVPWRCTZNCY-ZIAGYGMSSA-N 1 1 348.447 3.542 20 5 EHBDMO C[C@H](c1ccccc1F)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000071952352 1024917453 /nfs/dbraw/zinc/91/74/53/1024917453.db2.gz OSWKJIHLXCOGLM-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO Nc1c(F)c(NC[C@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435591227 1025023009 /nfs/dbraw/zinc/02/30/09/1025023009.db2.gz DABCVGSRMJOLCH-CYBMUJFWSA-N 1 1 336.411 3.525 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1nccc2ccc([N+](=O)[O-])cc21 ZINC000895987458 1025043950 /nfs/dbraw/zinc/04/39/50/1025043950.db2.gz GNQGIFXNHIQHTB-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC000895988475 1025045554 /nfs/dbraw/zinc/04/55/54/1025045554.db2.gz SPILGGBJVQDXCP-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)cs1 ZINC000074312818 1025093535 /nfs/dbraw/zinc/09/35/35/1025093535.db2.gz PMNDYQROLZMZLR-INIZCTEOSA-N 1 1 332.425 3.528 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)cs1 ZINC000074312818 1025093547 /nfs/dbraw/zinc/09/35/47/1025093547.db2.gz PMNDYQROLZMZLR-INIZCTEOSA-N 1 1 332.425 3.528 20 5 EHBDMO C[C@H]1C[NH+](C(C)(C)CNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000515341085 1025180269 /nfs/dbraw/zinc/18/02/69/1025180269.db2.gz XDQDJCKGJGUGAF-RYUDHWBXSA-N 1 1 341.839 3.548 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000425549725 1025712305 /nfs/dbraw/zinc/71/23/05/1025712305.db2.gz LRHSEYNYDLUOEN-QZTJIDSGSA-N 1 1 346.814 3.599 20 5 EHBDMO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000521847963 1025717889 /nfs/dbraw/zinc/71/78/89/1025717889.db2.gz CHPUTPHEIWYELX-GOEBONIOSA-N 1 1 340.427 3.514 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000020813781 1025985343 /nfs/dbraw/zinc/98/53/43/1025985343.db2.gz VORQPUBZLVHVEV-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000020813781 1025985351 /nfs/dbraw/zinc/98/53/51/1025985351.db2.gz VORQPUBZLVHVEV-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCO[C@H]3CCCCO3)C2)cc1 ZINC000451550475 1026101894 /nfs/dbraw/zinc/10/18/94/1026101894.db2.gz RWDMXBSULQQXDV-HKUYNNGSSA-N 1 1 348.443 3.708 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000451732156 1026240061 /nfs/dbraw/zinc/24/00/61/1026240061.db2.gz GDPWLDRZJWEAPV-MRXNPFEDSA-N 1 1 334.807 3.672 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)C1 ZINC000339002123 1026334681 /nfs/dbraw/zinc/33/46/81/1026334681.db2.gz HVWVESQJPOBOEC-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(OC(F)F)c(F)c2)cs1 ZINC000339524558 1026576518 /nfs/dbraw/zinc/57/65/18/1026576518.db2.gz LYKMBVMVGSKHPS-UHFFFAOYSA-N 1 1 332.303 3.687 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000186438456 1026902311 /nfs/dbraw/zinc/90/23/11/1026902311.db2.gz JTYPHWYMYWUGND-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000186438456 1026902320 /nfs/dbraw/zinc/90/23/20/1026902320.db2.gz JTYPHWYMYWUGND-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531587149 1027076488 /nfs/dbraw/zinc/07/64/88/1027076488.db2.gz PLWMDMAKACANPA-AWEZNQCLSA-N 1 1 334.416 3.719 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000277845596 1027250495 /nfs/dbraw/zinc/25/04/95/1027250495.db2.gz SMMASRNHWLXDDK-HUBLWGQQSA-N 1 1 346.349 3.599 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000078333432 1027676129 /nfs/dbraw/zinc/67/61/29/1027676129.db2.gz ZBYGQXBUKOXGNN-UHFFFAOYSA-N 1 1 328.294 3.621 20 5 EHBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179100610 1027688828 /nfs/dbraw/zinc/68/88/28/1027688828.db2.gz GFEIEJIHIXCJDF-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179100610 1027688838 /nfs/dbraw/zinc/68/88/38/1027688838.db2.gz GFEIEJIHIXCJDF-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179100596 1027689293 /nfs/dbraw/zinc/68/92/93/1027689293.db2.gz GFEIEJIHIXCJDF-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179100596 1027689304 /nfs/dbraw/zinc/68/93/04/1027689304.db2.gz GFEIEJIHIXCJDF-KRWDZBQOSA-N 1 1 332.375 3.507 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000300241791 1027784313 /nfs/dbraw/zinc/78/43/13/1027784313.db2.gz RPZZFRIKFQXCSR-ZJUUUORDSA-N 1 1 330.215 3.940 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420944261 1027902312 /nfs/dbraw/zinc/90/23/12/1027902312.db2.gz JGUSDVNDJBDTGX-GFCCVEGCSA-N 1 1 332.322 3.638 20 5 EHBDMO C[NH2+]C[C@@H](C)CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285345 1028322434 /nfs/dbraw/zinc/32/24/34/1028322434.db2.gz ZJWABFRPJBNPGT-OLZOCXBDSA-N 1 1 333.457 3.829 20 5 EHBDMO C[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738974 1028332149 /nfs/dbraw/zinc/33/21/49/1028332149.db2.gz OXPIEQQLWAEQGB-MRXNPFEDSA-N 1 1 339.439 3.910 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]23CCOC3)s1 ZINC000421393517 1028368806 /nfs/dbraw/zinc/36/88/06/1028368806.db2.gz DZJXNUKYUKJEPB-QGZVFWFLSA-N 1 1 330.409 3.688 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701380 1028554837 /nfs/dbraw/zinc/55/48/37/1028554837.db2.gz PUOJXJOUFNKUQV-UHFFFAOYSA-N 1 1 328.412 3.847 20 5 EHBDMO [NH3+][C@@H]1CCCC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000424366983 1029030899 /nfs/dbraw/zinc/03/08/99/1029030899.db2.gz KCGZDJNFOSQTLW-HZPDHXFCSA-N 1 1 331.441 3.683 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930041 1029077406 /nfs/dbraw/zinc/07/74/06/1029077406.db2.gz MYVRYQPXFWRVRA-CABCVRRESA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930041 1029077423 /nfs/dbraw/zinc/07/74/23/1029077423.db2.gz MYVRYQPXFWRVRA-CABCVRRESA-N 1 1 335.448 3.519 20 5 EHBDMO O=C(CC[N@H+]1CCCC2(CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000445840602 1029181474 /nfs/dbraw/zinc/18/14/74/1029181474.db2.gz JJDQJHHBQDOZFS-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446067689 1029383425 /nfs/dbraw/zinc/38/34/25/1029383425.db2.gz PCBOXIJITNBZCS-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000533263477 1029564491 /nfs/dbraw/zinc/56/44/91/1029564491.db2.gz HVAQPCMSVJZZHV-LSDHHAIUSA-N 1 1 341.411 3.657 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195850 1029738927 /nfs/dbraw/zinc/73/89/27/1029738927.db2.gz SQTLWCSNZPSIRZ-KGLIPLIRSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195850 1029738929 /nfs/dbraw/zinc/73/89/29/1029738929.db2.gz SQTLWCSNZPSIRZ-KGLIPLIRSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1C ZINC000525195850 1029738939 /nfs/dbraw/zinc/73/89/39/1029738939.db2.gz SQTLWCSNZPSIRZ-KGLIPLIRSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1C ZINC000525195850 1029738945 /nfs/dbraw/zinc/73/89/45/1029738945.db2.gz SQTLWCSNZPSIRZ-KGLIPLIRSA-N 1 1 345.468 3.896 20 5 EHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525410915 1029840072 /nfs/dbraw/zinc/84/00/72/1029840072.db2.gz PNTGINFIEMKSLV-NXHRZFHOSA-N 1 1 348.443 3.629 20 5 EHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508579741 1029872918 /nfs/dbraw/zinc/87/29/18/1029872918.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000508579741 1029872942 /nfs/dbraw/zinc/87/29/42/1029872942.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000508579741 1029872948 /nfs/dbraw/zinc/87/29/48/1029872948.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1C ZINC000537626537 1029903407 /nfs/dbraw/zinc/90/34/07/1029903407.db2.gz WSZYTMWERBGAOR-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1C ZINC000537626537 1029903427 /nfs/dbraw/zinc/90/34/27/1029903427.db2.gz WSZYTMWERBGAOR-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000447393665 1030161240 /nfs/dbraw/zinc/16/12/40/1030161240.db2.gz KHKKFINUKZPARO-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@H](O)C2CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453396112 1030248500 /nfs/dbraw/zinc/24/85/00/1030248500.db2.gz YDMVQLWMDRCULL-HKUYNNGSSA-N 1 1 344.411 3.590 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603049 1030258715 /nfs/dbraw/zinc/25/87/15/1030258715.db2.gz HYBPHRIOTILXHN-INIZCTEOSA-N 1 1 341.411 3.767 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857408 1030398725 /nfs/dbraw/zinc/39/87/25/1030398725.db2.gz FTMJYEYWXIIASL-IBGZPJMESA-N 1 1 341.411 3.904 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2)CC2(O)CCCC2)cs1 ZINC000532144598 1030436080 /nfs/dbraw/zinc/43/60/80/1030436080.db2.gz HQRQPWOBSUJCOB-UHFFFAOYSA-N 1 1 346.452 3.964 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccc2)CC2(O)CCCC2)cs1 ZINC000532144598 1030436090 /nfs/dbraw/zinc/43/60/90/1030436090.db2.gz HQRQPWOBSUJCOB-UHFFFAOYSA-N 1 1 346.452 3.964 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160843090 1031087862 /nfs/dbraw/zinc/08/78/62/1031087862.db2.gz FSBOXMHINJUUII-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO CCOc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000459294613 1031356481 /nfs/dbraw/zinc/35/64/81/1031356481.db2.gz HDPCBNDPGYUQMU-UHFFFAOYSA-N 1 1 342.395 3.864 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000459294613 1031356499 /nfs/dbraw/zinc/35/64/99/1031356499.db2.gz HDPCBNDPGYUQMU-UHFFFAOYSA-N 1 1 342.395 3.864 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000343590173 1031523158 /nfs/dbraw/zinc/52/31/58/1031523158.db2.gz ANBDRFDYLIABNH-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000343590173 1031523168 /nfs/dbraw/zinc/52/31/68/1031523168.db2.gz ANBDRFDYLIABNH-CYBMUJFWSA-N 1 1 345.374 3.583 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000484359208 1031544458 /nfs/dbraw/zinc/54/44/58/1031544458.db2.gz WACYWFRJKSSSNJ-AWEZNQCLSA-N 1 1 346.349 3.884 20 5 EHBDMO CCOc1cncc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000598677858 1033377019 /nfs/dbraw/zinc/37/70/19/1033377019.db2.gz BYJVGVVKCSKZGE-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cncc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000598677858 1033377025 /nfs/dbraw/zinc/37/70/25/1033377025.db2.gz BYJVGVVKCSKZGE-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CC(C)Oc1ncccc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594493863 1033394370 /nfs/dbraw/zinc/39/43/70/1033394370.db2.gz NQSQNWPLRYRRTI-INIZCTEOSA-N 1 1 327.384 3.554 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293216 1033575374 /nfs/dbraw/zinc/57/53/74/1033575374.db2.gz TUIYLQZGPKCQBV-DZGCQCFKSA-N 1 1 348.472 3.816 20 5 EHBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000594942964 1033588274 /nfs/dbraw/zinc/58/82/74/1033588274.db2.gz AWPDGGDRAZWPTM-UHFFFAOYSA-N 1 1 334.807 3.539 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCc2c1cccc2O ZINC000595013877 1033607512 /nfs/dbraw/zinc/60/75/12/1033607512.db2.gz USDHYGMOIIUNDW-BZNIZROVSA-N 1 1 328.368 3.647 20 5 EHBDMO CC(C)[C@@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000594990429 1033622331 /nfs/dbraw/zinc/62/23/31/1033622331.db2.gz QMAGQUQLOMQTSO-QZTJIDSGSA-N 1 1 332.375 3.582 20 5 EHBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(F)(F)C(C)(C)C ZINC000595106052 1033692036 /nfs/dbraw/zinc/69/20/36/1033692036.db2.gz HFTXFQRHEUQCNE-LLVKDONJSA-N 1 1 343.374 3.583 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000599072759 1033714094 /nfs/dbraw/zinc/71/40/94/1033714094.db2.gz HIKYCHLDMIVTKF-YJBOKZPZSA-N 1 1 340.427 3.754 20 5 EHBDMO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000595295167 1033721437 /nfs/dbraw/zinc/72/14/37/1033721437.db2.gz HJPDJXFRESIAMN-INIZCTEOSA-N 1 1 329.400 3.661 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](CCO)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001168309440 1033866741 /nfs/dbraw/zinc/86/67/41/1033866741.db2.gz MWACWYDKSVIKFZ-ZDUSSCGKSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001168309440 1033866755 /nfs/dbraw/zinc/86/67/55/1033866755.db2.gz MWACWYDKSVIKFZ-ZDUSSCGKSA-N 1 1 334.803 3.804 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843267 1033966231 /nfs/dbraw/zinc/96/62/31/1033966231.db2.gz LOIBNZDOXFXGMA-KRWDZBQOSA-N 1 1 342.395 3.819 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787962 1033998192 /nfs/dbraw/zinc/99/81/92/1033998192.db2.gz LAZXWPQISLFDEP-SJLPKXTDSA-N 1 1 348.443 3.775 20 5 EHBDMO CC[C@@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C(C)C ZINC000595849669 1034007171 /nfs/dbraw/zinc/00/71/71/1034007171.db2.gz CLLCSKGGWFQMLY-SFHVURJKSA-N 1 1 343.427 3.618 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2(C)C)c1[N+](=O)[O-] ZINC000599621170 1034038425 /nfs/dbraw/zinc/03/84/25/1034038425.db2.gz DCBNGYMZRJHIJK-CQSZACIVSA-N 1 1 333.363 3.798 20 5 EHBDMO Cc1cc(Cl)ccc1C1=CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000599619349 1034038539 /nfs/dbraw/zinc/03/85/39/1034038539.db2.gz ITCGZOQGCZSMMZ-UHFFFAOYSA-N 1 1 346.818 3.542 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000596244815 1034133093 /nfs/dbraw/zinc/13/30/93/1034133093.db2.gz UNSZKSFSQIUMPK-OAHLLOKOSA-N 1 1 343.349 3.536 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604016833 1034142415 /nfs/dbraw/zinc/14/24/15/1034142415.db2.gz GKVBZQAMYNJEND-KRWDZBQOSA-N 1 1 344.386 3.950 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@](C)(O)c1ccccc1 ZINC000179374577 1034260471 /nfs/dbraw/zinc/26/04/71/1034260471.db2.gz JRGZWXDYJYFBNC-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@](C)(O)c1ccccc1 ZINC000179374577 1034260491 /nfs/dbraw/zinc/26/04/91/1034260491.db2.gz JRGZWXDYJYFBNC-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1=CCSC1 ZINC000597241928 1034621365 /nfs/dbraw/zinc/62/13/65/1034621365.db2.gz ASZKMNJWYLRPOT-UHFFFAOYSA-N 1 1 330.409 3.960 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000597225035 1034625400 /nfs/dbraw/zinc/62/54/00/1034625400.db2.gz LXIGQLRSVOSRPP-KUZNAAJDSA-N 1 1 330.428 3.889 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000065959210 1035029113 /nfs/dbraw/zinc/02/91/13/1035029113.db2.gz PSQGPQLEVOIYPF-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472440666 1035050352 /nfs/dbraw/zinc/05/03/52/1035050352.db2.gz RKIXTIRDPHMKCG-JTQLQIEISA-N 1 1 343.214 3.791 20 5 EHBDMO CC(C)c1ccc(C[NH2+]Cc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000612692059 1035167479 /nfs/dbraw/zinc/16/74/79/1035167479.db2.gz LEMRWZRWWDZUTQ-UHFFFAOYSA-N 1 1 338.411 3.895 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000467174768 1035344064 /nfs/dbraw/zinc/34/40/64/1035344064.db2.gz WHTHMYRBSWWSAI-HNNXBMFYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCCCCCC1 ZINC000003538921 1035397419 /nfs/dbraw/zinc/39/74/19/1035397419.db2.gz SOLMLAAQCPSESB-LBPRGKRZSA-N 1 1 339.823 3.841 20 5 EHBDMO CC1(C)C[C@H](N[C@@H]2CC[N@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390419 1035434510 /nfs/dbraw/zinc/43/45/10/1035434510.db2.gz XJCHAXOGYFCURI-FGTMMUONSA-N 1 1 329.444 3.534 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@@H]2CCN3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390419 1035434515 /nfs/dbraw/zinc/43/45/15/1035434515.db2.gz XJCHAXOGYFCURI-FGTMMUONSA-N 1 1 329.444 3.534 20 5 EHBDMO Cc1ccccc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026197600 1035501551 /nfs/dbraw/zinc/50/15/51/1035501551.db2.gz NWHRDPYCMLXDLU-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cc(N2CCC[N@H+](C(C)(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000540649745 1035539030 /nfs/dbraw/zinc/53/90/30/1035539030.db2.gz CBLFBPQLXSLNRB-UHFFFAOYSA-N 1 1 342.443 3.762 20 5 EHBDMO COc1cc(C[N@H+](C)CCCOc2ccccc2)c([N+](=O)[O-])cc1F ZINC000463473819 1035541199 /nfs/dbraw/zinc/54/11/99/1035541199.db2.gz JOGYZHVPABHTKT-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCOc2ccccc2)c([N+](=O)[O-])cc1F ZINC000463473819 1035541212 /nfs/dbraw/zinc/54/12/12/1035541212.db2.gz JOGYZHVPABHTKT-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000045004339 1035599727 /nfs/dbraw/zinc/59/97/27/1035599727.db2.gz BTFLIHAKJSPYJL-INIZCTEOSA-N 1 1 342.395 3.949 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC(CO)CC1 ZINC000589206132 1036312502 /nfs/dbraw/zinc/31/25/02/1036312502.db2.gz JNRFGSIMRFLBGF-UHFFFAOYSA-N 1 1 344.411 3.838 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000026224403 1036394697 /nfs/dbraw/zinc/39/46/97/1036394697.db2.gz KBCSZDPSVIQEQG-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO O=C(C[C@@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000122461468 1036595820 /nfs/dbraw/zinc/59/58/20/1036595820.db2.gz URZBMADEAQWMSS-HNNXBMFYSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000122461468 1036595831 /nfs/dbraw/zinc/59/58/31/1036595831.db2.gz URZBMADEAQWMSS-HNNXBMFYSA-N 1 1 330.409 3.894 20 5 EHBDMO CCN(C)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000191232863 1036739803 /nfs/dbraw/zinc/73/98/03/1036739803.db2.gz HDDGCIUUABVDTF-UHFFFAOYSA-N 1 1 340.427 3.611 20 5 EHBDMO CCN(C)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000191232863 1036739816 /nfs/dbraw/zinc/73/98/16/1036739816.db2.gz HDDGCIUUABVDTF-UHFFFAOYSA-N 1 1 340.427 3.611 20 5 EHBDMO CC[C@@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777049 1036770245 /nfs/dbraw/zinc/77/02/45/1036770245.db2.gz OMTNRTNBKAGCSV-KSSFIOAISA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@](O)(C3CC3)C2)o1 ZINC000597206034 1036854234 /nfs/dbraw/zinc/85/42/34/1036854234.db2.gz POFZWIVDHVHUIF-LJQANCHMSA-N 1 1 342.395 3.592 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC000443646914 1036941992 /nfs/dbraw/zinc/94/19/92/1036941992.db2.gz KGEDJHMOYGRJGT-QGZVFWFLSA-N 1 1 342.443 3.706 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@H](CC)N2CCCC2)cc1[N+](=O)[O-] ZINC000152851822 1036996913 /nfs/dbraw/zinc/99/69/13/1036996913.db2.gz BNFYZLXCVRCXAT-HOCLYGCPSA-N 1 1 335.448 3.519 20 5 EHBDMO COC(=O)c1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761505023 1037087122 /nfs/dbraw/zinc/08/71/22/1037087122.db2.gz COMLHQXVLMYYST-UHFFFAOYSA-N 1 1 348.786 3.667 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761505023 1037087132 /nfs/dbraw/zinc/08/71/32/1037087132.db2.gz COMLHQXVLMYYST-UHFFFAOYSA-N 1 1 348.786 3.667 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(n1)CCC2 ZINC000590951367 1037138399 /nfs/dbraw/zinc/13/83/99/1037138399.db2.gz BTULYIXEUSXSBV-UHFFFAOYSA-N 1 1 325.412 3.889 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000542322047 1037298093 /nfs/dbraw/zinc/29/80/93/1037298093.db2.gz GWIVBKXPPZLICK-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO CC[N@H+]1CCC[C@@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423958 1037451026 /nfs/dbraw/zinc/45/10/26/1037451026.db2.gz QGJNIIPLHOMHMM-UXHICEINSA-N 1 1 339.439 3.758 20 5 EHBDMO CCN1CCC[C@@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423958 1037451039 /nfs/dbraw/zinc/45/10/39/1037451039.db2.gz QGJNIIPLHOMHMM-UXHICEINSA-N 1 1 339.439 3.758 20 5 EHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC(C)(C)C1 ZINC000412036487 1037564504 /nfs/dbraw/zinc/56/45/04/1037564504.db2.gz MJDIAHLUTVFOEJ-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4cccc(F)c4)CCC3)nc2c1 ZINC000592144272 1037861704 /nfs/dbraw/zinc/86/17/04/1037861704.db2.gz BBSZCTBNHQPDHJ-UHFFFAOYSA-N 1 1 340.358 3.779 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C1CC1)C1CCCC1 ZINC000103466258 1037900482 /nfs/dbraw/zinc/90/04/82/1037900482.db2.gz WGRSXBZURFZOEJ-UHFFFAOYSA-N 1 1 331.416 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@@H]3C3CCC3)n2)cc1 ZINC000592198941 1037945286 /nfs/dbraw/zinc/94/52/86/1037945286.db2.gz MTWLXNQUWKXYPE-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000123655322 1038052558 /nfs/dbraw/zinc/05/25/58/1038052558.db2.gz ZRTHQOKLWVRXEZ-INIZCTEOSA-N 1 1 342.395 3.949 20 5 EHBDMO C[C@H]1CC[C@H]([N@@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123757 1038359480 /nfs/dbraw/zinc/35/94/80/1038359480.db2.gz JOZUNRCOLRYLMO-AAEUAGOBSA-N 1 1 346.349 3.597 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C(C)C)N1CCCC1 ZINC000468655429 1038392878 /nfs/dbraw/zinc/39/28/78/1038392878.db2.gz KVQDFDQMULCRFC-KZIRBZLESA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000470172233 1038449231 /nfs/dbraw/zinc/44/92/31/1038449231.db2.gz UCIFHHKMJDBRRU-WOVXLNPSSA-N 1 1 330.428 3.747 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000538743505 1038509411 /nfs/dbraw/zinc/50/94/11/1038509411.db2.gz JTMVTNWGNFBDQZ-MRXNPFEDSA-N 1 1 347.459 3.514 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000538751732 1038515597 /nfs/dbraw/zinc/51/55/97/1038515597.db2.gz KKLZMCYQVAEUES-SFHVURJKSA-N 1 1 325.412 3.980 20 5 EHBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511562606 1038731238 /nfs/dbraw/zinc/73/12/38/1038731238.db2.gz WUQAULMKRJOFIL-DLBZAZTESA-N 1 1 336.432 3.507 20 5 EHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967824 1038769390 /nfs/dbraw/zinc/76/93/90/1038769390.db2.gz FHEJZPQPHJFNCB-OLZOCXBDSA-N 1 1 334.416 3.860 20 5 EHBDMO Cc1cc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000478040198 1039141874 /nfs/dbraw/zinc/14/18/74/1039141874.db2.gz KVVKSRAOTAXRHQ-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328258 1039671313 /nfs/dbraw/zinc/67/13/13/1039671313.db2.gz SFFPXTDINIHVMQ-GPMSIDNRSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328258 1039671318 /nfs/dbraw/zinc/67/13/18/1039671318.db2.gz SFFPXTDINIHVMQ-GPMSIDNRSA-N 1 1 329.444 3.579 20 5 EHBDMO CN(C)c1cccnc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417354051 1039714762 /nfs/dbraw/zinc/71/47/62/1039714762.db2.gz YTISSFUBSZCVLB-KRWDZBQOSA-N 1 1 340.427 3.613 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831004 1040042577 /nfs/dbraw/zinc/04/25/77/1040042577.db2.gz UERRIUXWVZNHJE-DNVCBOLYSA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831004 1040042592 /nfs/dbraw/zinc/04/25/92/1040042592.db2.gz UERRIUXWVZNHJE-DNVCBOLYSA-N 1 1 331.460 3.682 20 5 EHBDMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000573622003 1040162512 /nfs/dbraw/zinc/16/25/12/1040162512.db2.gz UETUWASBXGRFAA-CQSZACIVSA-N 1 1 331.803 3.941 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000490090526 1040352905 /nfs/dbraw/zinc/35/29/05/1040352905.db2.gz QYWQOGNWXCKOIC-NUJGCVRESA-N 1 1 331.460 3.911 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000512710249 1040586198 /nfs/dbraw/zinc/58/61/98/1040586198.db2.gz PMDAPTNIVKIBRE-OAHLLOKOSA-N 1 1 332.425 3.872 20 5 EHBDMO Cc1c(C[N@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000553952460 1040625739 /nfs/dbraw/zinc/62/57/39/1040625739.db2.gz UXDQJBYKQXXMMI-CVEARBPZSA-N 1 1 342.439 3.890 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000600197037 1040812697 /nfs/dbraw/zinc/81/26/97/1040812697.db2.gz QDSCQURWABUJNA-WMLDXEAASA-N 1 1 348.443 3.703 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491087489 1040910627 /nfs/dbraw/zinc/91/06/27/1040910627.db2.gz JGZDQTNELPJMQD-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCSC1 ZINC000433186045 1041024187 /nfs/dbraw/zinc/02/41/87/1041024187.db2.gz HNAOTKKRZVJLMC-AWEZNQCLSA-N 1 1 344.864 3.592 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCSC1 ZINC000433186045 1041024203 /nfs/dbraw/zinc/02/42/03/1041024203.db2.gz HNAOTKKRZVJLMC-AWEZNQCLSA-N 1 1 344.864 3.592 20 5 EHBDMO CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@H]21 ZINC000555721463 1041059863 /nfs/dbraw/zinc/05/98/63/1041059863.db2.gz REJPPJATMIELLI-CABCVRRESA-N 1 1 342.399 3.655 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000150741054 1041221971 /nfs/dbraw/zinc/22/19/71/1041221971.db2.gz DBOBNVLMFCWITE-AWEZNQCLSA-N 1 1 349.431 3.587 20 5 EHBDMO O=[N+]([O-])c1cccc2c(NC[C@H]3CCCC[N@H+]3C3CC3)ccnc21 ZINC000432152550 1041654251 /nfs/dbraw/zinc/65/42/51/1041654251.db2.gz KBPCWMDEGNUOFR-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(F)cc2Br)c1 ZINC000049592509 1042472557 /nfs/dbraw/zinc/47/25/57/1042472557.db2.gz CSLJHMRQILTTGM-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000053814011 1042547576 /nfs/dbraw/zinc/54/75/76/1042547576.db2.gz DFFTYZCORJQFRZ-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](C)c1cccs1 ZINC000053814011 1042547579 /nfs/dbraw/zinc/54/75/79/1042547579.db2.gz DFFTYZCORJQFRZ-LBPRGKRZSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000014929919 1042656508 /nfs/dbraw/zinc/65/65/08/1042656508.db2.gz SCMZBBKALMQFLX-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585743448 1043018061 /nfs/dbraw/zinc/01/80/61/1043018061.db2.gz OEVJXOZZUKGPRO-NTEUORMPSA-N 1 1 336.395 3.707 20 5 EHBDMO CCC[C@@H](NCCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421088 1043157889 /nfs/dbraw/zinc/15/78/89/1043157889.db2.gz FSRYGANXJJIWEW-QFBILLFUSA-N 1 1 349.475 3.527 20 5 EHBDMO CCC[C@@H](NCCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421088 1043157893 /nfs/dbraw/zinc/15/78/93/1043157893.db2.gz FSRYGANXJJIWEW-QFBILLFUSA-N 1 1 349.475 3.527 20 5 EHBDMO C[C@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1C ZINC000090095027 1043382148 /nfs/dbraw/zinc/38/21/48/1043382148.db2.gz WVBSFPKPIMBFMF-HOCLYGCPSA-N 1 1 340.427 3.576 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210859 1044162550 /nfs/dbraw/zinc/16/25/50/1044162550.db2.gz FWIQXLHOROAZRZ-SJORKVTESA-N 1 1 331.460 3.681 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000500460239 1044863851 /nfs/dbraw/zinc/86/38/51/1044863851.db2.gz XAGBOIFEOUOCBO-ZDUSSCGKSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774635 1127154414 /nfs/dbraw/zinc/15/44/14/1127154414.db2.gz XIPOTSPPRPLUJG-GJZGRUSLSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068980 1127569782 /nfs/dbraw/zinc/56/97/82/1127569782.db2.gz UUHLSDBARMJYBS-IAGOWNOFSA-N 1 1 346.456 3.570 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000282220537 1128097586 /nfs/dbraw/zinc/09/75/86/1128097586.db2.gz HYNJQAUBNSDKQW-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477794 1131242236 /nfs/dbraw/zinc/24/22/36/1131242236.db2.gz UMDLYFQDCXRZKI-PBHICJAKSA-N 1 1 336.395 3.780 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)c2ccncc21 ZINC000301465042 1128458619 /nfs/dbraw/zinc/45/86/19/1128458619.db2.gz LGLPTVZJCAMYPQ-HNNXBMFYSA-N 1 1 340.427 3.819 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(F)c(OC)c1 ZINC000153590711 1128488619 /nfs/dbraw/zinc/48/86/19/1128488619.db2.gz NXXRGGUWVSZCAS-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153605112 1128508418 /nfs/dbraw/zinc/50/84/18/1128508418.db2.gz SEOLQIMBSBYRLM-UHFFFAOYSA-N 1 1 340.855 3.592 20 5 EHBDMO Cc1cccc(N2CCC(Oc3cc[nH+]cc3C)CC2)c1[N+](=O)[O-] ZINC000338704967 1128722689 /nfs/dbraw/zinc/72/26/89/1128722689.db2.gz DLOBNNJXGKYTIR-UHFFFAOYSA-N 1 1 327.384 3.654 20 5 EHBDMO CCOC1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000091676463 1128779214 /nfs/dbraw/zinc/77/92/14/1128779214.db2.gz PDFVFHSMXZAGKN-UHFFFAOYSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[N@H+](CCSC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001659299364 1120104921 /nfs/dbraw/zinc/10/49/21/1120104921.db2.gz OWMPMNFUKIOGEX-UHFFFAOYSA-N 1 1 333.251 3.542 20 5 EHBDMO CC[N@@H+](CCSC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001659299364 1120104925 /nfs/dbraw/zinc/10/49/25/1120104925.db2.gz OWMPMNFUKIOGEX-UHFFFAOYSA-N 1 1 333.251 3.542 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccn(C)n1 ZINC000494467669 1120564989 /nfs/dbraw/zinc/56/49/89/1120564989.db2.gz RLEXQDOLQMYYLK-ZDUSSCGKSA-N 1 1 342.321 3.588 20 5 EHBDMO C[N@@H+]1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957922 1128948964 /nfs/dbraw/zinc/94/89/64/1128948964.db2.gz GEXGWCMCZKGRGG-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957922 1128948969 /nfs/dbraw/zinc/94/89/69/1128948969.db2.gz GEXGWCMCZKGRGG-WMZOPIPTSA-N 1 1 345.830 3.783 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cc(F)cc3cccnc31)C2 ZINC000153286622 1120937892 /nfs/dbraw/zinc/93/78/92/1120937892.db2.gz PCZQMSPKOPWANV-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cc(F)cc3cccnc31)C2 ZINC000153286622 1120937896 /nfs/dbraw/zinc/93/78/96/1120937896.db2.gz PCZQMSPKOPWANV-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO CCCCCC[N@H+](C)Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000762301196 1121243122 /nfs/dbraw/zinc/24/31/22/1121243122.db2.gz YEKWJXAOOSOQCQ-UHFFFAOYSA-N 1 1 346.431 3.889 20 5 EHBDMO CCCCCC[N@@H+](C)Cc1nc(Cc2ccc([N+](=O)[O-])c(C)c2)no1 ZINC000762301196 1121243125 /nfs/dbraw/zinc/24/31/25/1121243125.db2.gz YEKWJXAOOSOQCQ-UHFFFAOYSA-N 1 1 346.431 3.889 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311162900 1128984750 /nfs/dbraw/zinc/98/47/50/1128984750.db2.gz PZIWBSAGHGOIJV-INIZCTEOSA-N 1 1 341.411 3.537 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3ccccc3C2)c2ncccc12 ZINC000301091585 1121583357 /nfs/dbraw/zinc/58/33/57/1121583357.db2.gz WGTXSINTIJAYTQ-UHFFFAOYSA-N 1 1 348.406 3.613 20 5 EHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143294 1121783825 /nfs/dbraw/zinc/78/38/25/1121783825.db2.gz OXLCSTUULHJZSO-WFASDCNBSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180158 1121797990 /nfs/dbraw/zinc/79/79/90/1121797990.db2.gz GNNJYBDKEINUEP-SWLSCSKDSA-N 1 1 330.388 3.655 20 5 EHBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000461615810 1122128655 /nfs/dbraw/zinc/12/86/55/1122128655.db2.gz FZNUSTLGHAMEFM-GFCCVEGCSA-N 1 1 349.456 3.660 20 5 EHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000497201731 1122370351 /nfs/dbraw/zinc/37/03/51/1122370351.db2.gz WXZMKCYBWWJKKJ-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000497201731 1122370359 /nfs/dbraw/zinc/37/03/59/1122370359.db2.gz WXZMKCYBWWJKKJ-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCC[C@H]1O ZINC000497264042 1122428471 /nfs/dbraw/zinc/42/84/71/1122428471.db2.gz VZSCOOCIXQXDGY-RDTXWAMCSA-N 1 1 344.411 3.838 20 5 EHBDMO CCCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)CC ZINC000917436377 1122601585 /nfs/dbraw/zinc/60/15/85/1122601585.db2.gz BZTRFPQUHDPKOT-AWEZNQCLSA-N 1 1 331.420 3.711 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000609672666 1123641609 /nfs/dbraw/zinc/64/16/09/1123641609.db2.gz WAOXMCXHAVGYLV-GDBMZVCRSA-N 1 1 326.396 3.981 20 5 EHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(Cc2ccccc2)CC1 ZINC000114481255 1129149575 /nfs/dbraw/zinc/14/95/75/1129149575.db2.gz KATFEKYZIGUCFL-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(Cc2ccccc2)CC1 ZINC000114481255 1129149578 /nfs/dbraw/zinc/14/95/78/1129149578.db2.gz KATFEKYZIGUCFL-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836026 1123884361 /nfs/dbraw/zinc/88/43/61/1123884361.db2.gz HCDDJXOIXIMFDU-HFQYIWAZSA-N 1 1 326.400 3.601 20 5 EHBDMO Cc1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000080543903 1124006337 /nfs/dbraw/zinc/00/63/37/1124006337.db2.gz DJBXMIKVXJVVBH-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccccc1 ZINC000181670887 1125008856 /nfs/dbraw/zinc/00/88/56/1125008856.db2.gz ULVFCKCKSKTMBE-GOSISDBHSA-N 1 1 344.411 3.859 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000182356142 1125267172 /nfs/dbraw/zinc/26/71/72/1125267172.db2.gz OOZQBERVYYPXTJ-KDOFPFPSSA-N 1 1 349.862 3.697 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000619698897 1125383976 /nfs/dbraw/zinc/38/39/76/1125383976.db2.gz KCXDEJIGMBFXQO-LBPRGKRZSA-N 1 1 332.429 3.573 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)c2C1 ZINC000066515184 1129180239 /nfs/dbraw/zinc/18/02/39/1129180239.db2.gz JJONZZVLITUCHT-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)c2C1 ZINC000066515184 1129180240 /nfs/dbraw/zinc/18/02/40/1129180240.db2.gz JJONZZVLITUCHT-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891197 1129283845 /nfs/dbraw/zinc/28/38/45/1129283845.db2.gz UNHCMNHRBYCPRR-WMLDXEAASA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247737 1129371108 /nfs/dbraw/zinc/37/11/08/1129371108.db2.gz HYTRUVCPMJZSAN-ZIAGYGMSSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1cccn2c(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc12 ZINC000154290454 1129547457 /nfs/dbraw/zinc/54/74/57/1129547457.db2.gz DWFKNNDUGZKLHH-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1cccn2c(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc12 ZINC000154290454 1129547460 /nfs/dbraw/zinc/54/74/60/1129547460.db2.gz DWFKNNDUGZKLHH-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO COc1cccc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000389794509 1129590158 /nfs/dbraw/zinc/59/01/58/1129590158.db2.gz SGRBJJCNIXSKJF-WMLDXEAASA-N 1 1 341.411 3.536 20 5 EHBDMO CSC[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093761643 1129602067 /nfs/dbraw/zinc/60/20/67/1129602067.db2.gz PPWBUBICIVDYLH-LBPRGKRZSA-N 1 1 332.372 3.524 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093761643 1129602069 /nfs/dbraw/zinc/60/20/69/1129602069.db2.gz PPWBUBICIVDYLH-LBPRGKRZSA-N 1 1 332.372 3.524 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000331316970 1129660676 /nfs/dbraw/zinc/66/06/76/1129660676.db2.gz APTDDDVUKPPNNC-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000509030912 1129671859 /nfs/dbraw/zinc/67/18/59/1129671859.db2.gz KLWISOUNMUSEMC-ACJLOTCBSA-N 1 1 348.349 3.740 20 5 EHBDMO C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302040819 1129765298 /nfs/dbraw/zinc/76/52/98/1129765298.db2.gz HYTJPRWNDBIZAP-NWDGAFQWSA-N 1 1 339.386 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000302974460 1129803541 /nfs/dbraw/zinc/80/35/41/1129803541.db2.gz JCLQEEJFKIHNNI-QGZVFWFLSA-N 1 1 326.396 3.853 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC000303204375 1129828045 /nfs/dbraw/zinc/82/80/45/1129828045.db2.gz PETILWCCFVGLHX-UHFFFAOYSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)cs1 ZINC000173985009 1130327896 /nfs/dbraw/zinc/32/78/96/1130327896.db2.gz GDADBKFBDACWIW-OAHLLOKOSA-N 1 1 332.425 3.695 20 5 EHBDMO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCCC[C@H]1C ZINC000731206207 1130779098 /nfs/dbraw/zinc/77/90/98/1130779098.db2.gz BHKMWMZJYNVBEX-VXGBXAGGSA-N 1 1 334.445 3.879 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905334 1131886799 /nfs/dbraw/zinc/88/67/99/1131886799.db2.gz RFKALELCSMBZLM-HOCLYGCPSA-N 1 1 342.361 3.911 20 5 EHBDMO CC[N@@H+](CCN1CCCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922181 1131905251 /nfs/dbraw/zinc/90/52/51/1131905251.db2.gz WUDSERVDLIHRAG-IBGZPJMESA-N 1 1 345.487 3.650 20 5 EHBDMO CC[N@@H+](CCN1CCCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922182 1131905273 /nfs/dbraw/zinc/90/52/73/1131905273.db2.gz WUDSERVDLIHRAG-LJQANCHMSA-N 1 1 345.487 3.650 20 5 EHBDMO CC1(C)CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009922 1131935959 /nfs/dbraw/zinc/93/59/59/1131935959.db2.gz JTIDTVCAGFXZBJ-UHFFFAOYSA-N 1 1 339.386 3.716 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000743856557 1131988909 /nfs/dbraw/zinc/98/89/09/1131988909.db2.gz KPQWMLZLCFOBON-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2Cc3cccc(C)c3C2)c1F ZINC001173179707 1131992134 /nfs/dbraw/zinc/99/21/34/1131992134.db2.gz GFYYGKHGJJQQPG-ZDUSSCGKSA-N 1 1 344.386 3.998 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2Cc3cccc(C)c3C2)c1F ZINC001173179707 1131992141 /nfs/dbraw/zinc/99/21/41/1131992141.db2.gz GFYYGKHGJJQQPG-ZDUSSCGKSA-N 1 1 344.386 3.998 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCN(C)C)c1ccccc1 ZINC001173215704 1132002337 /nfs/dbraw/zinc/00/23/37/1132002337.db2.gz YTWWSUCQZZNNCU-JXFKEZNVSA-N 1 1 341.455 3.808 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1Cc1ccccn1 ZINC001173228539 1132008606 /nfs/dbraw/zinc/00/86/06/1132008606.db2.gz XMSPKYVQYRCTLA-BEFAXECRSA-N 1 1 325.412 3.628 20 5 EHBDMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046722 1132642035 /nfs/dbraw/zinc/64/20/35/1132642035.db2.gz MGIQHAOMOMFCIQ-ZFWWWQNUSA-N 1 1 330.350 3.973 20 5 EHBDMO CC1CC[NH+](CC[C@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353473 1132646943 /nfs/dbraw/zinc/64/69/43/1132646943.db2.gz ZTTDOXYWBWQQDH-LJQANCHMSA-N 1 1 345.487 3.724 20 5 EHBDMO CCOc1ccc(CC[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC001176832786 1133004067 /nfs/dbraw/zinc/00/40/67/1133004067.db2.gz ILZOTJDEVCCQAB-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]Cc1ccsc1 ZINC001177272655 1133050786 /nfs/dbraw/zinc/05/07/86/1133050786.db2.gz MENNPKZBCRZHHP-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO CSC[C@@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000767772816 1133050839 /nfs/dbraw/zinc/05/08/39/1133050839.db2.gz ZQESZQQYOAFHCC-NSHDSACASA-N 1 1 339.442 3.657 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000767772816 1133050846 /nfs/dbraw/zinc/05/08/46/1133050846.db2.gz ZQESZQQYOAFHCC-NSHDSACASA-N 1 1 339.442 3.657 20 5 EHBDMO COCC[C@H]1CCCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940064 1133073772 /nfs/dbraw/zinc/07/37/72/1133073772.db2.gz DHCLZEZKMKUSKX-CYBMUJFWSA-N 1 1 326.824 3.887 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246254 1133250858 /nfs/dbraw/zinc/25/08/58/1133250858.db2.gz YOWMXNWIGUYFLE-AZUAARDMSA-N 1 1 340.423 3.991 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1nc(Cl)c(Cl)cc1[N+](=O)[O-] ZINC001156928400 1133557440 /nfs/dbraw/zinc/55/74/40/1133557440.db2.gz KGPCXNLFFPWDKG-SNVBAGLBSA-N 1 1 347.246 3.973 20 5 EHBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCCC[C@@H]2F)cc1Br ZINC001183226908 1133781324 /nfs/dbraw/zinc/78/13/24/1133781324.db2.gz KWUTUMKQPYBPBE-VHSXEESVSA-N 1 1 337.214 3.789 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2C(C)=O)c1 ZINC000786583054 1133870714 /nfs/dbraw/zinc/87/07/14/1133870714.db2.gz LJLGPEJKIXSDIG-UHFFFAOYSA-N 1 1 341.411 3.861 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000786574914 1133876706 /nfs/dbraw/zinc/87/67/06/1133876706.db2.gz RTBGQTNQKVECCP-KRWDZBQOSA-N 1 1 343.383 3.639 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000746671972 1133990465 /nfs/dbraw/zinc/99/04/65/1133990465.db2.gz CYRYNVPJZPODHK-DOMZBBRYSA-N 1 1 325.840 3.553 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476060 1134129693 /nfs/dbraw/zinc/12/96/93/1134129693.db2.gz MULKWSVVIPFKMT-INIZCTEOSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1F ZINC000788484243 1134137696 /nfs/dbraw/zinc/13/76/96/1134137696.db2.gz YJZABBQNAQDPCN-HNNXBMFYSA-N 1 1 344.342 3.800 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1F ZINC000788484243 1134137701 /nfs/dbraw/zinc/13/77/01/1134137701.db2.gz YJZABBQNAQDPCN-HNNXBMFYSA-N 1 1 344.342 3.800 20 5 EHBDMO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788671868 1134159671 /nfs/dbraw/zinc/15/96/71/1134159671.db2.gz ZPGRCALWYYPVTI-YMTOWFKASA-N 1 1 333.775 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC=C(c3ccccc3)C2)c1 ZINC000789545244 1134294320 /nfs/dbraw/zinc/29/43/20/1134294320.db2.gz GBCQMIHWCJVPKV-UHFFFAOYSA-N 1 1 334.379 3.691 20 5 EHBDMO O=C1C[C@@]2(CC[N@@H+](Cc3c4ccccc4cc4ccccc43)C2)CN1 ZINC000789770453 1134329169 /nfs/dbraw/zinc/32/91/69/1134329169.db2.gz XTFYLNVWOJBEJT-QFIPXVFZSA-N 1 1 330.431 3.705 20 5 EHBDMO C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+]1C1CCCC1 ZINC001187624172 1134357886 /nfs/dbraw/zinc/35/78/86/1134357886.db2.gz ASYOSGKBFHFGSC-GFCCVEGCSA-N 1 1 346.456 3.658 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001190846195 1134759373 /nfs/dbraw/zinc/75/93/73/1134759373.db2.gz JLCWVZBAZGVQQF-SFHVURJKSA-N 1 1 340.423 3.928 20 5 EHBDMO Cc1ccc([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001193325020 1135125200 /nfs/dbraw/zinc/12/52/00/1135125200.db2.gz XWUXQFHVHMVVFK-QGZVFWFLSA-N 1 1 326.396 3.772 20 5 EHBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195015075 1135349524 /nfs/dbraw/zinc/34/95/24/1135349524.db2.gz RSCJUZDDHUGWIJ-AWEZNQCLSA-N 1 1 332.375 3.676 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC001195810966 1135474596 /nfs/dbraw/zinc/47/45/96/1135474596.db2.gz WXEZXUPGEOQAPT-QGZVFWFLSA-N 1 1 336.432 3.771 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OC(C)C)C1 ZINC001195810966 1135474597 /nfs/dbraw/zinc/47/45/97/1135474597.db2.gz WXEZXUPGEOQAPT-QGZVFWFLSA-N 1 1 336.432 3.771 20 5 EHBDMO CCC(CC)[C@H](CNC/C(C)=C\c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC001199170655 1135884748 /nfs/dbraw/zinc/88/47/48/1135884748.db2.gz LZCHRVRIPWXFKP-HVEPWOEZSA-N 1 1 333.476 3.954 20 5 EHBDMO CC1CC[NH+](CCNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC001199268418 1135891807 /nfs/dbraw/zinc/89/18/07/1135891807.db2.gz XHCZTCGONMKJTF-UHFFFAOYSA-N 1 1 343.427 3.676 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809788537 1135892056 /nfs/dbraw/zinc/89/20/56/1135892056.db2.gz SSRSSALOBLOTQB-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO COC(=O)CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000809946420 1135903469 /nfs/dbraw/zinc/90/34/69/1135903469.db2.gz VXXSEQMDDIVGIA-UHFFFAOYSA-N 1 1 349.214 3.675 20 5 EHBDMO C[N@H+](CCc1ccccn1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809966385 1135904278 /nfs/dbraw/zinc/90/42/78/1135904278.db2.gz AIVVAYWWVNDRKT-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](CCc1ccccn1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809966385 1135904281 /nfs/dbraw/zinc/90/42/81/1135904281.db2.gz AIVVAYWWVNDRKT-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1F ZINC000810047052 1135915238 /nfs/dbraw/zinc/91/52/38/1135915238.db2.gz IXOOPZZSBIUCPZ-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO C[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)N1CCN(C)CC1 ZINC000105467019 1135948528 /nfs/dbraw/zinc/94/85/28/1135948528.db2.gz KBMDOFKVVZRDHU-SFHVURJKSA-N 1 1 347.506 3.719 20 5 EHBDMO CC(C)(C)c1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810847381 1136014649 /nfs/dbraw/zinc/01/46/49/1136014649.db2.gz OHCIFOMJJGDRAO-GJZGRUSLSA-N 1 1 346.427 3.676 20 5 EHBDMO CC(C)[N@@H+](C)CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473077 1136095807 /nfs/dbraw/zinc/09/58/07/1136095807.db2.gz OVCHFHQNYNIHDU-UHFFFAOYSA-N 1 1 334.247 3.722 20 5 EHBDMO C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254065 1136104704 /nfs/dbraw/zinc/10/47/04/1136104704.db2.gz QYEVCQLEMUGIGX-QZTJIDSGSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254065 1136104705 /nfs/dbraw/zinc/10/47/05/1136104705.db2.gz QYEVCQLEMUGIGX-QZTJIDSGSA-N 1 1 345.830 3.783 20 5 EHBDMO C[C@@H](C1CC1)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271956 1136124186 /nfs/dbraw/zinc/12/41/86/1136124186.db2.gz PIGGULWUPYBOBQ-YWZLYKJASA-N 1 1 340.423 3.929 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812853795 1136262181 /nfs/dbraw/zinc/26/21/81/1136262181.db2.gz KGVWDAXGXDUWDJ-AUUYWEPGSA-N 1 1 344.411 3.547 20 5 EHBDMO Cc1noc(C[NH+]2CCC(c3cc4ccccc4[nH]3)CC2)c1[N+](=O)[O-] ZINC000851738530 1136402946 /nfs/dbraw/zinc/40/29/46/1136402946.db2.gz JUILJDIBXVLLJX-UHFFFAOYSA-N 1 1 340.383 3.752 20 5 EHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583859 1136442473 /nfs/dbraw/zinc/44/24/73/1136442473.db2.gz GMKLKTWJRPXIIA-WOJBJXKFSA-N 1 1 340.423 3.644 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582933 1136442542 /nfs/dbraw/zinc/44/25/42/1136442542.db2.gz DHHYJAJJTFQEHK-RTBURBONSA-N 1 1 326.396 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)cc1 ZINC000776578051 1136443455 /nfs/dbraw/zinc/44/34/55/1136443455.db2.gz CSAZXMUZXYTHMR-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO CC(C)c1ccc([C@H]([NH3+])CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951843 1136850901 /nfs/dbraw/zinc/85/09/01/1136850901.db2.gz BCKFXLQUZIRPPA-FZKQIMNGSA-N 1 1 342.443 3.651 20 5 EHBDMO C/C(=C/C(=O)Nc1cc(C)c2[nH+]ccn2c1)c1ccc([N+](=O)[O-])cc1 ZINC000818057589 1136861234 /nfs/dbraw/zinc/86/12/34/1136861234.db2.gz TVNKNEIAYIDTGS-BENRWUELSA-N 1 1 336.351 3.593 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000818180150 1136863247 /nfs/dbraw/zinc/86/32/47/1136863247.db2.gz UBJWKJLDMSNMGW-GFCCVEGCSA-N 1 1 348.374 3.876 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c1 ZINC000339015681 1136995331 /nfs/dbraw/zinc/99/53/31/1136995331.db2.gz WPCFZVODFYIFHG-IAQYHMDHSA-N 1 1 344.333 3.615 20 5 EHBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000859529387 1137018489 /nfs/dbraw/zinc/01/84/89/1137018489.db2.gz RIAIKFQGGKTHGC-ZDUSSCGKSA-N 1 1 337.420 3.502 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1F ZINC000860102787 1137044502 /nfs/dbraw/zinc/04/45/02/1137044502.db2.gz HFUWPDBWGJLLCB-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000844402913 1137217544 /nfs/dbraw/zinc/21/75/44/1137217544.db2.gz WPXMHUAJPUAMJR-LBPRGKRZSA-N 1 1 333.215 3.903 20 5 EHBDMO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000844402913 1137217545 /nfs/dbraw/zinc/21/75/45/1137217545.db2.gz WPXMHUAJPUAMJR-LBPRGKRZSA-N 1 1 333.215 3.903 20 5 EHBDMO O=c1[nH]c2c(cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CCCC2 ZINC000865878311 1137318360 /nfs/dbraw/zinc/31/83/60/1137318360.db2.gz HPPNMACGHBKMRU-UHFFFAOYSA-N 1 1 347.802 3.517 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1ccns1 ZINC000715994603 1137479322 /nfs/dbraw/zinc/47/93/22/1137479322.db2.gz POVBRZCRSPYHLF-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171805317 1137513322 /nfs/dbraw/zinc/51/33/22/1137513322.db2.gz RLTKFOMMLZUHES-MRXNPFEDSA-N 1 1 345.443 3.744 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017152 1137564697 /nfs/dbraw/zinc/56/46/97/1137564697.db2.gz VICBPCHWKXBGFU-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064581 1137569192 /nfs/dbraw/zinc/56/91/92/1137569192.db2.gz ZXWSBENOBIDEKU-LBPRGKRZSA-N 1 1 332.375 3.812 20 5 EHBDMO Cc1nccnc1[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000872133490 1137573402 /nfs/dbraw/zinc/57/34/02/1137573402.db2.gz NDVKYUNUMYPWHM-MLGOLLRUSA-N 1 1 326.400 3.766 20 5 EHBDMO Cc1csc([C@H]2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872736434 1137583462 /nfs/dbraw/zinc/58/34/62/1137583462.db2.gz AGJCAYYVIXYHIY-LBPRGKRZSA-N 1 1 340.408 3.902 20 5 EHBDMO COc1cc2c(c(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000873183669 1137592858 /nfs/dbraw/zinc/59/28/58/1137592858.db2.gz ZJBZAHRHZKRDHM-STQMWFEESA-N 1 1 342.395 3.778 20 5 EHBDMO CN(CCCCCC[NH3+])Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000873231543 1137594509 /nfs/dbraw/zinc/59/45/09/1137594509.db2.gz MYCPHHJFJFIOTQ-UHFFFAOYSA-N 1 1 348.472 3.669 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](c1ccccc1F)[C@@H](C)O ZINC000877609981 1137682840 /nfs/dbraw/zinc/68/28/40/1137682840.db2.gz GBFOYFXUSGLOTD-FZKQIMNGSA-N 1 1 332.375 3.562 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000877819660 1137691489 /nfs/dbraw/zinc/69/14/89/1137691489.db2.gz HHQPLHCOQRCQSX-HMVFGEFZSA-N 1 1 344.333 3.651 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000877819660 1137691490 /nfs/dbraw/zinc/69/14/90/1137691490.db2.gz HHQPLHCOQRCQSX-HMVFGEFZSA-N 1 1 344.333 3.651 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCCC1 ZINC000877908669 1137695106 /nfs/dbraw/zinc/69/51/06/1137695106.db2.gz SWLJGVRTXNITLO-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928033 1137695954 /nfs/dbraw/zinc/69/59/54/1137695954.db2.gz KVYOFSRPLBIKSI-JTQLQIEISA-N 1 1 338.795 3.775 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020300 1137699880 /nfs/dbraw/zinc/69/98/80/1137699880.db2.gz NDCPKSFNIAWJOI-ZDUSSCGKSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878152396 1137704778 /nfs/dbraw/zinc/70/47/78/1137704778.db2.gz BBFVUDSLVTYKHE-ZDUSSCGKSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@H](C3CCCC3)C2)o1 ZINC000878720966 1137726201 /nfs/dbraw/zinc/72/62/01/1137726201.db2.gz RMORJGIZDKGSFJ-AWEZNQCLSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC23CCCC3)o1 ZINC000878801285 1137728583 /nfs/dbraw/zinc/72/85/83/1137728583.db2.gz IVNKFSGFMAFEQW-UHFFFAOYSA-N 1 1 348.790 3.817 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC23CCCC3)o1 ZINC000878801285 1137728584 /nfs/dbraw/zinc/72/85/84/1137728584.db2.gz IVNKFSGFMAFEQW-UHFFFAOYSA-N 1 1 348.790 3.817 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879751669 1137758150 /nfs/dbraw/zinc/75/81/50/1137758150.db2.gz LMDLFBUUENHLHS-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cncc(C)c1 ZINC000879751669 1137758151 /nfs/dbraw/zinc/75/81/51/1137758151.db2.gz LMDLFBUUENHLHS-QGZVFWFLSA-N 1 1 327.384 3.644 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC4(CCCCO4)CC3)c2c1 ZINC000882949575 1137839440 /nfs/dbraw/zinc/83/94/40/1137839440.db2.gz XEWSOESZYSDMER-UHFFFAOYSA-N 1 1 327.384 3.683 20 5 EHBDMO CCC[C@@H](C)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000883257405 1137850900 /nfs/dbraw/zinc/85/09/00/1137850900.db2.gz AMGAIDKIWUEMKW-RHSMWYFYSA-N 1 1 330.432 3.834 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824706 1137922082 /nfs/dbraw/zinc/92/20/82/1137922082.db2.gz QAKPTFDMNZWLRR-SUMWQHHRSA-N 1 1 328.416 3.843 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000121060641 1137954717 /nfs/dbraw/zinc/95/47/17/1137954717.db2.gz SPULUNFNDVKWCE-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(OC(F)(F)F)c1 ZINC000886114350 1138048065 /nfs/dbraw/zinc/04/80/65/1138048065.db2.gz NCBBOJDYYWECLX-SNVBAGLBSA-N 1 1 341.289 3.739 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCSC[C@@H]1c1ccccc1 ZINC000886317920 1138067008 /nfs/dbraw/zinc/06/70/08/1138067008.db2.gz DVZNBYUIFRJUQY-MRXNPFEDSA-N 1 1 329.425 3.670 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC000886317920 1138067010 /nfs/dbraw/zinc/06/70/10/1138067010.db2.gz DVZNBYUIFRJUQY-MRXNPFEDSA-N 1 1 329.425 3.670 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2cc(C3CC3)no2)c2cc([N+](=O)[O-])ccc21 ZINC000886684922 1138115096 /nfs/dbraw/zinc/11/50/96/1138115096.db2.gz WCVWOMLKGMDQMN-QGZVFWFLSA-N 1 1 327.384 3.972 20 5 EHBDMO CC(C)(C)N1CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000089512896 1138200723 /nfs/dbraw/zinc/20/07/23/1138200723.db2.gz FSLOGTBHGSZDAU-SFHVURJKSA-N 1 1 345.487 3.768 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)s1 ZINC000126656019 1138334920 /nfs/dbraw/zinc/33/49/20/1138334920.db2.gz GPYWGAWEDYONNI-PBWFPOADSA-N 1 1 344.436 3.811 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174478279 1139423173 /nfs/dbraw/zinc/42/31/73/1139423173.db2.gz MNUYJVADMNDZDL-INIZCTEOSA-N 1 1 347.462 3.802 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000178729452 1139715521 /nfs/dbraw/zinc/71/55/21/1139715521.db2.gz NNJUPJFWUUJBKF-GFCCVEGCSA-N 1 1 345.355 3.671 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500569 1139760951 /nfs/dbraw/zinc/76/09/51/1139760951.db2.gz FGHSMVRJFPVCSV-WFASDCNBSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000179500569 1139760955 /nfs/dbraw/zinc/76/09/55/1139760955.db2.gz FGHSMVRJFPVCSV-WFASDCNBSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000179500569 1139760960 /nfs/dbraw/zinc/76/09/60/1139760960.db2.gz FGHSMVRJFPVCSV-WFASDCNBSA-N 1 1 341.415 3.531 20 5 EHBDMO Nc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000193399575 1140575353 /nfs/dbraw/zinc/57/53/53/1140575353.db2.gz YRWBDWZASPMTBK-ZDUSSCGKSA-N 1 1 346.456 3.563 20 5 EHBDMO Cc1nc2sccn2c1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000268228781 1140906109 /nfs/dbraw/zinc/90/61/09/1140906109.db2.gz KMULFSHJBQNFFG-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO Cc1nc2sccn2c1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000268228781 1140906112 /nfs/dbraw/zinc/90/61/12/1140906112.db2.gz KMULFSHJBQNFFG-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271656896 1141413744 /nfs/dbraw/zinc/41/37/44/1141413744.db2.gz WLIGCKAWIKSKGE-HUUCEWRRSA-N 1 1 341.411 3.889 20 5 EHBDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000283176109 1141567845 /nfs/dbraw/zinc/56/78/45/1141567845.db2.gz PVWYQNIXZLZBFX-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000078625285 217089999 /nfs/dbraw/zinc/08/99/99/217089999.db2.gz YUMXOCPYYNLACX-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO CCn1cc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000536668131 1032092402 /nfs/dbraw/zinc/09/24/02/1032092402.db2.gz LKEDDZJYCVOQPN-UHFFFAOYSA-N 1 1 340.383 3.703 20 5 EHBDMO CCn1cc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000536668131 1032092423 /nfs/dbraw/zinc/09/24/23/1032092423.db2.gz LKEDDZJYCVOQPN-UHFFFAOYSA-N 1 1 340.383 3.703 20 5 EHBDMO CC[C@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680285 1032122543 /nfs/dbraw/zinc/12/25/43/1032122543.db2.gz LMBDJUNXJWBDFN-WBVHZDCISA-N 1 1 340.427 3.670 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432138 1016241064 /nfs/dbraw/zinc/24/10/64/1016241064.db2.gz RDKJEEDLWGEHKI-OLZOCXBDSA-N 1 1 336.823 3.569 20 5 EHBDMO COc1ccc(C[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000414844370 1017236693 /nfs/dbraw/zinc/23/66/93/1017236693.db2.gz KTGVGBROVQZQFC-KRWDZBQOSA-N 1 1 343.427 3.516 20 5 EHBDMO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000538278703 1032266730 /nfs/dbraw/zinc/26/67/30/1032266730.db2.gz AJTQVDQTBRXRIV-KGLIPLIRSA-N 1 1 327.384 3.581 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000485143985 1032332712 /nfs/dbraw/zinc/33/27/12/1032332712.db2.gz JZTLDMVVWJAZMX-OAHLLOKOSA-N 1 1 341.411 3.752 20 5 EHBDMO CC[N@@H+](C[C@@H]1COc2ccccc2O1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189006 1032369016 /nfs/dbraw/zinc/36/90/16/1032369016.db2.gz FKGWQLJOKCEKOP-HUUCEWRRSA-N 1 1 342.395 3.818 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CCCSCC3)o2)c([N+](=O)[O-])c1 ZINC000508640813 1032412999 /nfs/dbraw/zinc/41/29/99/1032412999.db2.gz VLCLDJOYIHMJKT-UHFFFAOYSA-N 1 1 348.424 3.802 20 5 EHBDMO COCc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000278759811 1032422341 /nfs/dbraw/zinc/42/23/41/1032422341.db2.gz NVCGCFHYHOPMDK-UHFFFAOYSA-N 1 1 344.289 3.643 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2noc3ccccc32)C2CC2)c1 ZINC000593963692 1032644523 /nfs/dbraw/zinc/64/45/23/1032644523.db2.gz SOSHIEOWQDOCSA-UHFFFAOYSA-N 1 1 337.379 3.943 20 5 EHBDMO COc1cc(C)nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504368 1032687585 /nfs/dbraw/zinc/68/75/85/1032687585.db2.gz VVKRQVCHBJSLLK-MRXNPFEDSA-N 1 1 341.411 3.686 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2cc(N)ccc2O1 ZINC000415025508 1017414345 /nfs/dbraw/zinc/41/43/45/1017414345.db2.gz QILICINSPZXHMN-OAHLLOKOSA-N 1 1 327.384 3.569 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CCn3cc[nH+]c3C2)c(Cl)c1 ZINC000547961533 1017670004 /nfs/dbraw/zinc/67/00/04/1017670004.db2.gz HZZICGAMLLVXBI-QMMMGPOBSA-N 1 1 327.171 3.525 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185876063 1017792422 /nfs/dbraw/zinc/79/24/22/1017792422.db2.gz PNRKMSQTMGYSIX-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](CCO)c1ccccc1 ZINC000122710013 1018570622 /nfs/dbraw/zinc/57/06/22/1018570622.db2.gz QNYMJPRYRJEXMZ-MRXNPFEDSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@H](N[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997939 1018935178 /nfs/dbraw/zinc/93/51/78/1018935178.db2.gz CRGBNLRVOJOOIM-BXWFABGCSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997939 1018935194 /nfs/dbraw/zinc/93/51/94/1018935194.db2.gz CRGBNLRVOJOOIM-BXWFABGCSA-N 1 1 339.439 3.908 20 5 EHBDMO C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000473507440 1019077545 /nfs/dbraw/zinc/07/75/45/1019077545.db2.gz LAARLNPUCTZRCF-IBGZPJMESA-N 1 1 348.406 3.636 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412989 1019643453 /nfs/dbraw/zinc/64/34/53/1019643453.db2.gz FQJGSDCNOXFQJS-GNJLHFKMSA-N 1 1 348.406 3.905 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000182828972 1019756859 /nfs/dbraw/zinc/75/68/59/1019756859.db2.gz PWMXJYPBBDBJTG-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000182828972 1019756875 /nfs/dbraw/zinc/75/68/75/1019756875.db2.gz PWMXJYPBBDBJTG-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001167425280 1019764434 /nfs/dbraw/zinc/76/44/34/1019764434.db2.gz PUHZMGHCBDEDTJ-HZPDHXFCSA-N 1 1 347.459 3.988 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000430504955 1019947582 /nfs/dbraw/zinc/94/75/82/1019947582.db2.gz ZJYCRYNZWDXNJG-UHFFFAOYSA-N 1 1 346.475 3.511 20 5 EHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070682 1020059044 /nfs/dbraw/zinc/05/90/44/1020059044.db2.gz NERQALGUEKEALP-JTQLQIEISA-N 1 1 332.347 3.825 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCN(c2ccccc2)C1 ZINC000602440624 1032890223 /nfs/dbraw/zinc/89/02/23/1032890223.db2.gz QNHYCXNBOCGUQN-INIZCTEOSA-N 1 1 325.412 3.553 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138303 1020727354 /nfs/dbraw/zinc/72/73/54/1020727354.db2.gz XTNUSENHHZKUON-KBPBESRZSA-N 1 1 333.432 3.822 20 5 EHBDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449616943 1032936255 /nfs/dbraw/zinc/93/62/55/1032936255.db2.gz FQFGWOMDRKIMOB-AWEZNQCLSA-N 1 1 344.411 3.838 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000518934492 1021687750 /nfs/dbraw/zinc/68/77/50/1021687750.db2.gz ZFLXEEKDGIIYBQ-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CNCC[C@H]3CCC[NH2+]3)s2)cc1 ZINC000414911567 1022052814 /nfs/dbraw/zinc/05/28/14/1022052814.db2.gz WLEDIABHVUHCMI-CQSZACIVSA-N 1 1 331.441 3.555 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441295809 1022138713 /nfs/dbraw/zinc/13/87/13/1022138713.db2.gz UATQVSYPTUBEPB-JKSUJKDBSA-N 1 1 348.443 3.631 20 5 EHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140911 1022176766 /nfs/dbraw/zinc/17/67/66/1022176766.db2.gz LMSANYKSWDPYEN-SOFGYWHQSA-N 1 1 330.359 3.758 20 5 EHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000894921027 1022249868 /nfs/dbraw/zinc/24/98/68/1022249868.db2.gz VLJVRMAKDYWOFN-INIZCTEOSA-N 1 1 338.835 3.885 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CCO)c2ccco2)o1 ZINC000184514874 1022559246 /nfs/dbraw/zinc/55/92/46/1022559246.db2.gz WETFKXPKAWCMGS-HNNXBMFYSA-N 1 1 342.351 3.661 20 5 EHBDMO Cn1ccnc1[C@H](C1CC1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000602686076 1033066329 /nfs/dbraw/zinc/06/63/29/1033066329.db2.gz VKHLNCMMLGMELX-AEFFLSMTSA-N 1 1 340.427 3.659 20 5 EHBDMO CC(C)[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000550186322 1022694010 /nfs/dbraw/zinc/69/40/10/1022694010.db2.gz DVAWTKAHIPJARO-HNNXBMFYSA-N 1 1 346.349 3.861 20 5 EHBDMO CC(C)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000550186322 1022694019 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CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529661 1024039531 /nfs/dbraw/zinc/03/95/31/1024039531.db2.gz AHCIWVCVONQCCL-ARFHVFGLSA-N 1 1 347.459 3.673 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310314753 1024476679 /nfs/dbraw/zinc/47/66/79/1024476679.db2.gz UVVJYXRHXVNUIT-HNNXBMFYSA-N 1 1 329.375 3.668 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncccc1[N+](=O)[O-] ZINC000071954894 1024884891 /nfs/dbraw/zinc/88/48/91/1024884891.db2.gz MCKZAEKEUAMFJQ-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@H+]2C2CCCCC2)c(F)c1 ZINC000435746951 1025122557 /nfs/dbraw/zinc/12/25/57/1025122557.db2.gz CDXJZUPXBCSLFB-QGZVFWFLSA-N 1 1 335.423 3.621 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310352387 1025131437 /nfs/dbraw/zinc/13/14/37/1025131437.db2.gz HFQOPBUEDMJJFX-KRWDZBQOSA-N 1 1 325.412 3.837 20 5 EHBDMO Cc1ccc(C(=O)C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000054295253 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CCOc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504906417 1029050185 /nfs/dbraw/zinc/05/01/85/1029050185.db2.gz XSFHVCQTHSZNNN-PMPSAXMXSA-N 1 1 349.475 3.765 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066367 1029237439 /nfs/dbraw/zinc/23/74/39/1029237439.db2.gz WSJVREGQZGKCNL-DYVFJYSZSA-N 1 1 334.416 3.862 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000505259069 1029416896 /nfs/dbraw/zinc/41/68/96/1029416896.db2.gz BXOSJCFRWCMWOB-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407733 1029839318 /nfs/dbraw/zinc/83/93/18/1029839318.db2.gz HLAMISMXLMIVHU-CABCVRRESA-N 1 1 326.824 3.884 20 5 EHBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525409447 1029840021 /nfs/dbraw/zinc/84/00/21/1029840021.db2.gz ZWWZRGJZHAADCE-ZTFGCOKTSA-N 1 1 348.443 3.629 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CCc1ccccc1 ZINC000441198662 1029932890 /nfs/dbraw/zinc/93/28/90/1029932890.db2.gz NFAUPPYBDGSPIP-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO CC(C)[N@@H+](CCc1ccc2c(c1)CCO2)Cc1ccc([N+](=O)[O-])cc1 ZINC000441212496 1029963918 /nfs/dbraw/zinc/96/39/18/1029963918.db2.gz XMVDKUKSKKGZQK-UHFFFAOYSA-N 1 1 340.423 3.983 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709364 1030048068 /nfs/dbraw/zinc/04/80/68/1030048068.db2.gz VNFCZCWSPMQWII-ZFWWWQNUSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709364 1030048086 /nfs/dbraw/zinc/04/80/86/1030048086.db2.gz VNFCZCWSPMQWII-ZFWWWQNUSA-N 1 1 345.468 3.896 20 5 EHBDMO CC1(C)C[C@H]([N@H+]2CCC[C@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381838 1030162195 /nfs/dbraw/zinc/16/21/95/1030162195.db2.gz RIGNCQNQXOEKMD-HKUYNNGSSA-N 1 1 330.428 3.820 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159527943 1030254191 /nfs/dbraw/zinc/25/41/91/1030254191.db2.gz JKIJQJDKYDPRQV-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509105 1030257084 /nfs/dbraw/zinc/25/70/84/1030257084.db2.gz LUISUPNLAKOLBL-KXBFYZLASA-N 1 1 331.460 3.826 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(C(F)F)cc3)nc2c1 ZINC000526001517 1030341083 /nfs/dbraw/zinc/34/10/83/1030341083.db2.gz XACWVATUHZDJBP-UHFFFAOYSA-N 1 1 332.310 3.699 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000537698513 1031138205 /nfs/dbraw/zinc/13/82/05/1031138205.db2.gz VUCLSPDYJCHPQR-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c2ccncc21 ZINC000594596692 1033443532 /nfs/dbraw/zinc/44/35/32/1033443532.db2.gz BEDQPNFWQPHNQO-FUHWJXTLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCC[N@H+]4CCCC[C@@H]34)c2c1 ZINC000594599888 1033445934 /nfs/dbraw/zinc/44/59/34/1033445934.db2.gz KAYVLJIRRCHUNT-IRXDYDNUSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000611939330 1033452706 /nfs/dbraw/zinc/45/27/06/1033452706.db2.gz IHOZDGYDPDHPQL-CQSZACIVSA-N 1 1 329.400 3.936 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761291529 1033540253 /nfs/dbraw/zinc/54/02/53/1033540253.db2.gz MZFMCFAZQHGMLU-OAHLLOKOSA-N 1 1 348.472 3.818 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583489 1033575175 /nfs/dbraw/zinc/57/51/75/1033575175.db2.gz KKHBVVLBNFZYOE-DOTOQJQBSA-N 1 1 325.412 3.775 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/CN[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594977985 1033579769 /nfs/dbraw/zinc/57/97/69/1033579769.db2.gz PGAQYJMMUXDPCX-JKNJVXJCSA-N 1 1 329.444 3.605 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCN(C2CCCCC2)C1 ZINC000594977985 1033579778 /nfs/dbraw/zinc/57/97/78/1033579778.db2.gz PGAQYJMMUXDPCX-JKNJVXJCSA-N 1 1 329.444 3.605 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1N(C)C ZINC000595020465 1033611639 /nfs/dbraw/zinc/61/16/39/1033611639.db2.gz YXIKFVSCDFOGCO-CYBMUJFWSA-N 1 1 329.400 3.520 20 5 EHBDMO O=[N+]([O-])c1cccc(CN2CCC[N@@H+](CC3CCCCC3)CC2)c1 ZINC000059424662 1033660247 /nfs/dbraw/zinc/66/02/47/1033660247.db2.gz WZXOGBNWCFDPET-UHFFFAOYSA-N 1 1 331.460 3.683 20 5 EHBDMO CCCOc1ccc2c(c1)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001168301955 1033675255 /nfs/dbraw/zinc/67/52/55/1033675255.db2.gz GQPZSDSQXOFUDV-UHFFFAOYSA-N 1 1 340.423 3.984 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000595300275 1033726825 /nfs/dbraw/zinc/72/68/25/1033726825.db2.gz OUFXDZLLHPIKAZ-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000595300275 1033726840 /nfs/dbraw/zinc/72/68/40/1033726840.db2.gz OUFXDZLLHPIKAZ-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO CCn1cc(C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000593677282 1033734528 /nfs/dbraw/zinc/73/45/28/1033734528.db2.gz XCYJMFQFZBOVSN-CLFYSBASSA-N 1 1 328.416 3.735 20 5 EHBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595393695 1033785718 /nfs/dbraw/zinc/78/57/18/1033785718.db2.gz QAYPBKGMRXWWPQ-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595393695 1033785731 /nfs/dbraw/zinc/78/57/31/1033785731.db2.gz QAYPBKGMRXWWPQ-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO CCCC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000595415117 1033788812 /nfs/dbraw/zinc/78/88/12/1033788812.db2.gz MFRBMSSJWCEZNE-OAHLLOKOSA-N 1 1 333.388 3.921 20 5 EHBDMO Cc1cc([C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)ccc1F ZINC000491219601 1033957734 /nfs/dbraw/zinc/95/77/34/1033957734.db2.gz YWRRDSYXUZIHAB-LJQANCHMSA-N 1 1 344.386 3.658 20 5 EHBDMO Cc1cc([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)ccc1F ZINC000491219601 1033957739 /nfs/dbraw/zinc/95/77/39/1033957739.db2.gz YWRRDSYXUZIHAB-LJQANCHMSA-N 1 1 344.386 3.658 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000603855496 1033978249 /nfs/dbraw/zinc/97/82/49/1033978249.db2.gz VXCLXESJMAMWAT-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000603855496 1033978262 /nfs/dbraw/zinc/97/82/62/1033978262.db2.gz VXCLXESJMAMWAT-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](CCF)C1 ZINC000595754767 1033983425 /nfs/dbraw/zinc/98/34/25/1033983425.db2.gz BULVCDAIMWZLBJ-CHWSQXEVSA-N 1 1 348.378 3.777 20 5 EHBDMO C[C@H]1CC[N@@H+](CCN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610448 1034071626 /nfs/dbraw/zinc/07/16/26/1034071626.db2.gz MAWXHWOMPSNDJR-OXJNMPFZSA-N 1 1 339.439 3.616 20 5 EHBDMO C[C@H]1CCN(CC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610448 1034071636 /nfs/dbraw/zinc/07/16/36/1034071636.db2.gz MAWXHWOMPSNDJR-OXJNMPFZSA-N 1 1 339.439 3.616 20 5 EHBDMO COc1cc(NC[C@H]2CCC[N@H+](C(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596096600 1034081700 /nfs/dbraw/zinc/08/17/00/1034081700.db2.gz VGJMZCBBMKZPOT-GFCCVEGCSA-N 1 1 341.839 3.789 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604016834 1034141598 /nfs/dbraw/zinc/14/15/98/1034141598.db2.gz GKVBZQAMYNJEND-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1cc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596308838 1034165242 /nfs/dbraw/zinc/16/52/42/1034165242.db2.gz WMXKRKQTIDMZNB-LLVKDONJSA-N 1 1 341.839 3.789 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596570437 1034294599 /nfs/dbraw/zinc/29/45/99/1034294599.db2.gz KZESNYDUKJOFJP-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO Cc1ccc(C[NH2+]CC(C)(C)N2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604417944 1034371954 /nfs/dbraw/zinc/37/19/54/1034371954.db2.gz SUAASUWSEFVDLY-HUUCEWRRSA-N 1 1 333.476 3.749 20 5 EHBDMO CC(C)C[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179702583 1034584913 /nfs/dbraw/zinc/58/49/13/1034584913.db2.gz FWIRBZZJDUYBQD-UHFFFAOYSA-N 1 1 330.432 3.862 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000534660735 1034782214 /nfs/dbraw/zinc/78/22/14/1034782214.db2.gz HYRKOKQZTANYOA-UHFFFAOYSA-N 1 1 345.443 3.910 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534837241 1035684368 /nfs/dbraw/zinc/68/43/68/1035684368.db2.gz KEYOGYYFQKTUPF-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000492374096 1035702912 /nfs/dbraw/zinc/70/29/12/1035702912.db2.gz GKLVQWFTZVMMJI-SUMWQHHRSA-N 1 1 349.862 3.697 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588197868 1035817357 /nfs/dbraw/zinc/81/73/57/1035817357.db2.gz XBYHBVGCEHCIIP-AWEZNQCLSA-N 1 1 329.400 3.808 20 5 EHBDMO COc1nc(C)cc(C)c1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000588197868 1035817369 /nfs/dbraw/zinc/81/73/69/1035817369.db2.gz XBYHBVGCEHCIIP-AWEZNQCLSA-N 1 1 329.400 3.808 20 5 EHBDMO C[N@@H+](CCCCNC(=O)c1cc2ccccc2c2cccnc12)C1CC1 ZINC000457204914 1035842401 /nfs/dbraw/zinc/84/24/01/1035842401.db2.gz QEUWPVOKRQMGER-UHFFFAOYSA-N 1 1 347.462 3.992 20 5 EHBDMO COc1cc(C[N@@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000464102839 1036125830 /nfs/dbraw/zinc/12/58/30/1036125830.db2.gz BZSGYKIFVYYGOL-ZDUSSCGKSA-N 1 1 332.375 3.978 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589207293 1036313780 /nfs/dbraw/zinc/31/37/80/1036313780.db2.gz JZAHVOFTHNCDGG-AFCDSYGPSA-N 1 1 326.400 3.785 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000589281442 1036340589 /nfs/dbraw/zinc/34/05/89/1036340589.db2.gz HFNRDCVUDKWDCV-KXBFYZLASA-N 1 1 337.423 3.793 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000541773769 1036645987 /nfs/dbraw/zinc/64/59/87/1036645987.db2.gz MHEXTPJTPDWKTP-BEFAXECRSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000541773769 1036645994 /nfs/dbraw/zinc/64/59/94/1036645994.db2.gz MHEXTPJTPDWKTP-BEFAXECRSA-N 1 1 326.396 3.865 20 5 EHBDMO CCC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000464676754 1036651206 /nfs/dbraw/zinc/65/12/06/1036651206.db2.gz JFXGEYJVTZAOPJ-CQSZACIVSA-N 1 1 340.395 3.524 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1CC(O)C1 ZINC000191162287 1036703472 /nfs/dbraw/zinc/70/34/72/1036703472.db2.gz YTHIFWLNQHNMDE-UHFFFAOYSA-N 1 1 332.425 3.526 20 5 EHBDMO COC(=O)c1oc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000180399968 1036755208 /nfs/dbraw/zinc/75/52/08/1036755208.db2.gz JFKKXJUJVGFOLR-NEPJUHHUSA-N 1 1 332.356 3.695 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000443643641 1036915294 /nfs/dbraw/zinc/91/52/94/1036915294.db2.gz SEOLYIDDGLRGJV-KGLIPLIRSA-N 1 1 333.432 3.600 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493240364 1037104401 /nfs/dbraw/zinc/10/44/01/1037104401.db2.gz VRIYWYIVEOOETC-ZDUSSCGKSA-N 1 1 325.840 3.554 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000493282112 1037218797 /nfs/dbraw/zinc/21/87/97/1037218797.db2.gz SDXYCQBBINWWBQ-STQMWFEESA-N 1 1 325.840 3.553 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2OC)cc1[N+](=O)[O-] ZINC000188779316 1037245839 /nfs/dbraw/zinc/24/58/39/1037245839.db2.gz DIRKXTDRARJQON-CHWSQXEVSA-N 1 1 345.399 3.809 20 5 EHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829597 1037254999 /nfs/dbraw/zinc/25/49/99/1037254999.db2.gz REKKBSJDDNWHES-CJNGLKHVSA-N 1 1 328.416 3.616 20 5 EHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)CCC(F)(F)F ZINC000491583590 1037560193 /nfs/dbraw/zinc/56/01/93/1037560193.db2.gz LEOLPAMWIGCJSD-UHFFFAOYSA-N 1 1 339.745 3.934 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000532553301 1037609069 /nfs/dbraw/zinc/60/90/69/1037609069.db2.gz YRQVJPCGSZUNOF-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1cc(N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000463068807 1037733922 /nfs/dbraw/zinc/73/39/22/1037733922.db2.gz MRZCKULQHKTOKL-SFHVURJKSA-N 1 1 339.439 3.862 20 5 EHBDMO C[C@H](CO)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000549945975 1037766805 /nfs/dbraw/zinc/76/68/05/1037766805.db2.gz PASRZLPNQNQXOW-LLVKDONJSA-N 1 1 346.349 3.739 20 5 EHBDMO CC(C)([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccccc1[N+](=O)[O-] ZINC000492191889 1038105672 /nfs/dbraw/zinc/10/56/72/1038105672.db2.gz CEQBGOGWZABSHG-UHFFFAOYSA-N 1 1 336.395 3.805 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000549407634 1038343209 /nfs/dbraw/zinc/34/32/09/1038343209.db2.gz HJHGWIAFJTXBKS-UHFFFAOYSA-N 1 1 344.411 3.595 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661361 1038439941 /nfs/dbraw/zinc/43/99/41/1038439941.db2.gz SMXRCLODSAKXLU-OKILXGFUSA-N 1 1 329.400 3.770 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000538638341 1038441581 /nfs/dbraw/zinc/44/15/81/1038441581.db2.gz YFSFIGWZBCHFRV-UHFFFAOYSA-N 1 1 340.301 3.523 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038487998 /nfs/dbraw/zinc/48/79/98/1038487998.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488027 /nfs/dbraw/zinc/48/80/27/1038488027.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038488036 /nfs/dbraw/zinc/48/80/36/1038488036.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 1 1 333.476 3.880 20 5 EHBDMO CO[C@@H](C)C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000538720399 1038488814 /nfs/dbraw/zinc/48/88/14/1038488814.db2.gz WWGKFRIQSYCQIY-ZDUSSCGKSA-N 1 1 349.456 3.964 20 5 EHBDMO Cc1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731435 1038498110 /nfs/dbraw/zinc/49/81/10/1038498110.db2.gz KKOWYLPPPZNHNW-LJQANCHMSA-N 1 1 340.423 3.775 20 5 EHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCCC(=O)OC(C)(C)C ZINC000538739942 1038504540 /nfs/dbraw/zinc/50/45/40/1038504540.db2.gz VWEJRKVYZNAICE-YFHOEESVSA-N 1 1 334.416 3.662 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1C ZINC000538937425 1038603549 /nfs/dbraw/zinc/60/35/49/1038603549.db2.gz RXEDLIPLELGNDY-WCQYABFASA-N 1 1 343.374 3.505 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H](CNCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876362 1038823882 /nfs/dbraw/zinc/82/38/82/1038823882.db2.gz NLKHUBZNBCDYHC-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO CN(Cc1ccccc1)[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876362 1038823910 /nfs/dbraw/zinc/82/39/10/1038823910.db2.gz NLKHUBZNBCDYHC-HXUWFJFHSA-N 1 1 339.439 3.595 20 5 EHBDMO CC(C)CC[C@@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001167905007 1039380099 /nfs/dbraw/zinc/38/00/99/1039380099.db2.gz PUNSRPWNFBMKGH-KRWDZBQOSA-N 1 1 347.459 3.848 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340921 1039705652 /nfs/dbraw/zinc/70/56/52/1039705652.db2.gz AXNCEQHAGFIKLE-CXAGYDPISA-N 1 1 342.395 3.916 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145535 1040023006 /nfs/dbraw/zinc/02/30/06/1040023006.db2.gz OEFKWKVBBIYNSF-STQMWFEESA-N 1 1 330.388 3.828 20 5 EHBDMO C[N@@H+](CCSc1ncc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000432927606 1040199146 /nfs/dbraw/zinc/19/91/46/1040199146.db2.gz NDKFGFTWEHBFGV-UHFFFAOYSA-N 1 1 337.832 3.867 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)c1ccccc1F ZINC000292053951 1040287877 /nfs/dbraw/zinc/28/78/77/1040287877.db2.gz BUPWEYOYBDJQIA-UHFFFAOYSA-N 1 1 345.374 3.506 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782287 1040442111 /nfs/dbraw/zinc/44/21/11/1040442111.db2.gz UJBUFUDKSBNXCH-INIZCTEOSA-N 1 1 333.432 3.602 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000486783619 1040442365 /nfs/dbraw/zinc/44/23/65/1040442365.db2.gz ZKLFLDZONMPAIZ-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804449 1040471983 /nfs/dbraw/zinc/47/19/83/1040471983.db2.gz YQTBZWDQIKKDOP-GUYCJALGSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1c(C)cc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1C ZINC000110296426 1040493754 /nfs/dbraw/zinc/49/37/54/1040493754.db2.gz RLFPGIMMFJMSCC-UHFFFAOYSA-N 1 1 344.411 3.731 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@@H]1O ZINC000555420384 1040557601 /nfs/dbraw/zinc/55/76/01/1040557601.db2.gz GXVWRWVKWOIUED-ABAIWWIYSA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051140 1040564636 /nfs/dbraw/zinc/56/46/36/1040564636.db2.gz GLUQZTUZOLYFQO-SUMWQHHRSA-N 1 1 328.416 3.616 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC001167752307 1040833555 /nfs/dbraw/zinc/83/35/55/1040833555.db2.gz DQMZOXBNXRTPPX-LLVKDONJSA-N 1 1 346.353 3.685 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)c(Cl)c1 ZINC000600213457 1040833637 /nfs/dbraw/zinc/83/36/37/1040833637.db2.gz GESTWNZQBMORMP-ZDUSSCGKSA-N 1 1 332.787 3.943 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022890 1040869343 /nfs/dbraw/zinc/86/93/43/1040869343.db2.gz QDAMCVZUECETNM-YLJYHZDGSA-N 1 1 337.423 3.511 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022890 1040869352 /nfs/dbraw/zinc/86/93/52/1040869352.db2.gz QDAMCVZUECETNM-YLJYHZDGSA-N 1 1 337.423 3.511 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(Oc3cncc(Cl)c3)CC2)c1 ZINC000566663242 1041063598 /nfs/dbraw/zinc/06/35/98/1041063598.db2.gz NBEMZLHZAQEPJY-UHFFFAOYSA-N 1 1 347.802 3.687 20 5 EHBDMO Cc1ccc(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000511674079 1041452707 /nfs/dbraw/zinc/45/27/07/1041452707.db2.gz XJBJWVNYFIHJSW-IBGZPJMESA-N 1 1 326.396 3.649 20 5 EHBDMO O=[N+]([O-])c1cccc2c(N3CCC[N@H+](C4CCCC4)CC3)ccnc21 ZINC000432315434 1042806146 /nfs/dbraw/zinc/80/61/46/1042806146.db2.gz UVMDFCRBNHHDIN-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO Cc1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302032855 1042912899 /nfs/dbraw/zinc/91/28/99/1042912899.db2.gz CXNUUBZKOKTAEU-UHFFFAOYSA-N 1 1 347.806 3.559 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)C1 ZINC000344075668 1043220430 /nfs/dbraw/zinc/22/04/30/1043220430.db2.gz VHDGSHNNMZVKLM-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214634 1127234354 /nfs/dbraw/zinc/23/43/54/1127234354.db2.gz SDHQLKUHSZJTOA-AAEUAGOBSA-N 1 1 335.429 3.842 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039958 1127568698 /nfs/dbraw/zinc/56/86/98/1127568698.db2.gz USRGYCZPIAHOLJ-ZFWWWQNUSA-N 1 1 348.472 3.816 20 5 EHBDMO C[C@@H]1C[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301398763 1127741192 /nfs/dbraw/zinc/74/11/92/1127741192.db2.gz ARWFIRQVVHLYJM-ZYHUDNBSSA-N 1 1 331.338 3.533 20 5 EHBDMO C[C@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000131588579 1128457609 /nfs/dbraw/zinc/45/76/09/1128457609.db2.gz SHSNYBMKBDTDNJ-NSHDSACASA-N 1 1 330.775 3.747 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428833 1128486438 /nfs/dbraw/zinc/48/64/38/1128486438.db2.gz OSHFTHORABYXHH-GOEBONIOSA-N 1 1 326.400 3.546 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@H]3CCNc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001168648464 1128639007 /nfs/dbraw/zinc/63/90/07/1128639007.db2.gz IYSJMFALUAUTBO-SFHVURJKSA-N 1 1 338.411 3.552 20 5 EHBDMO C[N@H+]1CCc2c(N[C@H]3CCNc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001168648464 1128639008 /nfs/dbraw/zinc/63/90/08/1128639008.db2.gz IYSJMFALUAUTBO-SFHVURJKSA-N 1 1 338.411 3.552 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@H+]1Cc1ccccc1 ZINC000301636021 1128774902 /nfs/dbraw/zinc/77/49/02/1128774902.db2.gz WRDYUQICNGYRKI-OCCSQVGLSA-N 1 1 346.818 3.718 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000193454834 1121318414 /nfs/dbraw/zinc/31/84/14/1121318414.db2.gz VIVDZQFUMHBLJW-SJKOYZFVSA-N 1 1 346.456 3.734 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000301735103 1129011682 /nfs/dbraw/zinc/01/16/82/1129011682.db2.gz ZPKKDYFANIYQHD-AAEUAGOBSA-N 1 1 343.349 3.534 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000544529522 1122240466 /nfs/dbraw/zinc/24/04/66/1122240466.db2.gz HRYAAJRPBHEBKU-AWEZNQCLSA-N 1 1 347.415 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c2ccncc21 ZINC000301172533 1122248990 /nfs/dbraw/zinc/24/89/90/1122248990.db2.gz FBVFNPCQFCRFIX-CYBMUJFWSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(F)c1 ZINC000301184172 1122311189 /nfs/dbraw/zinc/31/11/89/1122311189.db2.gz IWJTWWCDUWYRKK-MRXNPFEDSA-N 1 1 343.402 3.710 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000609894749 1123689446 /nfs/dbraw/zinc/68/94/46/1123689446.db2.gz OKDXAZKYTFNMMB-UHFFFAOYSA-N 1 1 340.855 3.592 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000255641277 1129168624 /nfs/dbraw/zinc/16/86/24/1129168624.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 1 1 341.455 3.557 20 5 EHBDMO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCCCCC1 ZINC000734779480 1131278114 /nfs/dbraw/zinc/27/81/14/1131278114.db2.gz FWYDZZXSPGCJIO-LBPRGKRZSA-N 1 1 340.807 3.556 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399744 /nfs/dbraw/zinc/39/97/44/1129399744.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 1 1 349.475 3.544 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)[C@@H](C)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403198 1129462702 /nfs/dbraw/zinc/46/27/02/1129462702.db2.gz QIEYXIBTHAGXJS-BOFPYLFWSA-N 1 1 346.427 3.836 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CCC(C)C)C1CC1 ZINC000533243947 1129467129 /nfs/dbraw/zinc/46/71/29/1129467129.db2.gz NRCPIAGVIHMDFX-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884140 1129547618 /nfs/dbraw/zinc/54/76/18/1129547618.db2.gz RAWDOSCMDNCLJR-WFASDCNBSA-N 1 1 326.824 3.764 20 5 EHBDMO COc1cccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000389794510 1129589735 /nfs/dbraw/zinc/58/97/35/1129589735.db2.gz SGRBJJCNIXSKJF-YOEHRIQHSA-N 1 1 341.411 3.536 20 5 EHBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482612 1129590737 /nfs/dbraw/zinc/59/07/37/1129590737.db2.gz IJKAJLKDYVRGLE-ZIAGYGMSSA-N 1 1 330.384 3.590 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000154921462 1129598713 /nfs/dbraw/zinc/59/87/13/1129598713.db2.gz PTZUOGNQJZOXBJ-HNNXBMFYSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000154921462 1129598717 /nfs/dbraw/zinc/59/87/17/1129598717.db2.gz PTZUOGNQJZOXBJ-HNNXBMFYSA-N 1 1 329.375 3.810 20 5 EHBDMO CO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384171 1129674664 /nfs/dbraw/zinc/67/46/64/1129674664.db2.gz QWCRPNPRXCMMBZ-LRDDRELGSA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384171 1129674667 /nfs/dbraw/zinc/67/46/67/1129674667.db2.gz QWCRPNPRXCMMBZ-LRDDRELGSA-N 1 1 347.440 3.718 20 5 EHBDMO Cc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302167185 1129771348 /nfs/dbraw/zinc/77/13/48/1129771348.db2.gz LCXFBKGOJSEKIL-INIZCTEOSA-N 1 1 340.427 3.516 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2cccs2)CC1 ZINC000028726034 1129821193 /nfs/dbraw/zinc/82/11/93/1129821193.db2.gz OPHBNYAYILKYHF-CQSZACIVSA-N 1 1 331.441 3.535 20 5 EHBDMO C[N@H+](Cc1ccc(Br)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000030218842 1129913905 /nfs/dbraw/zinc/91/39/05/1129913905.db2.gz QBUARXUWQFISOZ-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO C[N@@H+](Cc1ccc(Br)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000030218842 1129913908 /nfs/dbraw/zinc/91/39/08/1129913908.db2.gz QBUARXUWQFISOZ-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](CO)C2)s1 ZINC000305230076 1129914918 /nfs/dbraw/zinc/91/49/18/1129914918.db2.gz XRIBHHQLWYAZLU-ZDUSSCGKSA-N 1 1 332.425 3.528 20 5 EHBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422068 1130202276 /nfs/dbraw/zinc/20/22/76/1130202276.db2.gz ILYCMPHIXDWONU-IFXJQAMLSA-N 1 1 339.395 3.616 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CCCC[N@@H+]2CC)cc1[N+](=O)[O-] ZINC000245503906 1130224024 /nfs/dbraw/zinc/22/40/24/1130224024.db2.gz JAKUJWWHJAJSBM-GDBMZVCRSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H]2CCCC[N@H+]2CC)cc1[N+](=O)[O-] ZINC000245503906 1130224026 /nfs/dbraw/zinc/22/40/26/1130224026.db2.gz JAKUJWWHJAJSBM-GDBMZVCRSA-N 1 1 335.448 3.519 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC(F)(F)CC2)c1Br ZINC000702828447 1130250316 /nfs/dbraw/zinc/25/03/16/1130250316.db2.gz UPNPUFFOYRXEMN-UHFFFAOYSA-N 1 1 349.175 3.979 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCC(F)(F)CC2)c1Br ZINC000702828447 1130250319 /nfs/dbraw/zinc/25/03/19/1130250319.db2.gz UPNPUFFOYRXEMN-UHFFFAOYSA-N 1 1 349.175 3.979 20 5 EHBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000175217175 1130413751 /nfs/dbraw/zinc/41/37/51/1130413751.db2.gz KSCUSPMUNBALIF-KRWDZBQOSA-N 1 1 336.432 3.775 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731208707 1130779238 /nfs/dbraw/zinc/77/92/38/1130779238.db2.gz GCNWWYWTPDPLHO-LBPRGKRZSA-N 1 1 334.445 3.737 20 5 EHBDMO CO[C@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(F)(F)F ZINC000733329168 1131026918 /nfs/dbraw/zinc/02/69/18/1131026918.db2.gz OHMLVECNFBYPHR-CQSZACIVSA-N 1 1 344.289 3.522 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1C ZINC000740870792 1131550975 /nfs/dbraw/zinc/55/09/75/1131550975.db2.gz IMMFFGIVLRDOKA-RYUDHWBXSA-N 1 1 334.445 3.514 20 5 EHBDMO Cc1nn(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742156813 1131694349 /nfs/dbraw/zinc/69/43/49/1131694349.db2.gz KZNMDEPVZBGGCE-KRWDZBQOSA-N 1 1 328.416 3.901 20 5 EHBDMO Cc1nn(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742156813 1131694351 /nfs/dbraw/zinc/69/43/51/1131694351.db2.gz KZNMDEPVZBGGCE-KRWDZBQOSA-N 1 1 328.416 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](c3ccccn3)C1)CC2 ZINC001172914250 1131903265 /nfs/dbraw/zinc/90/32/65/1131903265.db2.gz FSYUFEQUSQZVQT-ROUUACIJSA-N 1 1 337.423 3.727 20 5 EHBDMO CC[N@@H+](Cc1cccnc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916375 1131904264 /nfs/dbraw/zinc/90/42/64/1131904264.db2.gz RJHXDCXLJCEUAU-GOSISDBHSA-N 1 1 325.412 3.759 20 5 EHBDMO C[N@@H+](Cc1cccc(O)c1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910428 1131916163 /nfs/dbraw/zinc/91/61/63/1131916163.db2.gz ZPKCJBFYEUZENQ-KRWDZBQOSA-N 1 1 326.396 3.680 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H](O)c1ccc(C)cc1 ZINC000743867025 1131993925 /nfs/dbraw/zinc/99/39/25/1131993925.db2.gz QVSYJEHJZOBRHH-LJQANCHMSA-N 1 1 328.412 3.767 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCn3cccc3[C@H]2C)c1F ZINC001173195367 1131996080 /nfs/dbraw/zinc/99/60/80/1131996080.db2.gz FDYMJOBBRMAAPL-CHWSQXEVSA-N 1 1 347.390 3.552 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCn3cccc3[C@H]2C)c1F ZINC001173195367 1131996087 /nfs/dbraw/zinc/99/60/87/1131996087.db2.gz FDYMJOBBRMAAPL-CHWSQXEVSA-N 1 1 347.390 3.552 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227928 1132008324 /nfs/dbraw/zinc/00/83/24/1132008324.db2.gz SPMVACWSVHGVDQ-JXFKEZNVSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)c1ccccc1 ZINC001173233724 1132009846 /nfs/dbraw/zinc/00/98/46/1132009846.db2.gz MRTTYXRRNXWJFX-OAHLLOKOSA-N 1 1 326.396 3.731 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001173232497 1132010172 /nfs/dbraw/zinc/01/01/72/1132010172.db2.gz BSOOPMRUTNGUSX-LSDHHAIUSA-N 1 1 330.428 3.750 20 5 EHBDMO COc1cccc(C[N@H+](CC(C)C)Cn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000746053464 1132357922 /nfs/dbraw/zinc/35/79/22/1132357922.db2.gz HQQOCXXBYXLUGJ-UHFFFAOYSA-N 1 1 346.431 3.532 20 5 EHBDMO COc1cccc(C[N@@H+](CC(C)C)Cn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000746053464 1132357930 /nfs/dbraw/zinc/35/79/30/1132357930.db2.gz HQQOCXXBYXLUGJ-UHFFFAOYSA-N 1 1 346.431 3.532 20 5 EHBDMO COCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000746150923 1132384592 /nfs/dbraw/zinc/38/45/92/1132384592.db2.gz SKTRWSRYUXKUGY-AWEZNQCLSA-N 1 1 332.375 3.944 20 5 EHBDMO COCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000746150923 1132384601 /nfs/dbraw/zinc/38/46/01/1132384601.db2.gz SKTRWSRYUXKUGY-AWEZNQCLSA-N 1 1 332.375 3.944 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040027 1132638132 /nfs/dbraw/zinc/63/81/32/1132638132.db2.gz XCAHBRMZIXAPMC-DGCLKSJQSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041699 1132638449 /nfs/dbraw/zinc/63/84/49/1132638449.db2.gz CBNJSOPBCHCETQ-SJLPKXTDSA-N 1 1 334.485 3.830 20 5 EHBDMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046720 1132641769 /nfs/dbraw/zinc/64/17/69/1132641769.db2.gz MGIQHAOMOMFCIQ-HIFRSBDPSA-N 1 1 330.350 3.973 20 5 EHBDMO CC[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC001169090077 1132660745 /nfs/dbraw/zinc/66/07/45/1132660745.db2.gz DYUSBGWJUHRQQB-QGZVFWFLSA-N 1 1 345.468 3.753 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169395952 1132746494 /nfs/dbraw/zinc/74/64/94/1132746494.db2.gz OLOLBPLGJXMWJA-IBGZPJMESA-N 1 1 346.402 3.897 20 5 EHBDMO CC[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001169495396 1132772036 /nfs/dbraw/zinc/77/20/36/1132772036.db2.gz RGIBIXISCNJULE-GHMZBOCLSA-N 1 1 327.222 3.978 20 5 EHBDMO CO[C@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001169666274 1132813464 /nfs/dbraw/zinc/81/34/64/1132813464.db2.gz JMEVLRAYYSLEQZ-GOSISDBHSA-N 1 1 332.375 3.596 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767761888 1133048951 /nfs/dbraw/zinc/04/89/51/1133048951.db2.gz LDDBUQJSKMDJJR-MRXNPFEDSA-N 1 1 343.431 3.856 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCN(C)c2ccccc2C1 ZINC001180212659 1133344817 /nfs/dbraw/zinc/34/48/17/1133344817.db2.gz DVZQCVPIKRRLFO-UHFFFAOYSA-N 1 1 325.412 3.664 20 5 EHBDMO Cc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(Cl)c1 ZINC001180446038 1133371198 /nfs/dbraw/zinc/37/11/98/1133371198.db2.gz RQKHQWMTXUGEDC-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO C[C@@H]1CSCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181444478 1133487866 /nfs/dbraw/zinc/48/78/66/1133487866.db2.gz ALPBRXDQWYJMIO-JTQLQIEISA-N 1 1 334.363 3.799 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001183831464 1133862037 /nfs/dbraw/zinc/86/20/37/1133862037.db2.gz BZMHXEFLQMXRBP-CYBMUJFWSA-N 1 1 334.363 3.691 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCS[C@@H](C(F)(F)F)C1 ZINC001183831464 1133862043 /nfs/dbraw/zinc/86/20/43/1133862043.db2.gz BZMHXEFLQMXRBP-CYBMUJFWSA-N 1 1 334.363 3.691 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC001184252503 1133916100 /nfs/dbraw/zinc/91/61/00/1133916100.db2.gz QEIBLZXQABJSQE-DLBZAZTESA-N 1 1 332.444 3.850 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1c(F)cc([N+](=O)[O-])cc1F ZINC001184874474 1134000735 /nfs/dbraw/zinc/00/07/35/1134000735.db2.gz OKRJSKAXXDPFCF-LBPRGKRZSA-N 1 1 327.375 3.940 20 5 EHBDMO COc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)c(Cl)cc1[N+](=O)[O-] ZINC001186023039 1134161776 /nfs/dbraw/zinc/16/17/76/1134161776.db2.gz PTDSEQNXGBPEBT-HNNXBMFYSA-N 1 1 347.802 3.855 20 5 EHBDMO COc1cc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c(Cl)cc1[N+](=O)[O-] ZINC001186023039 1134161779 /nfs/dbraw/zinc/16/17/79/1134161779.db2.gz PTDSEQNXGBPEBT-HNNXBMFYSA-N 1 1 347.802 3.855 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326683 1134748361 /nfs/dbraw/zinc/74/83/61/1134748361.db2.gz BOOOAQJSJARJMU-OLZOCXBDSA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170354804 1134753669 /nfs/dbraw/zinc/75/36/69/1134753669.db2.gz PJHYZANXPKHFPA-AWEZNQCLSA-N 1 1 346.402 3.848 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCc1c(F)cccc1Cl)CC2 ZINC001191521245 1134878489 /nfs/dbraw/zinc/87/84/89/1134878489.db2.gz OUPVQIHFUKGCHK-UHFFFAOYSA-N 1 1 334.778 3.988 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCc1c(F)cccc1Cl)CC2 ZINC001191521245 1134878496 /nfs/dbraw/zinc/87/84/96/1134878496.db2.gz OUPVQIHFUKGCHK-UHFFFAOYSA-N 1 1 334.778 3.988 20 5 EHBDMO C[C@H](C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820336 1135336825 /nfs/dbraw/zinc/33/68/25/1135336825.db2.gz KXSWGQJAYVUOAY-CABCVRRESA-N 1 1 346.402 3.720 20 5 EHBDMO Cc1c(C[N@@H+]2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495921 1135433892 /nfs/dbraw/zinc/43/38/92/1135433892.db2.gz AZTAXIBMQFYEQG-CJNGLKHVSA-N 1 1 348.443 3.703 20 5 EHBDMO COC(=O)CC[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468857 1135693813 /nfs/dbraw/zinc/69/38/13/1135693813.db2.gz OMFCEDPZEFFEGA-LSDHHAIUSA-N 1 1 334.416 3.629 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccccn2)nc1)c1ccccc1[N+](=O)[O-] ZINC001197514100 1135697113 /nfs/dbraw/zinc/69/71/13/1135697113.db2.gz IFYXZWLDSKKLKB-CQSZACIVSA-N 1 1 334.379 3.903 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c1 ZINC001197639455 1135722139 /nfs/dbraw/zinc/72/21/39/1135722139.db2.gz QAIKAGYXHPYBHC-ZDUSSCGKSA-N 1 1 348.349 3.741 20 5 EHBDMO COCCC[N@H+](Cc1ccncc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809741514 1135883194 /nfs/dbraw/zinc/88/31/94/1135883194.db2.gz XQIGSZUQTBLWJB-UHFFFAOYSA-N 1 1 349.818 3.682 20 5 EHBDMO COCCC[N@@H+](Cc1ccncc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809741514 1135883198 /nfs/dbraw/zinc/88/31/98/1135883198.db2.gz XQIGSZUQTBLWJB-UHFFFAOYSA-N 1 1 349.818 3.682 20 5 EHBDMO CO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809975134 1135907512 /nfs/dbraw/zinc/90/75/12/1135907512.db2.gz YJIBDVAHBFIKPM-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809975134 1135907514 /nfs/dbraw/zinc/90/75/14/1135907514.db2.gz YJIBDVAHBFIKPM-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000809982443 1135908775 /nfs/dbraw/zinc/90/87/75/1135908775.db2.gz RFMYQAMJMXXVHM-UHFFFAOYSA-N 1 1 333.215 3.637 20 5 EHBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000810623584 1135982346 /nfs/dbraw/zinc/98/23/46/1135982346.db2.gz XWDHSJPTEOSWSL-SNVBAGLBSA-N 1 1 345.380 3.560 20 5 EHBDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000776176124 1136021623 /nfs/dbraw/zinc/02/16/23/1136021623.db2.gz ZKJSAOLLLAUHBA-HNNXBMFYSA-N 1 1 348.786 3.870 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276944 1136130591 /nfs/dbraw/zinc/13/05/91/1136130591.db2.gz LXKCYTDSODXMBI-ROUUACIJSA-N 1 1 330.359 3.604 20 5 EHBDMO Cc1ccc(C[N@H+]2CCN(c3cccc(F)c3)C[C@H]2C)cc1[N+](=O)[O-] ZINC001170722916 1136395329 /nfs/dbraw/zinc/39/53/29/1136395329.db2.gz MQMOGJQBBQIKJN-OAHLLOKOSA-N 1 1 343.402 3.753 20 5 EHBDMO Cc1ccc(C[N@@H+]2CCN(c3cccc(F)c3)C[C@H]2C)cc1[N+](=O)[O-] ZINC001170722916 1136395333 /nfs/dbraw/zinc/39/53/33/1136395333.db2.gz MQMOGJQBBQIKJN-OAHLLOKOSA-N 1 1 343.402 3.753 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000776583352 1136441969 /nfs/dbraw/zinc/44/19/69/1136441969.db2.gz DNXJTSNBXZBCOU-SJORKVTESA-N 1 1 330.384 3.839 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597186 1136457783 /nfs/dbraw/zinc/45/77/83/1136457783.db2.gz HUDNGQVMXAIFMK-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO Cn1ccnc1[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccc([N+](=O)[O-])cc1 ZINC000816636116 1136747266 /nfs/dbraw/zinc/74/72/66/1136747266.db2.gz GYSLSRUUMNJQHD-SFHVURJKSA-N 1 1 349.394 3.802 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000846109298 1137333290 /nfs/dbraw/zinc/33/32/90/1137333290.db2.gz UMMAQHNLAIFJRI-AWEZNQCLSA-N 1 1 348.296 3.817 20 5 EHBDMO O=[N+]([O-])c1ccccc1Nc1c[nH+]c2ccc(Br)cn12 ZINC001206145146 1137502197 /nfs/dbraw/zinc/50/21/97/1137502197.db2.gz YGTSIKASQBPDIT-UHFFFAOYSA-N 1 1 333.145 3.749 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(N(C)C)n1 ZINC000872050544 1137567918 /nfs/dbraw/zinc/56/79/18/1137567918.db2.gz BTTCBVGHKOMABU-GFCCVEGCSA-N 1 1 346.456 3.629 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c(F)c1 ZINC000872282419 1137577910 /nfs/dbraw/zinc/57/79/10/1137577910.db2.gz KFZIHBLTXCYLPB-AWEZNQCLSA-N 1 1 340.370 3.797 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H](OC3CCC3)CC2)c(F)c1 ZINC000872282419 1137577911 /nfs/dbraw/zinc/57/79/11/1137577911.db2.gz KFZIHBLTXCYLPB-AWEZNQCLSA-N 1 1 340.370 3.797 20 5 EHBDMO Cc1c(C[NH2+]Cc2c(F)cccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000873067154 1137589409 /nfs/dbraw/zinc/58/94/09/1137589409.db2.gz WQTNSYCZCRAYHK-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877825435 1137692472 /nfs/dbraw/zinc/69/24/72/1137692472.db2.gz ZYSXONRLJIAMFX-NBOVPLECSA-N 1 1 344.333 3.650 20 5 EHBDMO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H](C(F)(F)F)O1 ZINC000877825435 1137692473 /nfs/dbraw/zinc/69/24/73/1137692473.db2.gz ZYSXONRLJIAMFX-NBOVPLECSA-N 1 1 344.333 3.650 20 5 EHBDMO CCCC[N@@H+](CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877908362 1137695164 /nfs/dbraw/zinc/69/51/64/1137695164.db2.gz SRPCMTQQIVERQU-UHFFFAOYSA-N 1 1 338.795 3.920 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000877960181 1137697137 /nfs/dbraw/zinc/69/71/37/1137697137.db2.gz HJNNZUDLDNFBGJ-UHFFFAOYSA-N 1 1 332.404 3.903 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135255 1137704018 /nfs/dbraw/zinc/70/40/18/1137704018.db2.gz VXWHCXYCNFINFV-NFAWXSAZSA-N 1 1 342.399 3.798 20 5 EHBDMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878693650 1137725447 /nfs/dbraw/zinc/72/54/47/1137725447.db2.gz XKTYZLHFFWPAHT-ZDUSSCGKSA-N 1 1 344.415 3.903 20 5 EHBDMO C=C/C=C/CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000878754802 1137727048 /nfs/dbraw/zinc/72/70/48/1137727048.db2.gz BRCFUCVGUDYOFR-CTWCUAEASA-N 1 1 330.428 3.833 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066652 1137736860 /nfs/dbraw/zinc/73/68/60/1137736860.db2.gz QMBGXUOBVWUHQV-SFAKSCPVSA-N 1 1 342.399 3.823 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCCn2nccc21 ZINC000879788090 1137758751 /nfs/dbraw/zinc/75/87/51/1137758751.db2.gz QRKCLXQHLOPPNV-GFCCVEGCSA-N 1 1 341.198 3.723 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1OC ZINC000886010090 1138031785 /nfs/dbraw/zinc/03/17/85/1138031785.db2.gz DIDSQZPENIFSDH-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO CC[N@H+](CCC1CCN(Cc2cccnc2[N+](=O)[O-])CC1)CC(C)C ZINC000886104564 1138047185 /nfs/dbraw/zinc/04/71/85/1138047185.db2.gz GBADOTZKXVTUFU-UHFFFAOYSA-N 1 1 348.491 3.570 20 5 EHBDMO CC[N@@H+](CCC1CCN(Cc2cccnc2[N+](=O)[O-])CC1)CC(C)C ZINC000886104564 1138047186 /nfs/dbraw/zinc/04/71/86/1138047186.db2.gz GBADOTZKXVTUFU-UHFFFAOYSA-N 1 1 348.491 3.570 20 5 EHBDMO COc1cc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])ccc1OC(C)C ZINC000886107422 1138047255 /nfs/dbraw/zinc/04/72/55/1138047255.db2.gz QZRJBQZXJBUVPC-CYBMUJFWSA-N 1 1 345.399 3.636 20 5 EHBDMO Cc1csc(C[C@H]2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000886696265 1138117642 /nfs/dbraw/zinc/11/76/42/1138117642.db2.gz KKBMCWCGAMXKII-GFCCVEGCSA-N 1 1 337.470 3.876 20 5 EHBDMO Cc1csc(C[C@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)n1 ZINC000886696265 1138117644 /nfs/dbraw/zinc/11/76/44/1138117644.db2.gz KKBMCWCGAMXKII-GFCCVEGCSA-N 1 1 337.470 3.876 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000338344015 1138843753 /nfs/dbraw/zinc/84/37/53/1138843753.db2.gz OCQZNWYGIYWWQB-UHFFFAOYSA-N 1 1 328.368 3.876 20 5 EHBDMO COc1ccc(C[N@H+]2CCC(C)=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000338346941 1138844720 /nfs/dbraw/zinc/84/47/20/1138844720.db2.gz SKVGBNWSQBRKEL-UHFFFAOYSA-N 1 1 328.368 3.876 20 5 EHBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371368 1139486767 /nfs/dbraw/zinc/48/67/67/1139486767.db2.gz LZBLLAWDHBWPAJ-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000175371368 1139486769 /nfs/dbraw/zinc/48/67/69/1139486769.db2.gz LZBLLAWDHBWPAJ-JCQPUDPBSA-N 1 1 332.425 3.525 20 5 EHBDMO COC(=O)c1ccc(F)c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182119322 1139951995 /nfs/dbraw/zinc/95/19/95/1139951995.db2.gz RRJXSNOUFHRLFC-LBPRGKRZSA-N 1 1 346.358 3.680 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000189584411 1140353271 /nfs/dbraw/zinc/35/32/71/1140353271.db2.gz VYCSNSWOBVTEEO-INIZCTEOSA-N 1 1 346.358 3.746 20 5 EHBDMO COCC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349072377 1141632805 /nfs/dbraw/zinc/63/28/05/1141632805.db2.gz IGYJXBVNOVVJCI-UHFFFAOYSA-N 1 1 343.427 3.762 20 5 EHBDMO COCC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349072377 1141632812 /nfs/dbraw/zinc/63/28/12/1141632812.db2.gz IGYJXBVNOVVJCI-UHFFFAOYSA-N 1 1 343.427 3.762 20 5 EHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(O)c1 ZINC000471165706 1015183318 /nfs/dbraw/zinc/18/33/18/1015183318.db2.gz PXCYFRHWPPPERE-AWEZNQCLSA-N 1 1 330.384 3.762 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCc1ccccn1)Cc1cccnc1 ZINC000430333490 1016394153 /nfs/dbraw/zinc/39/41/53/1016394153.db2.gz AQZGOGKRBOMDCR-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccccn1)Cc1cccnc1 ZINC000430333490 1016394161 /nfs/dbraw/zinc/39/41/61/1016394161.db2.gz AQZGOGKRBOMDCR-UHFFFAOYSA-N 1 1 348.406 3.630 20 5 EHBDMO CC(C)c1ccc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000189929016 1016780396 /nfs/dbraw/zinc/78/03/96/1016780396.db2.gz ZZCCUGAZLFJOPE-MRXNPFEDSA-N 1 1 347.459 3.665 20 5 EHBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(CN(C)C)c(F)c1 ZINC000449200938 1032324742 /nfs/dbraw/zinc/32/47/42/1032324742.db2.gz FXAZKCHFOUXECI-CQSZACIVSA-N 1 1 345.418 3.516 20 5 EHBDMO CCc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000007420099 1032326630 /nfs/dbraw/zinc/32/66/30/1032326630.db2.gz RRLOIMJZCCZSNI-CQSZACIVSA-N 1 1 341.411 3.616 20 5 EHBDMO CCc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000007420099 1032326644 /nfs/dbraw/zinc/32/66/44/1032326644.db2.gz RRLOIMJZCCZSNI-CQSZACIVSA-N 1 1 341.411 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(OC2CCN(c3cc[nH+]cc3Cl)CC2)cc1 ZINC000176942124 1017527667 /nfs/dbraw/zinc/52/76/67/1017527667.db2.gz KIPMYKXMCSGSNE-UHFFFAOYSA-N 1 1 333.775 3.691 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010022 1018197959 /nfs/dbraw/zinc/19/79/59/1018197959.db2.gz BSXIIFICMOXOGP-WMLDXEAASA-N 1 1 340.427 3.678 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404506 1032777329 /nfs/dbraw/zinc/77/73/29/1032777329.db2.gz ZARRCMMRNNKBKZ-CXAGYDPISA-N 1 1 332.375 3.817 20 5 EHBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCCC1 ZINC000052331329 1018927507 /nfs/dbraw/zinc/92/75/07/1018927507.db2.gz ZDODXTZOVNWDNN-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NCc1csc([N+](=O)[O-])c1 ZINC000398036559 1018957576 /nfs/dbraw/zinc/95/75/76/1018957576.db2.gz NKFJLKOAQDVSFN-QGZVFWFLSA-N 1 1 347.484 3.903 20 5 EHBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NCc1csc([N+](=O)[O-])c1 ZINC000398036559 1018957590 /nfs/dbraw/zinc/95/75/90/1018957590.db2.gz NKFJLKOAQDVSFN-QGZVFWFLSA-N 1 1 347.484 3.903 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](OC3CCC3)C2)ccc1[N+](=O)[O-] ZINC000594027219 1032808797 /nfs/dbraw/zinc/80/87/97/1032808797.db2.gz SNRFKHCRDDUIOK-INIZCTEOSA-N 1 1 334.416 3.527 20 5 EHBDMO COC(=O)c1cc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)oc1C ZINC000182587200 1019713252 /nfs/dbraw/zinc/71/32/52/1019713252.db2.gz VIVDXFFFYUZDPU-GFCCVEGCSA-N 1 1 346.383 3.784 20 5 EHBDMO COC(=O)c1cc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)oc1C ZINC000182587200 1019713268 /nfs/dbraw/zinc/71/32/68/1019713268.db2.gz VIVDXFFFYUZDPU-GFCCVEGCSA-N 1 1 346.383 3.784 20 5 EHBDMO CC[C@@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000168006144 1020390905 /nfs/dbraw/zinc/39/09/05/1020390905.db2.gz WMPPUUPDTOSYME-HZPDHXFCSA-N 1 1 343.431 3.886 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(Cl)cc1O ZINC000602517288 1032927398 /nfs/dbraw/zinc/92/73/98/1032927398.db2.gz FNPKPDZMMFYULW-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO O=C(CC[N@H+]1CC[C@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000610505283 1020855923 /nfs/dbraw/zinc/85/59/23/1020855923.db2.gz FBXLLIVWOPSUCY-KRWDZBQOSA-N 1 1 343.358 3.510 20 5 EHBDMO O=C(CC[N@H+]1CC[C@@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000610505284 1020856404 /nfs/dbraw/zinc/85/64/04/1020856404.db2.gz FBXLLIVWOPSUCY-QGZVFWFLSA-N 1 1 343.358 3.510 20 5 EHBDMO Cc1cnn(CCCCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135219569 1020904176 /nfs/dbraw/zinc/90/41/76/1020904176.db2.gz RKCHYCLONPNUKZ-UHFFFAOYSA-N 1 1 342.443 3.935 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000084138386 1021005421 /nfs/dbraw/zinc/00/54/21/1021005421.db2.gz XXQAKHLRTPKERW-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084138386 1021005427 /nfs/dbraw/zinc/00/54/27/1021005427.db2.gz XXQAKHLRTPKERW-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOCC34CCC4)o2)cc1 ZINC000128223084 1032950291 /nfs/dbraw/zinc/95/02/91/1032950291.db2.gz ISUWDEWWMIOHCX-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOCC34CCC4)o2)cc1 ZINC000128223084 1032950302 /nfs/dbraw/zinc/95/03/02/1032950302.db2.gz ISUWDEWWMIOHCX-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](CCO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000505886440 1021270863 /nfs/dbraw/zinc/27/08/63/1021270863.db2.gz FLHXACSEYIKICA-UHFFFAOYSA-N 1 1 328.412 3.713 20 5 EHBDMO C[N@@H+](CCC1CCCCC1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507602287 1021392261 /nfs/dbraw/zinc/39/22/61/1021392261.db2.gz VUMFCKBPJOYUMP-UHFFFAOYSA-N 1 1 334.416 3.864 20 5 EHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477785 1021458852 /nfs/dbraw/zinc/45/88/52/1021458852.db2.gz HVEYZHABZJGNCI-PBHICJAKSA-N 1 1 328.416 3.610 20 5 EHBDMO COc1ccc2c(c1)CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000439788477 1021717684 /nfs/dbraw/zinc/71/76/84/1021717684.db2.gz WJQKPHMLEWKTIH-UHFFFAOYSA-N 1 1 326.396 3.513 20 5 EHBDMO Cc1cccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1C ZINC000428708241 1033004601 /nfs/dbraw/zinc/00/46/01/1033004601.db2.gz FJKNJAUIDFGRQI-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO Cc1cccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1C ZINC000428708241 1033004616 /nfs/dbraw/zinc/00/46/16/1033004616.db2.gz FJKNJAUIDFGRQI-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO COCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000426540559 1021848852 /nfs/dbraw/zinc/84/88/52/1021848852.db2.gz RWAXLFYGBRAETC-FNORWQNLSA-N 1 1 347.440 3.522 20 5 EHBDMO COCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000426540559 1021848871 /nfs/dbraw/zinc/84/88/71/1021848871.db2.gz RWAXLFYGBRAETC-FNORWQNLSA-N 1 1 347.440 3.522 20 5 EHBDMO CCc1ccc(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000471802842 1022281724 /nfs/dbraw/zinc/28/17/24/1022281724.db2.gz DCSYSHOUEJPKQS-HNNXBMFYSA-N 1 1 347.459 3.542 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000438331420 1022555039 /nfs/dbraw/zinc/55/50/39/1022555039.db2.gz XUDHQJCCZPHXMF-MRXNPFEDSA-N 1 1 342.443 3.863 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccnn3C3CCC3)C2)cc1 ZINC000894719945 1022790193 /nfs/dbraw/zinc/79/01/93/1022790193.db2.gz QYVIVXNNYSPANS-INIZCTEOSA-N 1 1 340.427 3.896 20 5 EHBDMO Cc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000894771405 1022867778 /nfs/dbraw/zinc/86/77/78/1022867778.db2.gz HXVAOQBLNKLVRN-JTQLQIEISA-N 1 1 343.412 3.601 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@H]4CCCC[C@H]43)nc2c1 ZINC000610619595 1023011748 /nfs/dbraw/zinc/01/17/48/1023011748.db2.gz JAAPWJNVWHQAPU-HIFRSBDPSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@H]4CCCC[C@H]43)nc2c1 ZINC000610619595 1023011762 /nfs/dbraw/zinc/01/17/62/1023011762.db2.gz JAAPWJNVWHQAPU-HIFRSBDPSA-N 1 1 333.413 3.596 20 5 EHBDMO COc1ccc(OCC[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000441476438 1023096661 /nfs/dbraw/zinc/09/66/61/1023096661.db2.gz POUOFLFSBIRUEM-FMKPAKJESA-N 1 1 334.416 3.635 20 5 EHBDMO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000426216322 1023108678 /nfs/dbraw/zinc/10/86/78/1023108678.db2.gz QGJOQPWTKZGMCS-UHFFFAOYSA-N 1 1 326.824 3.765 20 5 EHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000426216322 1023108684 /nfs/dbraw/zinc/10/86/84/1023108684.db2.gz QGJOQPWTKZGMCS-UHFFFAOYSA-N 1 1 326.824 3.765 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000507174223 1023175333 /nfs/dbraw/zinc/17/53/33/1023175333.db2.gz CCSKOLXRZDRGNW-MRXNPFEDSA-N 1 1 326.396 3.901 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507189954 1023181616 /nfs/dbraw/zinc/18/16/16/1023181616.db2.gz XHEQJTCKAAEKQM-QGZVFWFLSA-N 1 1 328.416 3.616 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)C1 ZINC000535799470 1023646621 /nfs/dbraw/zinc/64/66/21/1023646621.db2.gz QDNHRWUFFNRLCY-LSDHHAIUSA-N 1 1 342.443 3.863 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(Nc2cccc(CC[N@H+](C)C3CC3)c2)n1 ZINC000538137228 1023845689 /nfs/dbraw/zinc/84/56/89/1023845689.db2.gz ZYKPQJBMSROULN-UHFFFAOYSA-N 1 1 326.400 3.679 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000522660599 1024162777 /nfs/dbraw/zinc/16/27/77/1024162777.db2.gz FBFKVJCQOCGTET-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO CC(=O)NC1CCC([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000346275631 1024566376 /nfs/dbraw/zinc/56/63/76/1024566376.db2.gz QSAZQMGUSLLJJX-UHFFFAOYSA-N 1 1 347.459 3.597 20 5 EHBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CCCCO1 ZINC000435057618 1024586560 /nfs/dbraw/zinc/58/65/60/1024586560.db2.gz QEWHBKSHKKXRQG-AWEZNQCLSA-N 1 1 333.388 3.517 20 5 EHBDMO CSCCC[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281169131 1024697654 /nfs/dbraw/zinc/69/76/54/1024697654.db2.gz GSFMSGGCRQDSQE-UHFFFAOYSA-N 1 1 337.470 3.903 20 5 EHBDMO CSCCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281169131 1024697661 /nfs/dbraw/zinc/69/76/61/1024697661.db2.gz GSFMSGGCRQDSQE-UHFFFAOYSA-N 1 1 337.470 3.903 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000425365986 1024874897 /nfs/dbraw/zinc/87/48/97/1024874897.db2.gz NSFCUUVUGOMDCZ-IAGOWNOFSA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000425365986 1024874909 /nfs/dbraw/zinc/87/49/09/1024874909.db2.gz NSFCUUVUGOMDCZ-IAGOWNOFSA-N 1 1 332.787 3.556 20 5 EHBDMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368573 1024882895 /nfs/dbraw/zinc/88/28/95/1024882895.db2.gz FDTPUMWNZKDBSX-GOSISDBHSA-N 1 1 330.428 3.684 20 5 EHBDMO CO[C@@H]1CC[C@H](C)[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926391 1024980806 /nfs/dbraw/zinc/98/08/06/1024980806.db2.gz DPJJLVOSBGUPNN-BLLLJJGKSA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@@H]1CC[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926391 1024980810 /nfs/dbraw/zinc/98/08/10/1024980810.db2.gz DPJJLVOSBGUPNN-BLLLJJGKSA-N 1 1 347.440 3.718 20 5 EHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000435770332 1025130877 /nfs/dbraw/zinc/13/08/77/1025130877.db2.gz OOTRCWJKKQQPSE-KRWDZBQOSA-N 1 1 346.431 3.513 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000072014210 1025147337 /nfs/dbraw/zinc/14/73/37/1025147337.db2.gz HCGYSIHGCGLINC-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO CCC1CCC([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000444026936 1025187671 /nfs/dbraw/zinc/18/76/71/1025187671.db2.gz ADIMLZJDWIAJKS-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000521480041 1025405811 /nfs/dbraw/zinc/40/58/11/1025405811.db2.gz DVWJZUWKYALKGN-AWEZNQCLSA-N 1 1 330.384 3.675 20 5 EHBDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000185583007 1025442249 /nfs/dbraw/zinc/44/22/49/1025442249.db2.gz DQXYVPNYDFFAQC-YXMGTMDOSA-N 1 1 346.427 3.662 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281802517 1025523459 /nfs/dbraw/zinc/52/34/59/1025523459.db2.gz GHOUWVIXDGHKDJ-AWEZNQCLSA-N 1 1 326.400 3.512 20 5 EHBDMO Cc1ccccc1[C@@H]([C@H](C)NCc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000442997124 1025639653 /nfs/dbraw/zinc/63/96/53/1025639653.db2.gz YZNSVQYINLHLBN-HNAYVOBHSA-N 1 1 327.428 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn4ccsc4n3)C2)cc1 ZINC000451547686 1026099835 /nfs/dbraw/zinc/09/98/35/1026099835.db2.gz LQICWXWESQXGCP-CQSZACIVSA-N 1 1 342.424 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn4ccsc4n3)C2)cc1 ZINC000451547686 1026099853 /nfs/dbraw/zinc/09/98/53/1026099853.db2.gz LQICWXWESQXGCP-CQSZACIVSA-N 1 1 342.424 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCCCn3cccn3)C2)cc1 ZINC000451550141 1026101301 /nfs/dbraw/zinc/10/13/01/1026101301.db2.gz RHBUAXUIUJXKOE-GOSISDBHSA-N 1 1 342.443 3.841 20 5 EHBDMO CC(C)n1ccnc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549556 1026102038 /nfs/dbraw/zinc/10/20/38/1026102038.db2.gz PMEHQYXIQCYDQV-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO CC(C)n1ccnc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549556 1026102053 /nfs/dbraw/zinc/10/20/53/1026102053.db2.gz PMEHQYXIQCYDQV-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141482 1026234628 /nfs/dbraw/zinc/23/46/28/1026234628.db2.gz WCQGTNDXSBZOFG-ICEKFOEVSA-N 1 1 340.423 3.798 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025945844 1026504497 /nfs/dbraw/zinc/50/44/97/1026504497.db2.gz VOIFXFJOWYRHRJ-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025945844 1026504507 /nfs/dbraw/zinc/50/45/07/1026504507.db2.gz VOIFXFJOWYRHRJ-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000520059636 1026712696 /nfs/dbraw/zinc/71/26/96/1026712696.db2.gz YWPAAMDCLTYHFG-GOSISDBHSA-N 1 1 326.396 3.681 20 5 EHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000531379275 1026844721 /nfs/dbraw/zinc/84/47/21/1026844721.db2.gz ZOHWILYIOYCHLE-IBGZPJMESA-N 1 1 325.412 3.696 20 5 EHBDMO CC(C)[C@@H](c1ccccc1Cl)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472247233 1027034498 /nfs/dbraw/zinc/03/44/98/1027034498.db2.gz CKRJVOTVOGVBIR-INIZCTEOSA-N 1 1 336.823 3.774 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413172858 1027210975 /nfs/dbraw/zinc/21/09/75/1027210975.db2.gz GCZXUORFIXRFPA-HIFRSBDPSA-N 1 1 344.390 3.594 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2F)C2CCCCC2)c1 ZINC000472257224 1027619830 /nfs/dbraw/zinc/61/98/30/1027619830.db2.gz MEHSKJNNKQDTSW-UHFFFAOYSA-N 1 1 346.406 3.765 20 5 EHBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1Cl ZINC000503570834 1027909508 /nfs/dbraw/zinc/90/95/08/1027909508.db2.gz KSMRMFZBXUVKOF-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1Cl ZINC000503570834 1027909527 /nfs/dbraw/zinc/90/95/27/1027909527.db2.gz KSMRMFZBXUVKOF-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000362854135 1028028109 /nfs/dbraw/zinc/02/81/09/1028028109.db2.gz WQXUIDRZVJUJBF-KRWDZBQOSA-N 1 1 336.395 3.819 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)CC1(c2ccccc2)CC1 ZINC000444686752 1028133662 /nfs/dbraw/zinc/13/36/62/1028133662.db2.gz TVQCSESQUFSQTA-UHFFFAOYSA-N 1 1 336.395 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4cccc(Cl)c4)CC3)nc2c1 ZINC000444688774 1028160838 /nfs/dbraw/zinc/16/08/38/1028160838.db2.gz LARUSSPJGOIUAL-UHFFFAOYSA-N 1 1 342.786 3.903 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C(C)C)C1CCCCC1 ZINC000532694050 1028207469 /nfs/dbraw/zinc/20/74/69/1028207469.db2.gz NMXVCHXMVOYDEP-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774634 1028264515 /nfs/dbraw/zinc/26/45/15/1028264515.db2.gz XIPOTSPPRPLUJG-CABCVRRESA-N 1 1 333.432 3.598 20 5 EHBDMO CCc1ccc([C@H](N[C@H]2CC[C@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513804 1028490163 /nfs/dbraw/zinc/49/01/63/1028490163.db2.gz RNQSIBIAACHOPK-ZUEVXXBESA-N 1 1 343.427 3.557 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521290 1028709481 /nfs/dbraw/zinc/70/94/81/1028709481.db2.gz KECRQWJUEYAWFG-OAHLLOKOSA-N 1 1 342.395 3.602 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000074994028 1028777839 /nfs/dbraw/zinc/77/78/39/1028777839.db2.gz KOFXMAHYUWMVHJ-CYBMUJFWSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000524221852 1028994144 /nfs/dbraw/zinc/99/41/44/1028994144.db2.gz NKXUIVQVXQGKEV-LLVKDONJSA-N 1 1 342.237 3.644 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]CC2(N(C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000504911513 1029052887 /nfs/dbraw/zinc/05/28/87/1029052887.db2.gz HOMWCUQRJSRJMQ-HNNXBMFYSA-N 1 1 349.475 3.909 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000504926270 1029073078 /nfs/dbraw/zinc/07/30/78/1029073078.db2.gz HEYVYOIKRBTDGY-PMPSAXMXSA-N 1 1 349.500 3.682 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000504926270 1029073087 /nfs/dbraw/zinc/07/30/87/1029073087.db2.gz HEYVYOIKRBTDGY-PMPSAXMXSA-N 1 1 349.500 3.682 20 5 EHBDMO O=C(CC[N@H+]1CCCC2(CCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000615000544 1029236863 /nfs/dbraw/zinc/23/68/63/1029236863.db2.gz UWWUCZNAQYLIDI-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO CC(C)[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533247934 1029524284 /nfs/dbraw/zinc/52/42/84/1029524284.db2.gz WZPCOCSTAQVODS-INIZCTEOSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533299916 1029602966 /nfs/dbraw/zinc/60/29/66/1029602966.db2.gz QZJWCCHTONFXCT-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000525268989 1029776539 /nfs/dbraw/zinc/77/65/39/1029776539.db2.gz CABIVGVJMHDWAW-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3CCO)s2)cc1 ZINC000428462391 1029874484 /nfs/dbraw/zinc/87/44/84/1029874484.db2.gz SWQAFTIYYGJZEB-CQSZACIVSA-N 1 1 332.425 3.670 20 5 EHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1C ZINC000441182331 1029881189 /nfs/dbraw/zinc/88/11/89/1029881189.db2.gz UIIDVNYAMBOXBT-UHFFFAOYSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](CCCc3ccccc3)C2)c1 ZINC000441190799 1029918141 /nfs/dbraw/zinc/91/81/41/1029918141.db2.gz SGQOSAWMEHSUGJ-SFHVURJKSA-N 1 1 342.443 3.526 20 5 EHBDMO CCC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000441243271 1030087810 /nfs/dbraw/zinc/08/78/10/1030087810.db2.gz HHFKFQJRYVYSLW-UHFFFAOYSA-N 1 1 344.411 3.894 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000453335128 1030116650 /nfs/dbraw/zinc/11/66/50/1030116650.db2.gz CXOLTJLIXRRPRQ-HFBAOOFYSA-N 1 1 326.400 3.809 20 5 EHBDMO COc1ccccc1OCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000441265373 1030217863 /nfs/dbraw/zinc/21/78/63/1030217863.db2.gz MCKSLTNFCFNJIS-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO COc1ccccc1OCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000441265373 1030217878 /nfs/dbraw/zinc/21/78/78/1030217878.db2.gz MCKSLTNFCFNJIS-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@@H](CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729483 1030441481 /nfs/dbraw/zinc/44/14/81/1030441481.db2.gz NWROGQFDYQHODM-RDJZCZTQSA-N 1 1 340.427 3.670 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000537659799 1030914756 /nfs/dbraw/zinc/91/47/56/1030914756.db2.gz RHTRPGLZJITJGS-YFHOEESVSA-N 1 1 325.412 3.806 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368405 1031017378 /nfs/dbraw/zinc/01/73/78/1031017378.db2.gz UUHUZWZUHKMIIL-HUUCEWRRSA-N 1 1 344.411 3.980 20 5 EHBDMO CC[C@H](N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807239 1031342666 /nfs/dbraw/zinc/34/26/66/1031342666.db2.gz LZSWMABKDKUVPZ-MJGOQNOKSA-N 1 1 331.460 3.900 20 5 EHBDMO CC[C@H]([NH2+][C@@H]1CCN(CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807239 1031342684 /nfs/dbraw/zinc/34/26/84/1031342684.db2.gz LZSWMABKDKUVPZ-MJGOQNOKSA-N 1 1 331.460 3.900 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@H]1c1ccsc1)Nc1ccccc1[N+](=O)[O-] ZINC000052803845 1031699097 /nfs/dbraw/zinc/69/90/97/1031699097.db2.gz RQYSBNHQSMCTJP-HNNXBMFYSA-N 1 1 345.424 3.822 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000475737446 1031721086 /nfs/dbraw/zinc/72/10/86/1031721086.db2.gz ZYZPVWRETIBIAB-GOSISDBHSA-N 1 1 328.412 3.593 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CC(CC4CC4)C3)cs2)c1 ZINC000598678789 1033378043 /nfs/dbraw/zinc/37/80/43/1033378043.db2.gz UMCZNBXZHIKNOH-UHFFFAOYSA-N 1 1 329.425 3.950 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)ccc2ncccc21 ZINC000594598795 1033445949 /nfs/dbraw/zinc/44/59/49/1033445949.db2.gz HYBMALIREUWTBL-WBVHZDCISA-N 1 1 326.400 3.572 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583490 1033574119 /nfs/dbraw/zinc/57/41/19/1033574119.db2.gz KKHBVVLBNFZYOE-NVXWUHKLSA-N 1 1 325.412 3.775 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594977983 1033581586 /nfs/dbraw/zinc/58/15/86/1033581586.db2.gz PGAQYJMMUXDPCX-BQLWYNFJSA-N 1 1 329.444 3.605 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC000594977983 1033581602 /nfs/dbraw/zinc/58/16/02/1033581602.db2.gz PGAQYJMMUXDPCX-BQLWYNFJSA-N 1 1 329.444 3.605 20 5 EHBDMO COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C2CC2)cn1 ZINC000599021060 1033648973 /nfs/dbraw/zinc/64/89/73/1033648973.db2.gz ZMNOXUJECPBGKZ-QGZVFWFLSA-N 1 1 347.802 3.893 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599023697 1033651147 /nfs/dbraw/zinc/65/11/47/1033651147.db2.gz JUZSGJIJHNDSEI-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000592998551 1033790586 /nfs/dbraw/zinc/79/05/86/1033790586.db2.gz BLHQSAMRAAXYOC-HNNXBMFYSA-N 1 1 346.408 3.780 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000592998551 1033790599 /nfs/dbraw/zinc/79/05/99/1033790599.db2.gz BLHQSAMRAAXYOC-HNNXBMFYSA-N 1 1 346.408 3.780 20 5 EHBDMO C[C@@H](CCO)[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694702 1033804135 /nfs/dbraw/zinc/80/41/35/1033804135.db2.gz QGXVPDLDYFUOPN-ZDUSSCGKSA-N 1 1 348.374 3.729 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC2(CCCCC2)CC1 ZINC000608833424 1033908829 /nfs/dbraw/zinc/90/88/29/1033908829.db2.gz XYHIIXVOTDRMNG-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)cc1C ZINC000603895113 1034003823 /nfs/dbraw/zinc/00/38/23/1034003823.db2.gz RKMOAIPZQZAVGD-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000596308808 1034163130 /nfs/dbraw/zinc/16/31/30/1034163130.db2.gz VWEHPJJDYSRUHH-JTQLQIEISA-N 1 1 346.353 3.541 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])nc2)[C@@H]1c1ccc(Cl)cc1 ZINC000450413163 1034299006 /nfs/dbraw/zinc/29/90/06/1034299006.db2.gz SNTUGSTUYGHHCY-ZBFHGGJFSA-N 1 1 332.791 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484498 1034388277 /nfs/dbraw/zinc/38/82/77/1034388277.db2.gz XRGADLLIOPOVLK-LJQANCHMSA-N 1 1 342.395 3.906 20 5 EHBDMO C[C@@H](c1ccccc1)[C@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600319 1034552133 /nfs/dbraw/zinc/55/21/33/1034552133.db2.gz NGSUKYRUVHZTSN-MGPUTAFESA-N 1 1 340.423 3.724 20 5 EHBDMO CCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC000060495473 1034600744 /nfs/dbraw/zinc/60/07/44/1034600744.db2.gz SMUHEMDGQXWSID-UHFFFAOYSA-N 1 1 347.459 3.850 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000075721905 1034713964 /nfs/dbraw/zinc/71/39/64/1034713964.db2.gz FWWAREJMCHMXEE-SNVBAGLBSA-N 1 1 340.305 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000172258408 1034870223 /nfs/dbraw/zinc/87/02/23/1034870223.db2.gz PQSCDTCUBQTESB-LJQANCHMSA-N 1 1 344.386 3.606 20 5 EHBDMO COc1ccc(OC)c(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892503211 1035037420 /nfs/dbraw/zinc/03/74/20/1035037420.db2.gz ZPSURXRGZRLZEY-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411989852 1035093534 /nfs/dbraw/zinc/09/35/34/1035093534.db2.gz QGIWXADSQSBESQ-LJQANCHMSA-N 1 1 338.407 3.949 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411989852 1035093543 /nfs/dbraw/zinc/09/35/43/1035093543.db2.gz QGIWXADSQSBESQ-LJQANCHMSA-N 1 1 338.407 3.949 20 5 EHBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922882 1035462998 /nfs/dbraw/zinc/46/29/98/1035462998.db2.gz GDFGLRSNFKFCJM-HUUCEWRRSA-N 1 1 344.411 3.838 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCC[NH2+]CC3)s2)cc1 ZINC000591278462 1035615659 /nfs/dbraw/zinc/61/56/59/1035615659.db2.gz DMJRJUQDMHGJPU-CQSZACIVSA-N 1 1 331.441 3.555 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000613380798 1035708005 /nfs/dbraw/zinc/70/80/05/1035708005.db2.gz FPJAWHGFKMXZJR-MRXNPFEDSA-N 1 1 346.358 3.785 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000613380798 1035708022 /nfs/dbraw/zinc/70/80/22/1035708022.db2.gz FPJAWHGFKMXZJR-MRXNPFEDSA-N 1 1 346.358 3.785 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000588216023 1035826220 /nfs/dbraw/zinc/82/62/20/1035826220.db2.gz KJGKWWFZZYIOPU-UHFFFAOYSA-N 1 1 328.359 3.873 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489384 1035848242 /nfs/dbraw/zinc/84/82/42/1035848242.db2.gz ABBHJUKMPPXTFV-XHSDSOJGSA-N 1 1 327.384 3.659 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492660033 1036152689 /nfs/dbraw/zinc/15/26/89/1036152689.db2.gz XWNLNJKYVKFKBM-QGZVFWFLSA-N 1 1 326.396 3.983 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589110888 1036256654 /nfs/dbraw/zinc/25/66/54/1036256654.db2.gz OYADUEDEZYTIQZ-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCOc2ccccc21 ZINC000589185021 1036296199 /nfs/dbraw/zinc/29/61/99/1036296199.db2.gz MMLZJDFXJCFUHO-MRXNPFEDSA-N 1 1 326.396 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H](C3CC3)C2)c1 ZINC000589209852 1036312549 /nfs/dbraw/zinc/31/25/49/1036312549.db2.gz UXBLHMJHNNYWDG-GFCCVEGCSA-N 1 1 326.343 3.818 20 5 EHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000589598916 1036564360 /nfs/dbraw/zinc/56/43/60/1036564360.db2.gz GURTZHJZPIBFGR-SNVBAGLBSA-N 1 1 334.342 3.541 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000464838371 1036855878 /nfs/dbraw/zinc/85/58/78/1036855878.db2.gz VLLSUFCBEVSJAC-DNVCBOLYSA-N 1 1 326.396 3.599 20 5 EHBDMO CCOc1cccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831178 1036912834 /nfs/dbraw/zinc/91/28/34/1036912834.db2.gz YXIIDBRCVPPYJT-MRXNPFEDSA-N 1 1 341.411 3.680 20 5 EHBDMO C[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000443655141 1036961026 /nfs/dbraw/zinc/96/10/26/1036961026.db2.gz NZJROEVXRGGKDT-NEPJUHHUSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000443655141 1036961042 /nfs/dbraw/zinc/96/10/42/1036961042.db2.gz NZJROEVXRGGKDT-NEPJUHHUSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+](C)Cc1ccccc1 ZINC000761527956 1037104054 /nfs/dbraw/zinc/10/40/54/1037104054.db2.gz VLERBTQVPCOXTE-CQSZACIVSA-N 1 1 347.846 3.858 20 5 EHBDMO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+](C)Cc1ccccc1 ZINC000761527956 1037104057 /nfs/dbraw/zinc/10/40/57/1037104057.db2.gz VLERBTQVPCOXTE-CQSZACIVSA-N 1 1 347.846 3.858 20 5 EHBDMO Cn1c[nH+]c2cc(N[C@H](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000539740319 1037140437 /nfs/dbraw/zinc/14/04/37/1037140437.db2.gz GIXHSUMSJBVYNI-MRXNPFEDSA-N 1 1 336.395 3.915 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC3(CCCC3)C2)o1 ZINC000539819601 1037240893 /nfs/dbraw/zinc/24/08/93/1037240893.db2.gz MHNJGVKIMVZKDW-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC3(CCCC3)C2)o1 ZINC000539819601 1037240898 /nfs/dbraw/zinc/24/08/98/1037240898.db2.gz MHNJGVKIMVZKDW-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO CN(Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109834 1037324890 /nfs/dbraw/zinc/32/48/90/1037324890.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 1 1 339.439 3.549 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000311066170 1037334327 /nfs/dbraw/zinc/33/43/27/1037334327.db2.gz YDKDFSJKEDCVDQ-KRWDZBQOSA-N 1 1 340.427 3.622 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000462862131 1037485788 /nfs/dbraw/zinc/48/57/88/1037485788.db2.gz LMAQECXBLITDOQ-YPMHNXCESA-N 1 1 345.365 3.780 20 5 EHBDMO CN(C)c1cccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000760869406 1037542209 /nfs/dbraw/zinc/54/22/09/1037542209.db2.gz QGHRNCHVSGOQCC-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000760869406 1037542223 /nfs/dbraw/zinc/54/22/23/1037542223.db2.gz QGHRNCHVSGOQCC-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO COc1cccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000341230119 1037799570 /nfs/dbraw/zinc/79/95/70/1037799570.db2.gz QXUXVJIFYQEBIW-NSHDSACASA-N 1 1 327.340 3.595 20 5 EHBDMO 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ZINC000538717336 1038487449 /nfs/dbraw/zinc/48/74/49/1038487449.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 1 1 333.476 3.880 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967820 1038768891 /nfs/dbraw/zinc/76/88/91/1038768891.db2.gz FHEJZPQPHJFNCB-CHWSQXEVSA-N 1 1 334.416 3.860 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488364285 1039125064 /nfs/dbraw/zinc/12/50/64/1039125064.db2.gz VTLBTCZBSOIJMJ-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000175143891 1039307514 /nfs/dbraw/zinc/30/75/14/1039307514.db2.gz WIQNIIXXZXCMIS-UHFFFAOYSA-N 1 1 348.443 3.917 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1CO ZINC000249062709 1039343556 /nfs/dbraw/zinc/34/35/56/1039343556.db2.gz ICDCRLXCZNLTPG-LRDDRELGSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549465144 1039479057 /nfs/dbraw/zinc/47/90/57/1039479057.db2.gz HXGAKJISGZAREM-LLVKDONJSA-N 1 1 343.349 3.818 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440159 1039547388 /nfs/dbraw/zinc/54/73/88/1039547388.db2.gz AIJXJZIAWXBZLI-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@@H](c1ccc(F)cc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000015443192 1039549920 /nfs/dbraw/zinc/54/99/20/1039549920.db2.gz GLMOHBBFDCXVQN-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+](C)[C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883841 1039906886 /nfs/dbraw/zinc/90/68/86/1039906886.db2.gz CBQBIHZRHARFPP-AWEZNQCLSA-N 1 1 346.452 3.867 20 5 EHBDMO CC(=O)c1cc(NCCC[N@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000553308887 1039972917 /nfs/dbraw/zinc/97/29/17/1039972917.db2.gz AWZZJHPBASHGKP-UHFFFAOYSA-N 1 1 333.432 3.864 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000489495470 1040039794 /nfs/dbraw/zinc/03/97/94/1040039794.db2.gz JJBPHZUQGQRICA-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037572 1040302345 /nfs/dbraw/zinc/30/23/45/1040302345.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 1 1 331.460 3.628 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000490016259 1040309228 /nfs/dbraw/zinc/30/92/28/1040309228.db2.gz XNVDYKOVTAZPJT-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H](CCOC)C1 ZINC000467269246 1040514131 /nfs/dbraw/zinc/51/41/31/1040514131.db2.gz RHINOVZMEKOZAZ-HNNXBMFYSA-N 1 1 336.432 3.632 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H](c4ccccc4)C3)nc2c1 ZINC000433053569 1040575234 /nfs/dbraw/zinc/57/52/34/1040575234.db2.gz QRMNRMOTPUBHDJ-OAHLLOKOSA-N 1 1 336.395 3.851 20 5 EHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371478 1040791977 /nfs/dbraw/zinc/79/19/77/1040791977.db2.gz MXYURLXIVJSOIU-PWSUYJOCSA-N 1 1 344.358 3.825 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000600197035 1040812945 /nfs/dbraw/zinc/81/29/45/1040812945.db2.gz QDSCQURWABUJNA-PBHICJAKSA-N 1 1 348.443 3.703 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC001167752308 1040833584 /nfs/dbraw/zinc/83/35/84/1040833584.db2.gz DQMZOXBNXRTPPX-NSHDSACASA-N 1 1 346.353 3.685 20 5 EHBDMO CC[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798610 1040840469 /nfs/dbraw/zinc/84/04/69/1040840469.db2.gz INORURFVFMOSIY-AWEZNQCLSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798610 1040840482 /nfs/dbraw/zinc/84/04/82/1040840482.db2.gz INORURFVFMOSIY-AWEZNQCLSA-N 1 1 332.425 3.934 20 5 EHBDMO COCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433192869 1041038595 /nfs/dbraw/zinc/03/85/95/1041038595.db2.gz NIPYQCVJOWFMTD-AWEZNQCLSA-N 1 1 344.864 3.592 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000341522972 1041092054 /nfs/dbraw/zinc/09/20/54/1041092054.db2.gz HHKZBDSYEOIVEC-LBPRGKRZSA-N 1 1 349.460 3.524 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854385 1041235821 /nfs/dbraw/zinc/23/58/21/1041235821.db2.gz KZQAWKQAQTVDBG-OAHLLOKOSA-N 1 1 341.411 3.577 20 5 EHBDMO CC(=O)c1ccc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511711000 1041474230 /nfs/dbraw/zinc/47/42/30/1041474230.db2.gz CHYNDCFCJONRGN-MJBXVCDLSA-N 1 1 333.432 3.576 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072897480 1042764498 /nfs/dbraw/zinc/76/44/98/1042764498.db2.gz HYHHRJFHHWYJOS-KGLIPLIRSA-N 1 1 329.400 3.913 20 5 EHBDMO COc1cc(NCc2ccc(C)[nH+]c2N2CCCC2)ccc1[N+](=O)[O-] ZINC000302030515 1043048785 /nfs/dbraw/zinc/04/87/85/1043048785.db2.gz BQSWWZFCVGXYEF-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO COc1ncccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279109777 1043360788 /nfs/dbraw/zinc/36/07/88/1043360788.db2.gz PAWSKMJJYPAHNK-MRXNPFEDSA-N 1 1 327.384 3.511 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2s1 ZINC000051909151 1044131865 /nfs/dbraw/zinc/13/18/65/1044131865.db2.gz NWPPDTMNKBLMPA-UHFFFAOYSA-N 1 1 327.409 3.879 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000183295543 1125516895 /nfs/dbraw/zinc/51/68/95/1125516895.db2.gz YQTFYDOLXLXBQX-GOSISDBHSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000183295543 1125516900 /nfs/dbraw/zinc/51/69/00/1125516900.db2.gz YQTFYDOLXLXBQX-GOSISDBHSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)s1 ZINC000764969789 1127560415 /nfs/dbraw/zinc/56/04/15/1127560415.db2.gz BQFGCCXQARHTQI-UHFFFAOYSA-N 1 1 330.413 3.712 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)s1 ZINC000764969789 1127560416 /nfs/dbraw/zinc/56/04/16/1127560416.db2.gz BQFGCCXQARHTQI-UHFFFAOYSA-N 1 1 330.413 3.712 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)o1 ZINC000131339598 1127626608 /nfs/dbraw/zinc/62/66/08/1127626608.db2.gz RXAUPRJXIMDHKP-KRWDZBQOSA-N 1 1 346.383 3.550 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]Cc2cc3ccccc3[nH]2)c1 ZINC000131463833 1128044375 /nfs/dbraw/zinc/04/43/75/1128044375.db2.gz REWBPFPKRSLBEQ-UHFFFAOYSA-N 1 1 347.321 3.967 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508532 1128483957 /nfs/dbraw/zinc/48/39/57/1128483957.db2.gz AQIKWZGFWHYRPZ-WBVHZDCISA-N 1 1 340.427 3.763 20 5 EHBDMO C[N@@H+](CCCC1CCOCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765931794 1128772814 /nfs/dbraw/zinc/77/28/14/1128772814.db2.gz HOHGJFKHKYBEOM-UHFFFAOYSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c2ccncc21 ZINC000715711904 1128810357 /nfs/dbraw/zinc/81/03/57/1128810357.db2.gz KYWVJRXURMAUFF-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO Cc1ccc(C[NH2+][C@@H](CN(C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938854 1128888347 /nfs/dbraw/zinc/88/83/47/1128888347.db2.gz YPVLMEHAQIKDBJ-KRWDZBQOSA-N 1 1 347.846 3.949 20 5 EHBDMO CCc1ccc([C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000484556966 1120352107 /nfs/dbraw/zinc/35/21/07/1120352107.db2.gz UDBRJYKFTDDXTI-FQEVSTJZSA-N 1 1 340.423 3.773 20 5 EHBDMO CCc1ccc([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)cc1 ZINC000484556966 1120352113 /nfs/dbraw/zinc/35/21/13/1120352113.db2.gz UDBRJYKFTDDXTI-FQEVSTJZSA-N 1 1 340.423 3.773 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1nc2cc(Cl)ccc2n1C ZINC000494459405 1120564088 /nfs/dbraw/zinc/56/40/88/1120564088.db2.gz VHDWARKIRCMVNA-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](CCO)c2ccc(Cl)cc2)c(F)c1 ZINC000347439988 1120618038 /nfs/dbraw/zinc/61/80/38/1120618038.db2.gz WPFZVVNTBMNBCO-MRXNPFEDSA-N 1 1 338.766 3.601 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000153233974 1120906628 /nfs/dbraw/zinc/90/66/28/1120906628.db2.gz DICZYGNUAZVDCS-UHFFFAOYSA-N 1 1 327.340 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000153233974 1120906632 /nfs/dbraw/zinc/90/66/32/1120906632.db2.gz DICZYGNUAZVDCS-UHFFFAOYSA-N 1 1 327.340 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC000780400262 1121575407 /nfs/dbraw/zinc/57/54/07/1121575407.db2.gz UQZPVQNKRTVKJO-NCJCTJFTSA-N 1 1 338.407 3.806 20 5 EHBDMO C[C@@H](O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536202 1121683408 /nfs/dbraw/zinc/68/34/08/1121683408.db2.gz OCUXWHABLIVFPY-CHWSQXEVSA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000301104695 1121920135 /nfs/dbraw/zinc/92/01/35/1121920135.db2.gz VMIAJXLYRFLMSP-QWHCGFSZSA-N 1 1 329.322 3.652 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000302268896 1121934940 /nfs/dbraw/zinc/93/49/40/1121934940.db2.gz GPNOAGSTHSFZQL-QMTHXVAHSA-N 1 1 344.242 3.822 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCC[C@@H]1O ZINC000497157477 1122354259 /nfs/dbraw/zinc/35/42/59/1122354259.db2.gz AFRLKOUSTVCDGC-QAPCUYQASA-N 1 1 344.411 3.838 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917454505 1122610906 /nfs/dbraw/zinc/61/09/06/1122610906.db2.gz PXXXQDUWMPBHPM-UHFFFAOYSA-N 1 1 331.420 3.569 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H]2C2CCCCC2)c1 ZINC000917477204 1122612526 /nfs/dbraw/zinc/61/25/26/1122612526.db2.gz FAPQXFLXJZBTPU-KRWDZBQOSA-N 1 1 328.416 3.947 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc([S@](C)=O)cc1 ZINC000154466653 1122653671 /nfs/dbraw/zinc/65/36/71/1122653671.db2.gz GSJDLZVOTHLGTA-XMMPIXPASA-N 1 1 346.452 3.743 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000556968297 1123244390 /nfs/dbraw/zinc/24/43/90/1123244390.db2.gz YMYIGSIJUWXSHC-YLLXALGISA-N 1 1 328.412 3.642 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000556968297 1123244392 /nfs/dbraw/zinc/24/43/92/1123244392.db2.gz YMYIGSIJUWXSHC-YLLXALGISA-N 1 1 328.412 3.642 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000610004697 1123712234 /nfs/dbraw/zinc/71/22/34/1123712234.db2.gz ZOIUXOIATFKMRN-INIZCTEOSA-N 1 1 342.370 3.829 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000610004697 1123712237 /nfs/dbraw/zinc/71/22/37/1123712237.db2.gz ZOIUXOIATFKMRN-INIZCTEOSA-N 1 1 342.370 3.829 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)s1 ZINC000618980861 1125255977 /nfs/dbraw/zinc/25/59/77/1125255977.db2.gz HCBKVIRYMSEBPQ-UHFFFAOYSA-N 1 1 332.429 3.573 20 5 EHBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000619895224 1125425129 /nfs/dbraw/zinc/42/51/29/1125425129.db2.gz RWTGHAKYJROUJW-INIZCTEOSA-N 1 1 333.435 3.602 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000124746010 1129463022 /nfs/dbraw/zinc/46/30/22/1129463022.db2.gz ROLZCRWYFALSJK-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1cc(Nc2cccc(CC[N@H+](C)C3CC3)c2)ncc1[N+](=O)[O-] ZINC000301979916 1129466050 /nfs/dbraw/zinc/46/60/50/1129466050.db2.gz GDNGUCJZEUSORR-UHFFFAOYSA-N 1 1 326.400 3.679 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884135 1129547851 /nfs/dbraw/zinc/54/78/51/1129547851.db2.gz RAWDOSCMDNCLJR-IUODEOHRSA-N 1 1 326.824 3.764 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000154455602 1129559888 /nfs/dbraw/zinc/55/98/88/1129559888.db2.gz SPRZGUPBLQGVDQ-KRWDZBQOSA-N 1 1 330.384 3.590 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000330447106 1129637708 /nfs/dbraw/zinc/63/77/08/1129637708.db2.gz HTDXEZHURAWAKY-MRXNPFEDSA-N 1 1 348.443 3.631 20 5 EHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000302718829 1129787287 /nfs/dbraw/zinc/78/72/87/1129787287.db2.gz ZDJOBRSUEKKLAV-ZDUSSCGKSA-N 1 1 348.834 3.749 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000429235313 1130149871 /nfs/dbraw/zinc/14/98/71/1130149871.db2.gz FHMIJODCBJUGMG-UHFFFAOYSA-N 1 1 345.374 3.506 20 5 EHBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422067 1130202855 /nfs/dbraw/zinc/20/28/55/1130202855.db2.gz ILYCMPHIXDWONU-AUUYWEPGSA-N 1 1 339.395 3.616 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000246429287 1130380725 /nfs/dbraw/zinc/38/07/25/1130380725.db2.gz MVSOINKKYRPZFS-DNVCBOLYSA-N 1 1 342.443 3.998 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246462463 1130384959 /nfs/dbraw/zinc/38/49/59/1130384959.db2.gz FNOSIDDXGZQZIQ-SUMWQHHRSA-N 1 1 349.862 3.697 20 5 EHBDMO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCCC[C@@H]1C ZINC000731206204 1130779138 /nfs/dbraw/zinc/77/91/38/1130779138.db2.gz BHKMWMZJYNVBEX-NWDGAFQWSA-N 1 1 334.445 3.879 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000738228765 1131463750 /nfs/dbraw/zinc/46/37/50/1131463750.db2.gz ZNMMIKVUACILEQ-HNNXBMFYSA-N 1 1 334.445 3.510 20 5 EHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150032 1131693498 /nfs/dbraw/zinc/69/34/98/1131693498.db2.gz TYFOILBQSHBOSC-ZBFHGGJFSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154508 1131693998 /nfs/dbraw/zinc/69/39/98/1131693998.db2.gz KMEYHTLHRXOUIZ-GJZGRUSLSA-N 1 1 328.416 3.926 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381101 1131915010 /nfs/dbraw/zinc/91/50/10/1131915010.db2.gz VZVFOFQIPWOCED-PBHICJAKSA-N 1 1 343.431 3.711 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2ccccc2)c1F ZINC001173184661 1131993560 /nfs/dbraw/zinc/99/35/60/1131993560.db2.gz NYIBZUKAZWCKTR-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001173225011 1132005349 /nfs/dbraw/zinc/00/53/49/1132005349.db2.gz ARUOZBIDDPDJDI-DOTOQJQBSA-N 1 1 325.412 3.800 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCC[C@@H](C)CC1 ZINC000745170672 1132212422 /nfs/dbraw/zinc/21/24/22/1132212422.db2.gz ISKIINHBHZQPBE-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCC[C@@H](C)CC1 ZINC000745170672 1132212430 /nfs/dbraw/zinc/21/24/30/1132212430.db2.gz ISKIINHBHZQPBE-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000746076758 1132361225 /nfs/dbraw/zinc/36/12/25/1132361225.db2.gz PNMGMYFHMMPBDV-TUAOUCFPSA-N 1 1 340.807 3.553 20 5 EHBDMO CC[C@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@@H]1c1ccccc1 ZINC000746382295 1132505264 /nfs/dbraw/zinc/50/52/64/1132505264.db2.gz LLHYMIIRJVZQLA-WMZOPIPTSA-N 1 1 342.443 3.881 20 5 EHBDMO CN(c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000746391175 1132506914 /nfs/dbraw/zinc/50/69/14/1132506914.db2.gz ZKUBBCOMKVOUQV-IBGZPJMESA-N 1 1 325.412 3.696 20 5 EHBDMO C/C=C\C[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052534 1132550175 /nfs/dbraw/zinc/55/01/75/1132550175.db2.gz HAWVDZIQYFGLBP-SFAKSCPVSA-N 1 1 349.406 3.741 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025940 1132640333 /nfs/dbraw/zinc/64/03/33/1132640333.db2.gz KCLKROIDROIISD-XPKDYRNWSA-N 1 1 342.361 3.940 20 5 EHBDMO C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057841 1132646529 /nfs/dbraw/zinc/64/65/29/1132646529.db2.gz XZYGCMJLHFNDNO-JMSVASOKSA-N 1 1 341.249 3.887 20 5 EHBDMO C[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001169396212 1132747268 /nfs/dbraw/zinc/74/72/68/1132747268.db2.gz PZCBRPNEPHZTLG-NSHDSACASA-N 1 1 327.222 3.979 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000766932707 1132916024 /nfs/dbraw/zinc/91/60/24/1132916024.db2.gz RXKYHUBKFZGONE-QGZVFWFLSA-N 1 1 334.441 3.644 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000804352046 1132981672 /nfs/dbraw/zinc/98/16/72/1132981672.db2.gz NLRDJWMYEDSYIL-CYBMUJFWSA-N 1 1 336.392 3.570 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767761887 1133048297 /nfs/dbraw/zinc/04/82/97/1133048297.db2.gz LDDBUQJSKMDJJR-INIZCTEOSA-N 1 1 343.431 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000773705257 1133095743 /nfs/dbraw/zinc/09/57/43/1133095743.db2.gz UQUJVVMDMQUHKX-KGLIPLIRSA-N 1 1 338.835 3.887 20 5 EHBDMO COc1cccc2cc(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])oc21 ZINC000768337891 1133126225 /nfs/dbraw/zinc/12/62/25/1133126225.db2.gz WRGRPZBEIDBOFI-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO COc1cccc2cc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])oc21 ZINC000768337891 1133126228 /nfs/dbraw/zinc/12/62/28/1133126228.db2.gz WRGRPZBEIDBOFI-UHFFFAOYSA-N 1 1 326.352 3.982 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1noc2cc(F)ccc12 ZINC001179429498 1133249741 /nfs/dbraw/zinc/24/97/41/1133249741.db2.gz CLZPYXKLXCQUQQ-UHFFFAOYSA-N 1 1 329.331 3.782 20 5 EHBDMO Cc1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000069448006 1133261246 /nfs/dbraw/zinc/26/12/46/1133261246.db2.gz AECLWLGEELICCF-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769446983 1133291851 /nfs/dbraw/zinc/29/18/51/1133291851.db2.gz PVBBWFSJDAXAQY-GOSISDBHSA-N 1 1 349.430 3.757 20 5 EHBDMO Cc1cc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925740 1134006438 /nfs/dbraw/zinc/00/64/38/1134006438.db2.gz CVJODBUBEIIZLT-QLFBSQMISA-N 1 1 335.423 3.884 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1 ZINC001185428578 1134084697 /nfs/dbraw/zinc/08/46/97/1134084697.db2.gz CKHORGORYMHRBW-MRXNPFEDSA-N 1 1 325.412 3.696 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501755 1134286274 /nfs/dbraw/zinc/28/62/74/1134286274.db2.gz CZFJCCGIFIETIA-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC001187361559 1134326555 /nfs/dbraw/zinc/32/65/55/1134326555.db2.gz NRGZBPMKOPTUIH-OAHLLOKOSA-N 1 1 340.408 3.803 20 5 EHBDMO C[N@H+]1Cc2ccccc2[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC001187361559 1134326558 /nfs/dbraw/zinc/32/65/58/1134326558.db2.gz NRGZBPMKOPTUIH-OAHLLOKOSA-N 1 1 340.408 3.803 20 5 EHBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775205526 1134515304 /nfs/dbraw/zinc/51/53/04/1134515304.db2.gz ZDTXTXOHOXTGQM-AWEZNQCLSA-N 1 1 343.383 3.874 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2Cc3ccccc3C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170353121 1134754195 /nfs/dbraw/zinc/75/41/95/1134754195.db2.gz WGZOCBFUQGLFNY-HUUCEWRRSA-N 1 1 340.423 3.981 20 5 EHBDMO Cc1nn(C[N@@H+](C)Cc2ccc(F)cc2C)c2ccc([N+](=O)[O-])cc12 ZINC000792708473 1134783271 /nfs/dbraw/zinc/78/32/71/1134783271.db2.gz VVDUMGKTGAAPSP-UHFFFAOYSA-N 1 1 342.374 3.790 20 5 EHBDMO Cc1nn(C[N@H+](C)Cc2ccc(F)cc2C)c2ccc([N+](=O)[O-])cc12 ZINC000792708473 1134783278 /nfs/dbraw/zinc/78/32/78/1134783278.db2.gz VVDUMGKTGAAPSP-UHFFFAOYSA-N 1 1 342.374 3.790 20 5 EHBDMO C[C@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000804606404 1135136451 /nfs/dbraw/zinc/13/64/51/1135136451.db2.gz LPUBJPMEHXKOHB-STQMWFEESA-N 1 1 348.403 3.568 20 5 EHBDMO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424185 1135428059 /nfs/dbraw/zinc/42/80/59/1135428059.db2.gz HXMKKWKEOXIZGJ-KBAYOESNSA-N 1 1 332.444 3.776 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613676 1135589374 /nfs/dbraw/zinc/58/93/74/1135589374.db2.gz KVZAUSKWLRDCPT-NMONBKHDSA-N 1 1 331.416 3.600 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](Oc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC001197542623 1135703166 /nfs/dbraw/zinc/70/31/66/1135703166.db2.gz LWLKWMPYFCGBQN-KRWDZBQOSA-N 1 1 330.359 3.696 20 5 EHBDMO C[N@H+](CC[C@H](O)c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000808735567 1135732626 /nfs/dbraw/zinc/73/26/26/1135732626.db2.gz RVBIFPWBOYYIIU-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](CC[C@H](O)c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000808735567 1135732632 /nfs/dbraw/zinc/73/26/32/1135732632.db2.gz RVBIFPWBOYYIIU-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809982047 1135908448 /nfs/dbraw/zinc/90/84/48/1135908448.db2.gz GLAQYVQLRMOKCL-ZUZCIYMTSA-N 1 1 347.242 3.885 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C2(CO)CCCC2)c1 ZINC001170615070 1136001212 /nfs/dbraw/zinc/00/12/12/1136001212.db2.gz VITNCEVWRMSEDF-UHFFFAOYSA-N 1 1 340.423 3.902 20 5 EHBDMO CC(C)c1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810836979 1136012029 /nfs/dbraw/zinc/01/20/29/1136012029.db2.gz JQJQZJOYOGOLAM-GJZGRUSLSA-N 1 1 332.400 3.502 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000811473405 1136095004 /nfs/dbraw/zinc/09/50/04/1136095004.db2.gz XWVXSPVDEKQQMN-UHFFFAOYSA-N 1 1 342.182 3.595 20 5 EHBDMO C[N@H+](Cc1csc2ccccc12)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277923 1136130816 /nfs/dbraw/zinc/13/08/16/1136130816.db2.gz QURRCFRMVAJQAM-QGZVFWFLSA-N 1 1 342.420 3.975 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851220 1136261608 /nfs/dbraw/zinc/26/16/08/1136261608.db2.gz QOSAXEJOFLIJFB-DNVCBOLYSA-N 1 1 328.412 3.847 20 5 EHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583741 1136442408 /nfs/dbraw/zinc/44/24/08/1136442408.db2.gz GMKLKTWJRPXIIA-UXHICEINSA-N 1 1 340.423 3.644 20 5 EHBDMO Cc1ccccc1C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776579095 1136443923 /nfs/dbraw/zinc/44/39/23/1136443923.db2.gz JAMYTFOPHLIZSL-IBGZPJMESA-N 1 1 326.396 3.601 20 5 EHBDMO CCc1ccc(C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000776579779 1136444675 /nfs/dbraw/zinc/44/46/75/1136444675.db2.gz QFTSAZORRFPJHA-FQEVSTJZSA-N 1 1 340.423 3.855 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590374 1136453134 /nfs/dbraw/zinc/45/31/34/1136453134.db2.gz DCCSQKBBFMACOP-KRWDZBQOSA-N 1 1 326.352 3.506 20 5 EHBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592489 1136454276 /nfs/dbraw/zinc/45/42/76/1136454276.db2.gz OXCPKEBBPPXBKE-XFQXTVEOSA-N 1 1 340.423 3.581 20 5 EHBDMO O=c1[nH]ccc(Nc2ccc([NH+]3CCCCCC3)cc2)c1[N+](=O)[O-] ZINC000853093078 1136508755 /nfs/dbraw/zinc/50/87/55/1136508755.db2.gz AXGSQIBWFGQADN-UHFFFAOYSA-N 1 1 328.372 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000817281823 1136790840 /nfs/dbraw/zinc/79/08/40/1136790840.db2.gz QBLVHTJYDZPOLE-SNVBAGLBSA-N 1 1 347.293 3.667 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000817281823 1136790842 /nfs/dbraw/zinc/79/08/42/1136790842.db2.gz QBLVHTJYDZPOLE-SNVBAGLBSA-N 1 1 347.293 3.667 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585274 1137021507 /nfs/dbraw/zinc/02/15/07/1137021507.db2.gz MMZIJTMMDVNQFC-KXBFYZLASA-N 1 1 326.396 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl ZINC000824696977 1137147086 /nfs/dbraw/zinc/14/70/86/1137147086.db2.gz WUUHAZPOHMBJTC-FRFSOERESA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl ZINC000824696979 1137147249 /nfs/dbraw/zinc/14/72/49/1137147249.db2.gz WUUHAZPOHMBJTC-UNEWFSDZSA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1Cl ZINC000824696256 1137148781 /nfs/dbraw/zinc/14/87/81/1137148781.db2.gz JHCMHNHIVMOSIB-YSVLISHTSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@@H](CO)C1CC[NH+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000844415123 1137218926 /nfs/dbraw/zinc/21/89/26/1137218926.db2.gz ATCWXYAQSPRGRF-JTQLQIEISA-N 1 1 347.242 3.742 20 5 EHBDMO Cc1nn(C[N@@H+](CC2CC2)CC2CCC2)c2ccc([N+](=O)[O-])cc12 ZINC000794710239 1137240267 /nfs/dbraw/zinc/24/02/67/1137240267.db2.gz KOXSHIIQIBYQOU-UHFFFAOYSA-N 1 1 328.416 3.723 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(Br)cn1 ZINC000866570643 1137365842 /nfs/dbraw/zinc/36/58/42/1137365842.db2.gz IEPXYEHNSSURSV-AWEZNQCLSA-N 1 1 348.200 3.529 20 5 EHBDMO Cn1cc([C@@H]2C[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846932792 1137376163 /nfs/dbraw/zinc/37/61/63/1137376163.db2.gz UJDXWKRGWBLTDS-HNNXBMFYSA-N 1 1 348.834 3.607 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3cc(F)ccc3n2C)cc1[N+](=O)[O-] ZINC000772994612 1137431620 /nfs/dbraw/zinc/43/16/20/1137431620.db2.gz AQLAWJUIUSKTJM-GFCCVEGCSA-N 1 1 342.374 3.780 20 5 EHBDMO CC[C@H]([NH2+]Cc1nc2cc(F)ccc2n1C)c1cccc([N+](=O)[O-])c1 ZINC000772996232 1137439708 /nfs/dbraw/zinc/43/97/08/1137439708.db2.gz BNGWYBIOCNYSJW-HNNXBMFYSA-N 1 1 342.374 3.862 20 5 EHBDMO CCC(=O)c1ccc(N2CCC(C[N@@H+](C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000795074363 1137448877 /nfs/dbraw/zinc/44/88/77/1137448877.db2.gz SNWBSXGXPNAYST-UHFFFAOYSA-N 1 1 347.459 3.744 20 5 EHBDMO CC[C@H](CSC)[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000773255594 1137481817 /nfs/dbraw/zinc/48/18/17/1137481817.db2.gz MFLRNMCSSBWAEL-SNVBAGLBSA-N 1 1 341.458 3.903 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000773255594 1137481818 /nfs/dbraw/zinc/48/18/18/1137481818.db2.gz MFLRNMCSSBWAEL-SNVBAGLBSA-N 1 1 341.458 3.903 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000877796722 1137690335 /nfs/dbraw/zinc/69/03/35/1137690335.db2.gz KTEXTLABFYQGKB-HNNXBMFYSA-N 1 1 344.411 3.838 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878149625 1137704502 /nfs/dbraw/zinc/70/45/02/1137704502.db2.gz ZXLJFZXZSXNQJX-QGZVFWFLSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878165121 1137705299 /nfs/dbraw/zinc/70/52/99/1137705299.db2.gz RPXACHOXKHZGFK-NXEZZACHSA-N 1 1 336.779 3.529 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878187144 1137706388 /nfs/dbraw/zinc/70/63/88/1137706388.db2.gz QVBSNZFPSUBVIU-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476034 1137717326 /nfs/dbraw/zinc/71/73/26/1137717326.db2.gz VJXRXJWQEBZFJR-TZMCWYRMSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2ccc(F)cn2)CC1 ZINC000879004617 1137734936 /nfs/dbraw/zinc/73/49/36/1137734936.db2.gz MUYMEQPINRLGFV-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879234787 1137741678 /nfs/dbraw/zinc/74/16/78/1137741678.db2.gz RCFYXNKRROMYHC-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879234787 1137741679 /nfs/dbraw/zinc/74/16/79/1137741679.db2.gz RCFYXNKRROMYHC-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(C(=O)CC(C)C)CC1 ZINC000879760764 1137758276 /nfs/dbraw/zinc/75/82/76/1137758276.db2.gz LKJXTSPJHQYZBD-MRXNPFEDSA-N 1 1 347.459 3.545 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(C(=O)CC(C)C)CC1 ZINC000879760764 1137758277 /nfs/dbraw/zinc/75/82/77/1137758277.db2.gz LKJXTSPJHQYZBD-MRXNPFEDSA-N 1 1 347.459 3.545 20 5 EHBDMO CCCC[N@@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000131874961 1137860934 /nfs/dbraw/zinc/86/09/34/1137860934.db2.gz VXQMRMAWRQLSFH-NSHDSACASA-N 1 1 327.812 3.697 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2ccccc2NC1(C)C ZINC000883462574 1137861202 /nfs/dbraw/zinc/86/12/02/1137861202.db2.gz URMWECJKMKXTLL-KRWDZBQOSA-N 1 1 327.384 3.638 20 5 EHBDMO C[C@H](NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708405 1137917840 /nfs/dbraw/zinc/91/78/40/1137917840.db2.gz BWGDENVWHVUCBW-KBXCAEBGSA-N 1 1 345.443 3.569 20 5 EHBDMO C[C@H]1SCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000118417387 1137933728 /nfs/dbraw/zinc/93/37/28/1137933728.db2.gz XCGZTMJVADXCBW-CHWSQXEVSA-N 1 1 347.440 3.618 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000134796609 1137960779 /nfs/dbraw/zinc/96/07/79/1137960779.db2.gz VZFNFTRZJMLAMS-OALUTQOASA-N 1 1 344.386 3.822 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000885973466 1138029514 /nfs/dbraw/zinc/02/95/14/1138029514.db2.gz SXRSJVMZDUQPHW-AEFFLSMTSA-N 1 1 341.411 3.590 20 5 EHBDMO CCCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ncsc2C1 ZINC000886265911 1138063027 /nfs/dbraw/zinc/06/30/27/1138063027.db2.gz URWXYVAPFCGRLW-CQSZACIVSA-N 1 1 346.456 3.606 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCSC[C@H]1c1ccccc1 ZINC000886317919 1138067102 /nfs/dbraw/zinc/06/71/02/1138067102.db2.gz DVZNBYUIFRJUQY-INIZCTEOSA-N 1 1 329.425 3.670 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC000886317919 1138067105 /nfs/dbraw/zinc/06/71/05/1138067105.db2.gz DVZNBYUIFRJUQY-INIZCTEOSA-N 1 1 329.425 3.670 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(C)C)c1ccccn1 ZINC000122399087 1138257601 /nfs/dbraw/zinc/25/76/01/1138257601.db2.gz QYMYNJYHWNPSBY-KRWDZBQOSA-N 1 1 329.400 3.875 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1n1ccnc1 ZINC000182352683 1139967299 /nfs/dbraw/zinc/96/72/99/1139967299.db2.gz XDLMQMURFWXHGX-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1n1ccnc1 ZINC000182352683 1139967303 /nfs/dbraw/zinc/96/73/03/1139967303.db2.gz XDLMQMURFWXHGX-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](COCC(C)C)c1ccco1 ZINC000183456502 1140039983 /nfs/dbraw/zinc/03/99/83/1140039983.db2.gz HBDCVNIRMWRXAY-QGZVFWFLSA-N 1 1 332.400 4.000 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000184004029 1140073127 /nfs/dbraw/zinc/07/31/27/1140073127.db2.gz DHEDWPUIICLGAF-LBPRGKRZSA-N 1 1 335.429 3.686 20 5 EHBDMO Cc1nc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)cs1 ZINC000189806899 1140365769 /nfs/dbraw/zinc/36/57/69/1140365769.db2.gz IIZGXUHFOYYWGU-MRXNPFEDSA-N 1 1 333.413 3.576 20 5 EHBDMO Cc1nc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cs1 ZINC000189806899 1140365775 /nfs/dbraw/zinc/36/57/75/1140365775.db2.gz IIZGXUHFOYYWGU-MRXNPFEDSA-N 1 1 333.413 3.576 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)cs1 ZINC000271410728 1141360634 /nfs/dbraw/zinc/36/06/34/1141360634.db2.gz PHGACGZJPLIXPC-AWEZNQCLSA-N 1 1 342.424 3.671 20 5 EHBDMO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271618268 1141406594 /nfs/dbraw/zinc/40/65/94/1141406594.db2.gz MFNVDPWKBQQDDL-OLZOCXBDSA-N 1 1 345.374 3.720 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2cc(C)ccc2OC)c([N+](=O)[O-])cc1F ZINC000274268958 1141491366 /nfs/dbraw/zinc/49/13/66/1141491366.db2.gz AJXMJMKRVATNCB-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC000339167644 1141515902 /nfs/dbraw/zinc/51/59/02/1141515902.db2.gz AFPZMBLWDFEXFY-HNNXBMFYSA-N 1 1 344.333 3.616 20 5 EHBDMO Cc1ccccc1[C@@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246844009 1014259703 /nfs/dbraw/zinc/25/97/03/1014259703.db2.gz KNTSUMGVDXLVHI-HUUCEWRRSA-N 1 1 326.400 3.546 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430219874 1015089164 /nfs/dbraw/zinc/08/91/64/1015089164.db2.gz ODSXFXQTKIQRGJ-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000609672668 1015830475 /nfs/dbraw/zinc/83/04/75/1015830475.db2.gz WAOXMCXHAVGYLV-GOEBONIOSA-N 1 1 326.396 3.981 20 5 EHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000339934775 1015988999 /nfs/dbraw/zinc/98/89/99/1015988999.db2.gz RFLWALIXZYWBKA-AWEZNQCLSA-N 1 1 348.424 3.708 20 5 EHBDMO CCC[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000339934775 1015989010 /nfs/dbraw/zinc/98/90/10/1015989010.db2.gz RFLWALIXZYWBKA-AWEZNQCLSA-N 1 1 348.424 3.708 20 5 EHBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383557 1016125705 /nfs/dbraw/zinc/12/57/05/1016125705.db2.gz BCMNRSQRDHZAMW-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383557 1016125710 /nfs/dbraw/zinc/12/57/10/1016125710.db2.gz BCMNRSQRDHZAMW-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000247132401 1016597722 /nfs/dbraw/zinc/59/77/22/1016597722.db2.gz VPEOTBVGWDMZPF-CZUORRHYSA-N 1 1 346.456 3.855 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCN(C3CCC3)CC1)CCC2 ZINC000278745112 1032281384 /nfs/dbraw/zinc/28/13/84/1032281384.db2.gz NOEGGZYHTVRXHR-LJQANCHMSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(Br)cs2)cs1 ZINC000070218120 1032412577 /nfs/dbraw/zinc/41/25/77/1032412577.db2.gz VLUDLTVKWRODQK-UHFFFAOYSA-N 1 1 333.232 3.770 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1O ZINC000190052774 1017265506 /nfs/dbraw/zinc/26/55/06/1017265506.db2.gz CJIMKUAUUMBZER-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO CC1(C)C[NH2+]CC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414971508 1017360153 /nfs/dbraw/zinc/36/01/53/1017360153.db2.gz LMDNKLJDHKTPKS-QGZVFWFLSA-N 1 1 345.468 3.801 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000610285213 1017661483 /nfs/dbraw/zinc/66/14/83/1017661483.db2.gz PNKBZQBEYRPYEL-OAHLLOKOSA-N 1 1 331.441 3.615 20 5 EHBDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022504 1017781038 /nfs/dbraw/zinc/78/10/38/1017781038.db2.gz ZXMMVFXIQQVCLL-SNVBAGLBSA-N 1 1 332.347 3.683 20 5 EHBDMO COc1c(O)ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1[N+](=O)[O-] ZINC000893007458 1018145237 /nfs/dbraw/zinc/14/52/37/1018145237.db2.gz BQFJFSYHHCTYSX-UHFFFAOYSA-N 1 1 348.786 3.741 20 5 EHBDMO C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(-c2ccccc2)cc1 ZINC000341073502 1018401308 /nfs/dbraw/zinc/40/13/08/1018401308.db2.gz VPDGAVZSKZWVJG-AWEZNQCLSA-N 1 1 336.395 3.846 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccc(C)o2)C2CC2)c([N+](=O)[O-])c1 ZINC000610367753 1018536401 /nfs/dbraw/zinc/53/64/01/1018536401.db2.gz SOIDITRIEGIUOG-UHFFFAOYSA-N 1 1 346.383 3.548 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@@H](CCO)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000592402865 1032798319 /nfs/dbraw/zinc/79/83/19/1032798319.db2.gz LCOIQLXINFNTDA-GUYCJALGSA-N 1 1 332.375 3.817 20 5 EHBDMO COc1cccc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111387 1018973237 /nfs/dbraw/zinc/97/32/37/1018973237.db2.gz DFSMWKCWEXNGRC-GOEBONIOSA-N 1 1 341.411 3.678 20 5 EHBDMO Cc1c(CN2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610433478 1019125747 /nfs/dbraw/zinc/12/57/47/1019125747.db2.gz NBGRSVXYGOLOOY-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO CC[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427622 1032816934 /nfs/dbraw/zinc/81/69/34/1032816934.db2.gz JFBZSKYVLDHTCJ-CJNGLKHVSA-N 1 1 345.468 3.883 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(C(F)F)CC3)co2)cc1 ZINC000340691091 1019384316 /nfs/dbraw/zinc/38/43/16/1019384316.db2.gz BKELFWFXARHSHK-UHFFFAOYSA-N 1 1 337.326 3.727 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](C(C)C)CC2)cccc1[N+](=O)[O-] ZINC001167425281 1019764249 /nfs/dbraw/zinc/76/42/49/1019764249.db2.gz PUHZMGHCBDEDTJ-JKSUJKDBSA-N 1 1 347.459 3.988 20 5 EHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501009921 1020645761 /nfs/dbraw/zinc/64/57/61/1020645761.db2.gz GECIJMWBGYYDQU-MRXNPFEDSA-N 1 1 333.432 3.824 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413092220 1020680332 /nfs/dbraw/zinc/68/03/32/1020680332.db2.gz KUTCCMWTHRSAAQ-NSHDSACASA-N 1 1 346.353 3.541 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417366 1020818792 /nfs/dbraw/zinc/81/87/92/1020818792.db2.gz PSRKECAYOSWZQN-KRWDZBQOSA-N 1 1 336.395 3.700 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000361032301 1020891422 /nfs/dbraw/zinc/89/14/22/1020891422.db2.gz OREAQPCDRXTXAB-AWEZNQCLSA-N 1 1 329.400 3.536 20 5 EHBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000516478521 1021475518 /nfs/dbraw/zinc/47/55/18/1021475518.db2.gz KNLNCWWMIFGVOP-LJQANCHMSA-N 1 1 344.411 3.982 20 5 EHBDMO CC(C)c1c[nH]c(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000894899879 1022015555 /nfs/dbraw/zinc/01/55/55/1022015555.db2.gz CHFFMDJKGMZALC-HNNXBMFYSA-N 1 1 328.416 3.821 20 5 EHBDMO CC(C)c1c[nH]c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000894899879 1022015563 /nfs/dbraw/zinc/01/55/63/1022015563.db2.gz CHFFMDJKGMZALC-HNNXBMFYSA-N 1 1 328.416 3.821 20 5 EHBDMO CC(C)[N@@H+](Cc1cn2ccnc2s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891626262 1022147667 /nfs/dbraw/zinc/14/76/67/1022147667.db2.gz XDADVPRHOHLXPV-UHFFFAOYSA-N 1 1 330.413 3.715 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000550079250 1022360966 /nfs/dbraw/zinc/36/09/66/1022360966.db2.gz KSBMYMARPMGBNT-RHSMWYFYSA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548336455 1022376430 /nfs/dbraw/zinc/37/64/30/1022376430.db2.gz JTMBQUVGXPWYQY-LSDHHAIUSA-N 1 1 340.427 3.678 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000441424529 1022462729 /nfs/dbraw/zinc/46/27/29/1022462729.db2.gz IVMYTRMCMZNUPY-OAHLLOKOSA-N 1 1 328.412 3.709 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1O ZINC000438346716 1022585385 /nfs/dbraw/zinc/58/53/85/1022585385.db2.gz LUYVSZYBKOPLMU-KRWDZBQOSA-N 1 1 346.452 3.916 20 5 EHBDMO COc1cc(C[N@H+]2CCCC3(CCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000438369527 1022600993 /nfs/dbraw/zinc/60/09/93/1022600993.db2.gz YQRWAWXPTPJRPZ-UHFFFAOYSA-N 1 1 334.416 3.768 20 5 EHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184264148 1022678998 /nfs/dbraw/zinc/67/89/98/1022678998.db2.gz MTDPJXCVFOAZGU-LLVKDONJSA-N 1 1 330.425 3.706 20 5 EHBDMO CC(C)CCOc1ccc([C@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000341662916 1022915825 /nfs/dbraw/zinc/91/58/25/1022915825.db2.gz YPSRULGWPKGDQC-AWEZNQCLSA-N 1 1 346.431 3.604 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](O)C[C@@H]1c1ccccc1 ZINC000602729766 1033117039 /nfs/dbraw/zinc/11/70/39/1033117039.db2.gz CLMOGNKHTAMATJ-RTBURBONSA-N 1 1 326.396 3.601 20 5 EHBDMO CCOc1cc(C[N@H+](Cc2ccncc2)C2CC2)ccc1[N+](=O)[O-] ZINC000276925081 1023384749 /nfs/dbraw/zinc/38/47/49/1023384749.db2.gz PSFJFQUIUDHRLW-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2ccncc2)C2CC2)ccc1[N+](=O)[O-] ZINC000276925081 1023384757 /nfs/dbraw/zinc/38/47/57/1023384757.db2.gz PSFJFQUIUDHRLW-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccccc2[N+](=O)[O-])cc1F ZINC000063254728 1033144258 /nfs/dbraw/zinc/14/42/58/1033144258.db2.gz WZHUGNNBWQYTTI-UHFFFAOYSA-N 1 1 326.331 3.840 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000280899673 1024411499 /nfs/dbraw/zinc/41/14/99/1024411499.db2.gz DSUPKIIDKRLVOC-YJBOKZPZSA-N 1 1 341.411 3.650 20 5 EHBDMO COc1c2ccccc2oc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000474019017 1024698112 /nfs/dbraw/zinc/69/81/12/1024698112.db2.gz GQDYYKBIFTVERE-UHFFFAOYSA-N 1 1 326.352 3.948 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)o1 ZINC000895843993 1024891340 /nfs/dbraw/zinc/89/13/40/1024891340.db2.gz KXBZGBSLIKLNMI-KDOFPFPSSA-N 1 1 342.395 3.856 20 5 EHBDMO CCn1nc(C)c(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926405 1033256550 /nfs/dbraw/zinc/25/65/50/1033256550.db2.gz PQTKFDPOKHYZCQ-CQSZACIVSA-N 1 1 330.432 3.929 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926405 1033256557 /nfs/dbraw/zinc/25/65/57/1033256557.db2.gz PQTKFDPOKHYZCQ-CQSZACIVSA-N 1 1 330.432 3.929 20 5 EHBDMO CC[C@@H](C)c1nnc([C@H](C)[NH2+]CC=Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000277436418 1025095829 /nfs/dbraw/zinc/09/58/29/1025095829.db2.gz NZZYEAJBZJLFKI-PYISVCGKSA-N 1 1 329.404 3.590 20 5 EHBDMO C[N@@H+](CCCOCc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511107658 1026026384 /nfs/dbraw/zinc/02/63/84/1026026384.db2.gz LJOAPCZAZZTRPP-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO CC(C)n1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451545186 1026095090 /nfs/dbraw/zinc/09/50/90/1026095090.db2.gz GXWTYSKGFJPHFE-INIZCTEOSA-N 1 1 328.416 3.752 20 5 EHBDMO CC(C)n1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451545186 1026095112 /nfs/dbraw/zinc/09/51/12/1026095112.db2.gz GXWTYSKGFJPHFE-INIZCTEOSA-N 1 1 328.416 3.752 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CC(c3nc4ccccc4s3)C2)c1 ZINC000342540689 1026187618 /nfs/dbraw/zinc/18/76/18/1026187618.db2.gz BKUSSVURBPKSOF-UHFFFAOYSA-N 1 1 325.393 3.804 20 5 EHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000451955028 1026415470 /nfs/dbraw/zinc/41/54/70/1026415470.db2.gz ONSLEMHHASMHTA-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO COc1cccc(N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000475394562 1026558122 /nfs/dbraw/zinc/55/81/22/1026558122.db2.gz WLWZULMALJSBFH-HZPDHXFCSA-N 1 1 347.459 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](Cc4nccs4)C3)c2c1 ZINC000897279632 1026878890 /nfs/dbraw/zinc/87/88/90/1026878890.db2.gz VHRHPPFKRODIBR-GFCCVEGCSA-N 1 1 340.408 3.669 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480080373 1026981944 /nfs/dbraw/zinc/98/19/44/1026981944.db2.gz GFGLCKFGCAXABE-OAHLLOKOSA-N 1 1 347.459 3.967 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](C4CCCC4)C3)n2)c1 ZINC000420960213 1027930282 /nfs/dbraw/zinc/93/02/82/1027930282.db2.gz GLPDDEAHNBPUQK-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444610078 1028075105 /nfs/dbraw/zinc/07/51/05/1028075105.db2.gz NYXYVDSSNQSNTC-CQSZACIVSA-N 1 1 336.395 3.769 20 5 EHBDMO COc1cc(C[N@@H+](C)CC2(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000444670992 1028140013 /nfs/dbraw/zinc/14/00/13/1028140013.db2.gz HIQNUASHDZWAGT-UHFFFAOYSA-N 1 1 344.386 3.906 20 5 EHBDMO NC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCCC1 ZINC000423198792 1028266396 /nfs/dbraw/zinc/26/63/96/1028266396.db2.gz HYZDMLNFPMBAKV-QGZVFWFLSA-N 1 1 331.460 3.557 20 5 EHBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000016434719 1028495733 /nfs/dbraw/zinc/49/57/33/1028495733.db2.gz MHNHGCYQGNJMRT-NSHDSACASA-N 1 1 334.397 3.716 20 5 EHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000016434719 1028495751 /nfs/dbraw/zinc/49/57/51/1028495751.db2.gz MHNHGCYQGNJMRT-NSHDSACASA-N 1 1 334.397 3.716 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000445255349 1028664908 /nfs/dbraw/zinc/66/49/08/1028664908.db2.gz SMZUGOOCBUVIBB-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO Cc1nc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000176386227 1028838361 /nfs/dbraw/zinc/83/83/61/1028838361.db2.gz UZWFFAGPLNGXCY-UHFFFAOYSA-N 1 1 347.440 3.712 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)CN(C)C ZINC000504911816 1029053688 /nfs/dbraw/zinc/05/36/88/1029053688.db2.gz LWDXRVYVJYQILU-CQSZACIVSA-N 1 1 339.505 3.643 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926338 1029072873 /nfs/dbraw/zinc/07/28/73/1029072873.db2.gz IFXOJFJNEITEKA-JYJNAYRXSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926338 1029072891 /nfs/dbraw/zinc/07/28/91/1029072891.db2.gz IFXOJFJNEITEKA-JYJNAYRXSA-N 1 1 349.475 3.765 20 5 EHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000524755275 1029485193 /nfs/dbraw/zinc/48/51/93/1029485193.db2.gz LKSWVULIBUDBKR-SFHVURJKSA-N 1 1 325.412 3.998 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709362 1030047968 /nfs/dbraw/zinc/04/79/68/1030047968.db2.gz VNFCZCWSPMQWII-HIFRSBDPSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709362 1030047983 /nfs/dbraw/zinc/04/79/83/1030047983.db2.gz VNFCZCWSPMQWII-HIFRSBDPSA-N 1 1 345.468 3.896 20 5 EHBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000447403420 1030172606 /nfs/dbraw/zinc/17/26/06/1030172606.db2.gz ONBLECABKGVTNZ-QGZVFWFLSA-N 1 1 340.395 3.524 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367750 1030182489 /nfs/dbraw/zinc/18/24/89/1030182489.db2.gz MKRZPQMBHNLCGY-XKGZKEIXSA-N 1 1 344.455 3.809 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327134 1030265183 /nfs/dbraw/zinc/26/51/83/1030265183.db2.gz XWTWASJTLPYNLB-KDOFPFPSSA-N 1 1 342.443 3.823 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482693576 1030643668 /nfs/dbraw/zinc/64/36/68/1030643668.db2.gz CBBQYKMNLNNPMU-UHFFFAOYSA-N 1 1 338.411 3.926 20 5 EHBDMO C[NH+](C)C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776188 1030705043 /nfs/dbraw/zinc/70/50/43/1030705043.db2.gz TXLRGRAJRBHTFZ-YEODSOHDSA-N 1 1 343.402 3.640 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000190698731 1030917747 /nfs/dbraw/zinc/91/77/47/1030917747.db2.gz VBHDDMHAJKEXNN-SNVBAGLBSA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000190698731 1030917762 /nfs/dbraw/zinc/91/77/62/1030917762.db2.gz VBHDDMHAJKEXNN-SNVBAGLBSA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@H]1CCCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000187926236 1030961016 /nfs/dbraw/zinc/96/10/16/1030961016.db2.gz UHRRCUJYQQGKEZ-AWEZNQCLSA-N 1 1 329.400 3.914 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000483340552 1031126259 /nfs/dbraw/zinc/12/62/59/1031126259.db2.gz KVHQGZVPPYLDNM-DNVCBOLYSA-N 1 1 348.443 3.624 20 5 EHBDMO C[N@H+]1CC[C@@H](Cc2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000904132214 1031769786 /nfs/dbraw/zinc/76/97/86/1031769786.db2.gz UQACGJSBJWXRBV-AWEZNQCLSA-N 1 1 344.418 3.932 20 5 EHBDMO Cc1nn(C[N@@H+](C)CCCc2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761288926 1033456711 /nfs/dbraw/zinc/45/67/11/1033456711.db2.gz YFNPHZPSWDBCRR-UHFFFAOYSA-N 1 1 338.411 3.775 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000760509617 1033577273 /nfs/dbraw/zinc/57/72/73/1033577273.db2.gz LSDHNNNIYDWABM-UHFFFAOYSA-N 1 1 343.374 3.507 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)cc1OC ZINC000598955208 1033608878 /nfs/dbraw/zinc/60/88/78/1033608878.db2.gz JJLKWTJVABZSON-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1ccc(C2([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC000595021747 1033614826 /nfs/dbraw/zinc/61/48/26/1033614826.db2.gz CYYCRVGQMCSZIM-ZDUSSCGKSA-N 1 1 342.395 3.952 20 5 EHBDMO Cc1ccc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)cc1[N+](=O)[O-] ZINC000593658608 1033634768 /nfs/dbraw/zinc/63/47/68/1033634768.db2.gz QCUWMNBNDOIVHF-UHFFFAOYSA-N 1 1 332.297 3.770 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000173985891 1033663882 /nfs/dbraw/zinc/66/38/82/1033663882.db2.gz HECFSHWGWYJIHU-MRXNPFEDSA-N 1 1 344.386 3.773 20 5 EHBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(F)(F)C(C)(C)C ZINC000595109999 1033694196 /nfs/dbraw/zinc/69/41/96/1033694196.db2.gz YKTAAYCHDPXYQX-NSHDSACASA-N 1 1 343.374 3.583 20 5 EHBDMO CCCC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000046773491 1033748169 /nfs/dbraw/zinc/74/81/69/1033748169.db2.gz SVFJMIHFHCVELL-UHFFFAOYSA-N 1 1 344.358 3.969 20 5 EHBDMO COc1ccc(C[N@H+](Cc2onc(C)c2[N+](=O)[O-])C(C)(C)C)cc1 ZINC000595491976 1033828422 /nfs/dbraw/zinc/82/84/22/1033828422.db2.gz YTGOJONUWIXFME-UHFFFAOYSA-N 1 1 333.388 3.701 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C(C)(C)C)cc1 ZINC000595491976 1033828429 /nfs/dbraw/zinc/82/84/29/1033828429.db2.gz YTGOJONUWIXFME-UHFFFAOYSA-N 1 1 333.388 3.701 20 5 EHBDMO Cc1noc(C[N@@H+]2CCc3ccc(Cl)cc3[C@H](C)C2)c1[N+](=O)[O-] ZINC000595557439 1033861448 /nfs/dbraw/zinc/86/14/48/1033861448.db2.gz IRGRWJDEBAEHLS-SNVBAGLBSA-N 1 1 335.791 3.706 20 5 EHBDMO Cc1noc(C[N@H+]2CCc3ccc(Cl)cc3[C@H](C)C2)c1[N+](=O)[O-] ZINC000595557439 1033861466 /nfs/dbraw/zinc/86/14/66/1033861466.db2.gz IRGRWJDEBAEHLS-SNVBAGLBSA-N 1 1 335.791 3.706 20 5 EHBDMO CCC(C)(C)[N@@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491218120 1033928089 /nfs/dbraw/zinc/92/80/89/1033928089.db2.gz VDUYYRFHKONREE-UHFFFAOYSA-N 1 1 346.374 3.868 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2cccnc2[N+](=O)[O-])cc1 ZINC000603857853 1033980912 /nfs/dbraw/zinc/98/09/12/1033980912.db2.gz VQJKLBMHDSZLBK-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000603868401 1033993645 /nfs/dbraw/zinc/99/36/45/1033993645.db2.gz LHPRXFQRZJDXCB-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO CCOCc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000179314888 1034108695 /nfs/dbraw/zinc/10/86/95/1034108695.db2.gz AOOBBPJNQPVNNT-UHFFFAOYSA-N 1 1 344.411 3.772 20 5 EHBDMO CCOCc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000179314888 1034108704 /nfs/dbraw/zinc/10/87/04/1034108704.db2.gz AOOBBPJNQPVNNT-UHFFFAOYSA-N 1 1 344.411 3.772 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc2ncccc21 ZINC000596571585 1034293807 /nfs/dbraw/zinc/29/38/07/1034293807.db2.gz XADIJVOQMCIRRA-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598339 1034314496 /nfs/dbraw/zinc/31/44/96/1034314496.db2.gz LTKVHVUFAPNFPF-AWEZNQCLSA-N 1 1 342.443 3.782 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174540 1034378467 /nfs/dbraw/zinc/37/84/67/1034378467.db2.gz FTRCTTWJOZAUOI-UGSOOPFHSA-N 1 1 330.359 3.948 20 5 EHBDMO Cc1c(NC(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000054355510 1034410613 /nfs/dbraw/zinc/41/06/13/1034410613.db2.gz QHPOIARBYBJAJR-ZDUSSCGKSA-N 1 1 348.447 3.535 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000054349131 1034410962 /nfs/dbraw/zinc/41/09/62/1034410962.db2.gz UHHYAFLGDGRLMO-CYBMUJFWSA-N 1 1 348.447 3.535 20 5 EHBDMO COc1cc(C)c([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000179631045 1034526739 /nfs/dbraw/zinc/52/67/39/1034526739.db2.gz LLQMEMUJILSNGL-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000597206583 1034592560 /nfs/dbraw/zinc/59/25/60/1034592560.db2.gz RTODRXHTBFJMCQ-AZUAARDMSA-N 1 1 340.423 3.501 20 5 EHBDMO C[C@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212091 1034597134 /nfs/dbraw/zinc/59/71/34/1034597134.db2.gz RPSMVSYVNXMZIZ-KDOFPFPSSA-N 1 1 344.436 3.792 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597219150 1034601531 /nfs/dbraw/zinc/60/15/31/1034601531.db2.gz ZDAAHMIWIKVTAY-GOSISDBHSA-N 1 1 342.395 3.850 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597219150 1034601539 /nfs/dbraw/zinc/60/15/39/1034601539.db2.gz ZDAAHMIWIKVTAY-GOSISDBHSA-N 1 1 342.395 3.850 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000597224939 1034625556 /nfs/dbraw/zinc/62/55/56/1034625556.db2.gz KUGSAPAOBKIGLN-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccn(CC(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000450676359 1034705227 /nfs/dbraw/zinc/70/52/27/1034705227.db2.gz FHHQNMJGIMYSAZ-AWEZNQCLSA-N 1 1 342.321 3.595 20 5 EHBDMO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1noc(-c2ccccc2)n1 ZINC000612523797 1035029656 /nfs/dbraw/zinc/02/96/56/1035029656.db2.gz USOIJDULZHXLKR-ZDUSSCGKSA-N 1 1 338.367 3.538 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000535077673 1036001011 /nfs/dbraw/zinc/00/10/11/1036001011.db2.gz XWGVQEOXAIVLJE-XSHSDMCLSA-N 1 1 344.333 3.651 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000535077673 1036001029 /nfs/dbraw/zinc/00/10/29/1036001029.db2.gz XWGVQEOXAIVLJE-XSHSDMCLSA-N 1 1 344.333 3.651 20 5 EHBDMO CCN(CC)c1ncc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000589183962 1036297313 /nfs/dbraw/zinc/29/73/13/1036297313.db2.gz YWCFZSGUYHQLNU-UHFFFAOYSA-N 1 1 348.472 3.572 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000589495341 1036437866 /nfs/dbraw/zinc/43/78/66/1036437866.db2.gz QBKWEDKSHSCMRY-OAHLLOKOSA-N 1 1 346.408 3.780 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000589495341 1036437873 /nfs/dbraw/zinc/43/78/73/1036437873.db2.gz QBKWEDKSHSCMRY-OAHLLOKOSA-N 1 1 346.408 3.780 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000541773772 1036646623 /nfs/dbraw/zinc/64/66/23/1036646623.db2.gz MHEXTPJTPDWKTP-KXBFYZLASA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000541773772 1036646631 /nfs/dbraw/zinc/64/66/31/1036646631.db2.gz MHEXTPJTPDWKTP-KXBFYZLASA-N 1 1 326.396 3.865 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(C3CC3)CC2)c1 ZINC000590052754 1036740085 /nfs/dbraw/zinc/74/00/85/1036740085.db2.gz KNULRTFSSFNDLY-UHFFFAOYSA-N 1 1 326.343 3.818 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000541999092 1036964296 /nfs/dbraw/zinc/96/42/96/1036964296.db2.gz VGLVYDOGEBNJNV-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Oc2cncc(Cl)c2)CC1 ZINC000590602014 1036964538 /nfs/dbraw/zinc/96/45/38/1036964538.db2.gz QPNKEKYJXHOYOE-UHFFFAOYSA-N 1 1 347.802 3.687 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000542049075 1037025433 /nfs/dbraw/zinc/02/54/33/1037025433.db2.gz QBNUFHDVKNYMBN-ZVZYQTTQSA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1CCCC[C@H]1C ZINC000761520401 1037097855 /nfs/dbraw/zinc/09/78/55/1037097855.db2.gz FAYVCUCMLRBQLX-CHWSQXEVSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@H]1C ZINC000761520401 1037097873 /nfs/dbraw/zinc/09/78/73/1037097873.db2.gz FAYVCUCMLRBQLX-CHWSQXEVSA-N 1 1 325.840 3.601 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@H]1CC=CCC1 ZINC000542242642 1037206948 /nfs/dbraw/zinc/20/69/48/1037206948.db2.gz KOWUNHORRHGYDV-HNNXBMFYSA-N 1 1 331.416 3.520 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](C4CCC4)C3)co2)cc1 ZINC000591063380 1037225569 /nfs/dbraw/zinc/22/55/69/1037225569.db2.gz SFICJGCAMYKMMA-OAHLLOKOSA-N 1 1 327.384 3.872 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462834526 1037459324 /nfs/dbraw/zinc/45/93/24/1037459324.db2.gz PXPNMDQCGTUQIK-HYXAFXHYSA-N 1 1 336.391 3.861 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462834526 1037459335 /nfs/dbraw/zinc/45/93/35/1037459335.db2.gz PXPNMDQCGTUQIK-HYXAFXHYSA-N 1 1 336.391 3.861 20 5 EHBDMO C[C@@H](NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591581105 1037516689 /nfs/dbraw/zinc/51/66/89/1037516689.db2.gz KTFBRVDYZWRVPY-AGIUHOORSA-N 1 1 349.431 3.674 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000538760044 1038509594 /nfs/dbraw/zinc/50/95/94/1038509594.db2.gz NPJDZVPOWSSHTC-LSDHHAIUSA-N 1 1 347.459 3.513 20 5 EHBDMO C[N@H+](CCOc1ccc(F)cc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000538743201 1038509756 /nfs/dbraw/zinc/50/97/56/1038509756.db2.gz JVDSRCYSYLPJIL-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccc(F)cc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000538743201 1038509763 /nfs/dbraw/zinc/50/97/63/1038509763.db2.gz JVDSRCYSYLPJIL-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000015301013 1039087906 /nfs/dbraw/zinc/08/79/06/1039087906.db2.gz YLNQRWJZTCKFHN-QGZVFWFLSA-N 1 1 340.379 3.703 20 5 EHBDMO CC(C)[N@H+](CC(=O)N1[C@H](C)CCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138399863 1039150808 /nfs/dbraw/zinc/15/08/08/1039150808.db2.gz OXLLUGHVHOLFFV-IYBDPMFKSA-N 1 1 347.459 3.595 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N1[C@H](C)CCC[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138399863 1039150818 /nfs/dbraw/zinc/15/08/18/1039150818.db2.gz OXLLUGHVHOLFFV-IYBDPMFKSA-N 1 1 347.459 3.595 20 5 EHBDMO Cc1ccc(N2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000728914052 1039330022 /nfs/dbraw/zinc/33/00/22/1039330022.db2.gz NXAWQPIVOTUENS-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000728914052 1039330037 /nfs/dbraw/zinc/33/00/37/1039330037.db2.gz NXAWQPIVOTUENS-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1CO ZINC000249068150 1039379773 /nfs/dbraw/zinc/37/97/73/1039379773.db2.gz JEGGOZVALSRULW-LRDDRELGSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1 ZINC000500757325 1039387863 /nfs/dbraw/zinc/38/78/63/1039387863.db2.gz HUMQXITXOOPAFI-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000488897224 1039462219 /nfs/dbraw/zinc/46/22/19/1039462219.db2.gz MNXMIICPPIKLRL-CYBMUJFWSA-N 1 1 346.818 3.526 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[NH+](Cc2cccs2)CC1 ZINC000485817924 1039596935 /nfs/dbraw/zinc/59/69/35/1039596935.db2.gz QUIKRDBXSFIXCQ-HNNXBMFYSA-N 1 1 345.468 3.844 20 5 EHBDMO CC(C)N1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316982 1039658256 /nfs/dbraw/zinc/65/82/56/1039658256.db2.gz VMFYWFSWELJXCT-IBGZPJMESA-N 1 1 331.460 3.825 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2cc(C)ccc2C)c([N+](=O)[O-])cc1OC ZINC000432890374 1040075946 /nfs/dbraw/zinc/07/59/46/1040075946.db2.gz ZXBVOXDUKBVBKR-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cc(C)ccc2C)c([N+](=O)[O-])cc1OC ZINC000432890374 1040075967 /nfs/dbraw/zinc/07/59/67/1040075967.db2.gz ZXBVOXDUKBVBKR-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128287124 1040289164 /nfs/dbraw/zinc/28/91/64/1040289164.db2.gz BAXAMESXXUOEJA-CHWSQXEVSA-N 1 1 337.395 3.573 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490064884 1040330151 /nfs/dbraw/zinc/33/01/51/1040330151.db2.gz IWGNVUAITJYTMZ-KRWDZBQOSA-N 1 1 341.411 3.550 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000490092146 1040353729 /nfs/dbraw/zinc/35/37/29/1040353729.db2.gz YVCISCVTMHAOBR-QGTPRVQTSA-N 1 1 348.443 3.629 20 5 EHBDMO CC[N@@H+](CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490191576 1040395013 /nfs/dbraw/zinc/39/50/13/1040395013.db2.gz UQENBBDXYNAWED-HXUWFJFHSA-N 1 1 339.439 3.758 20 5 EHBDMO CCN(CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490191576 1040395025 /nfs/dbraw/zinc/39/50/25/1040395025.db2.gz UQENBBDXYNAWED-HXUWFJFHSA-N 1 1 339.439 3.758 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769533 1040425516 /nfs/dbraw/zinc/42/55/16/1040425516.db2.gz FFQDXJPJAMMJGN-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787133 1040443989 /nfs/dbraw/zinc/44/39/89/1040443989.db2.gz HEDIZDDHMCMDDG-WMLDXEAASA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000092626565 1040463682 /nfs/dbraw/zinc/46/36/82/1040463682.db2.gz FWZRHNPMWZMTKO-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c(F)c1 ZINC000586768623 1041006240 /nfs/dbraw/zinc/00/62/40/1041006240.db2.gz TXWJYHSIXCUWJE-STQMWFEESA-N 1 1 340.370 3.512 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c(F)c1 ZINC000586768623 1041006254 /nfs/dbraw/zinc/00/62/54/1041006254.db2.gz TXWJYHSIXCUWJE-STQMWFEESA-N 1 1 340.370 3.512 20 5 EHBDMO COCC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433185757 1041023758 /nfs/dbraw/zinc/02/37/58/1041023758.db2.gz FVTRETHJPDMTHR-LBPRGKRZSA-N 1 1 344.864 3.592 20 5 EHBDMO COCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433185757 1041023764 /nfs/dbraw/zinc/02/37/64/1041023764.db2.gz FVTRETHJPDMTHR-LBPRGKRZSA-N 1 1 344.864 3.592 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000511745223 1041548863 /nfs/dbraw/zinc/54/88/63/1041548863.db2.gz ZCDPCMKDRABFBB-LLVKDONJSA-N 1 1 331.338 3.900 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000247201380 1041582579 /nfs/dbraw/zinc/58/25/79/1041582579.db2.gz CBFNYVDKCTXXDZ-PBFPGSCMSA-N 1 1 332.400 3.614 20 5 EHBDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283789 1042138822 /nfs/dbraw/zinc/13/88/22/1042138822.db2.gz IQTARADSKNIRTJ-HIFRSBDPSA-N 1 1 334.416 3.567 20 5 EHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311637 1042260896 /nfs/dbraw/zinc/26/08/96/1042260896.db2.gz XPFUJEKIFQLAKF-HNNXBMFYSA-N 1 1 347.440 3.748 20 5 EHBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4ccc(C(C)C)c([N+](=O)[O-])c4)[C@H]1[C@H]3C2 ZINC000567650797 1042459405 /nfs/dbraw/zinc/45/94/05/1042459405.db2.gz TZOUWMNTWZOKKR-NZMUHZMNSA-N 1 1 330.428 3.573 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799437 1042700843 /nfs/dbraw/zinc/70/08/43/1042700843.db2.gz ZMGDHQPYHQJVRS-CJNGLKHVSA-N 1 1 334.416 3.782 20 5 EHBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072897483 1042764267 /nfs/dbraw/zinc/76/42/67/1042764267.db2.gz HYHHRJFHHWYJOS-UONOGXRCSA-N 1 1 329.400 3.913 20 5 EHBDMO COC(=O)c1coc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000278908054 1042906157 /nfs/dbraw/zinc/90/61/57/1042906157.db2.gz ZWSASJXXRYYQLJ-NWDGAFQWSA-N 1 1 332.356 3.695 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncs1 ZINC000279583274 1044253372 /nfs/dbraw/zinc/25/33/72/1044253372.db2.gz USYADRKXHGLDOY-MRVPVSSYSA-N 1 1 331.319 3.921 20 5 EHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697753 1126856387 /nfs/dbraw/zinc/85/63/87/1126856387.db2.gz SIPRZQUQFUHMJU-HIFRSBDPSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283260 1127473386 /nfs/dbraw/zinc/47/33/86/1127473386.db2.gz PFKBJQOHBYXWMX-RYUDHWBXSA-N 1 1 341.839 3.943 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](O)C34CCCC4)o2)cc1 ZINC000552085209 1127579145 /nfs/dbraw/zinc/57/91/45/1127579145.db2.gz UFWFXSYEVSMERO-SFHVURJKSA-N 1 1 342.395 3.734 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CCCC3)C2)c2ncccc12 ZINC000301404589 1127741916 /nfs/dbraw/zinc/74/19/16/1127741916.db2.gz SSEKZXRKSRNZFI-ZDUSSCGKSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3ccccc3CO)CC2)cs1 ZINC000347625060 1128151737 /nfs/dbraw/zinc/15/17/37/1128151737.db2.gz AZCZHOYDNDVFLN-UHFFFAOYSA-N 1 1 346.452 3.603 20 5 EHBDMO C[C@@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1ccc([N+](=O)[O-])cc1 ZINC000131588813 1128456828 /nfs/dbraw/zinc/45/68/28/1128456828.db2.gz SHSNYBMKBDTDNJ-LLVKDONJSA-N 1 1 330.775 3.747 20 5 EHBDMO Cc1ccnc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000301562905 1128497644 /nfs/dbraw/zinc/49/76/44/1128497644.db2.gz IWOZSXXQNCVHOU-WBVHZDCISA-N 1 1 340.427 3.621 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301603656 1128521868 /nfs/dbraw/zinc/52/18/68/1128521868.db2.gz LFPCLLHSHBNHKS-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO Cc1nc2sccn2c1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000273428966 1128527134 /nfs/dbraw/zinc/52/71/34/1128527134.db2.gz KTXVYBLSPRYJHD-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO Cc1nc2sccn2c1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000273428966 1128527138 /nfs/dbraw/zinc/52/71/38/1128527138.db2.gz KTXVYBLSPRYJHD-UHFFFAOYSA-N 1 1 330.413 3.553 20 5 EHBDMO C[C@@H](CCSc1ccccc1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000495475335 1121225986 /nfs/dbraw/zinc/22/59/86/1121225986.db2.gz JQKYMYIMASFFAX-AWEZNQCLSA-N 1 1 343.452 3.919 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@H]12 ZINC000915209643 1121253681 /nfs/dbraw/zinc/25/36/81/1121253681.db2.gz LXKJZHXWDJDXRQ-KBRIMQKVSA-N 1 1 328.416 3.803 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC000762634434 1121390521 /nfs/dbraw/zinc/39/05/21/1121390521.db2.gz PBBUJTREURDSHB-RTBURBONSA-N 1 1 326.396 3.855 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC000762634423 1121392617 /nfs/dbraw/zinc/39/26/17/1121392617.db2.gz PBBUJTREURDSHB-MOPGFXCFSA-N 1 1 326.396 3.855 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301087853 1121533455 /nfs/dbraw/zinc/53/34/55/1121533455.db2.gz KEYUIKSVPRIXEO-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO CC[N@@H+](CC(C)C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153752728 1121690578 /nfs/dbraw/zinc/69/05/78/1121690578.db2.gz YFIYZZNISMOZAH-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(Oc3ccc(F)cc3F)CC2)c1 ZINC000193877259 1121723130 /nfs/dbraw/zinc/72/31/30/1121723130.db2.gz QTMWOSJHWSZKBF-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609233774 1121823055 /nfs/dbraw/zinc/82/30/55/1121823055.db2.gz JAZOUAPASOPKGF-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609233774 1121823063 /nfs/dbraw/zinc/82/30/63/1121823063.db2.gz JAZOUAPASOPKGF-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO CCCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](C)CC ZINC000917438451 1122602411 /nfs/dbraw/zinc/60/24/11/1122602411.db2.gz VEFJWLBSNUARMY-AWEZNQCLSA-N 1 1 331.420 3.711 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301788531 1129069499 /nfs/dbraw/zinc/06/94/99/1129069499.db2.gz PWIIBULWHPASRI-SWLSCSKDSA-N 1 1 335.835 3.701 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000154709068 1122799862 /nfs/dbraw/zinc/79/98/62/1122799862.db2.gz WBWWSNLPMRBCHM-CQSZACIVSA-N 1 1 329.400 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCc3sccc3C2)cc1 ZINC000609323027 1123450617 /nfs/dbraw/zinc/45/06/17/1123450617.db2.gz RAEHJHXXTGVNFD-UHFFFAOYSA-N 1 1 332.425 3.874 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672697 1123641751 /nfs/dbraw/zinc/64/17/51/1123641751.db2.gz XXCWCCCRXYAPRV-RDJZCZTQSA-N 1 1 326.396 3.852 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000609705240 1123647498 /nfs/dbraw/zinc/64/74/98/1123647498.db2.gz KNOFVOSMSRGKOZ-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)n1 ZINC000609705240 1123647499 /nfs/dbraw/zinc/64/74/99/1123647499.db2.gz KNOFVOSMSRGKOZ-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800494 1123664364 /nfs/dbraw/zinc/66/43/64/1123664364.db2.gz JYPGPRHONUBLLT-GOSISDBHSA-N 1 1 328.437 3.927 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCCC2)CC1 ZINC000610004340 1123712282 /nfs/dbraw/zinc/71/22/82/1123712282.db2.gz DYNZQJWLUNPPGG-AWEZNQCLSA-N 1 1 331.416 3.578 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000619698901 1125384165 /nfs/dbraw/zinc/38/41/65/1125384165.db2.gz MZNXTKBWGGOBOL-LBPRGKRZSA-N 1 1 332.429 3.573 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(F)cc1 ZINC000301880076 1129252173 /nfs/dbraw/zinc/25/21/73/1129252173.db2.gz ZPLFHHVYMVASKC-IRXDYDNUSA-N 1 1 333.338 3.730 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301884962 1129261985 /nfs/dbraw/zinc/26/19/85/1129261985.db2.gz ZFBICBNHWZSNRL-OAHLLOKOSA-N 1 1 340.427 3.801 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)c(F)c1 ZINC000301915218 1129345737 /nfs/dbraw/zinc/34/57/37/1129345737.db2.gz VGUKRBFFWXTONX-RDJZCZTQSA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)c(F)c1 ZINC000301915218 1129345742 /nfs/dbraw/zinc/34/57/42/1129345742.db2.gz VGUKRBFFWXTONX-RDJZCZTQSA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000081014220 1129394104 /nfs/dbraw/zinc/39/41/04/1129394104.db2.gz RRTLMMCUHZQVOS-INIZCTEOSA-N 1 1 331.441 3.757 20 5 EHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000081014220 1129394109 /nfs/dbraw/zinc/39/41/09/1129394109.db2.gz RRTLMMCUHZQVOS-INIZCTEOSA-N 1 1 331.441 3.757 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070394 1129420786 /nfs/dbraw/zinc/42/07/86/1129420786.db2.gz YJQWGTIAHPTTAD-CYBMUJFWSA-N 1 1 331.372 3.518 20 5 EHBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000533263855 1129467725 /nfs/dbraw/zinc/46/77/25/1129467725.db2.gz QQXVEJIYQZCIFR-HNNXBMFYSA-N 1 1 341.411 3.659 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436536 1129546005 /nfs/dbraw/zinc/54/60/05/1129546005.db2.gz MSLKURBLPVUAMC-KRWDZBQOSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436536 1129546008 /nfs/dbraw/zinc/54/60/08/1129546008.db2.gz MSLKURBLPVUAMC-KRWDZBQOSA-N 1 1 330.384 3.677 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000922538674 1129565876 /nfs/dbraw/zinc/56/58/76/1129565876.db2.gz VGJWCXKWUPSEQX-IAQYHMDHSA-N 1 1 333.413 3.754 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000124338384 1129598940 /nfs/dbraw/zinc/59/89/40/1129598940.db2.gz BVZZSCMLHHMPPR-JTQLQIEISA-N 1 1 348.321 3.529 20 5 EHBDMO CC[N@@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000132094097 1129875740 /nfs/dbraw/zinc/87/57/40/1129875740.db2.gz SVPOATPLILJMFJ-HNNXBMFYSA-N 1 1 341.411 3.752 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCO)Cc1cccc(Cl)c1 ZINC000134282193 1129989318 /nfs/dbraw/zinc/98/93/18/1129989318.db2.gz GAGAWHKWZYNSCD-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCO)Cc1cccc(Cl)c1 ZINC000134282193 1129989320 /nfs/dbraw/zinc/98/93/20/1129989320.db2.gz GAGAWHKWZYNSCD-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173465010 1130235648 /nfs/dbraw/zinc/23/56/48/1130235648.db2.gz KZVOWUFJBFCTGU-NEPJUHHUSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173465010 1130235655 /nfs/dbraw/zinc/23/56/55/1130235655.db2.gz KZVOWUFJBFCTGU-NEPJUHHUSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000246068367 1130339554 /nfs/dbraw/zinc/33/95/54/1130339554.db2.gz ZBHGKOVUIYECET-UONOGXRCSA-N 1 1 329.400 3.770 20 5 EHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000246201022 1130356069 /nfs/dbraw/zinc/35/60/69/1130356069.db2.gz WALCDVDUTBFCFG-XNRPHZJLSA-N 1 1 342.399 3.798 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000175147138 1130409789 /nfs/dbraw/zinc/40/97/89/1130409789.db2.gz WVUSJPJYJAZACI-ZDUSSCGKSA-N 1 1 347.440 3.830 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1C ZINC000740870793 1131551152 /nfs/dbraw/zinc/55/11/52/1131551152.db2.gz IMMFFGIVLRDOKA-VXGBXAGGSA-N 1 1 334.445 3.514 20 5 EHBDMO c1ccc2c(c1)cc1ccccc1c2C[NH2+]Cc1nnnn1C1CC1 ZINC000742388055 1131714212 /nfs/dbraw/zinc/71/42/12/1131714212.db2.gz QDOGBTFWZXWGPX-UHFFFAOYSA-N 1 1 329.407 3.604 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000743407242 1131916917 /nfs/dbraw/zinc/91/69/17/1131916917.db2.gz RNVHQAANGZNINI-GOSISDBHSA-N 1 1 343.431 3.713 20 5 EHBDMO C[C@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014069 1131936070 /nfs/dbraw/zinc/93/60/70/1131936070.db2.gz JJJVZGPDWFDUDB-LBPRGKRZSA-N 1 1 339.386 3.574 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](Cc2ccco2)C2CC2)c1F ZINC001173194178 1131995276 /nfs/dbraw/zinc/99/52/76/1131995276.db2.gz YIZTWHWXYOVXBG-GFCCVEGCSA-N 1 1 348.374 3.931 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](OCc2ccccc2)C1 ZINC001173225457 1132006663 /nfs/dbraw/zinc/00/66/63/1132006663.db2.gz CGAYBEKHFCWWEH-OXQOHEQNSA-N 1 1 340.423 3.817 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001173231907 1132008860 /nfs/dbraw/zinc/00/88/60/1132008860.db2.gz DMDFPERPPXTMGB-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738244517 1132552087 /nfs/dbraw/zinc/55/20/87/1132552087.db2.gz XMVHWNBTZQYFHI-SFHVURJKSA-N 1 1 336.395 3.911 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738244517 1132552093 /nfs/dbraw/zinc/55/20/93/1132552093.db2.gz XMVHWNBTZQYFHI-SFHVURJKSA-N 1 1 336.395 3.911 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038399 1132637244 /nfs/dbraw/zinc/63/72/44/1132637244.db2.gz YLFGDRTXIUVSHS-INWMFGNUSA-N 1 1 342.361 3.940 20 5 EHBDMO CC[N@@H+](Cc1ccc(Br)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040062 1132638668 /nfs/dbraw/zinc/63/86/68/1132638668.db2.gz XLGICOTYVBMQIY-DZGCQCFKSA-N 1 1 341.249 3.716 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@@H]3CCCC(F)(F)C3)ccc([N+](=O)[O-])c2C1 ZINC001169219189 1132698898 /nfs/dbraw/zinc/69/88/98/1132698898.db2.gz OYVFHYZRRNOQRC-LLVKDONJSA-N 1 1 325.359 3.573 20 5 EHBDMO C[N@H+]1CCc2c(N[C@@H]3CCCC(F)(F)C3)ccc([N+](=O)[O-])c2C1 ZINC001169219189 1132698903 /nfs/dbraw/zinc/69/89/03/1132698903.db2.gz OYVFHYZRRNOQRC-LLVKDONJSA-N 1 1 325.359 3.573 20 5 EHBDMO COc1ccc(Nc2ccc(Cn3cc[nH+]c3C)cc2)cc1[N+](=O)[O-] ZINC001176362827 1132921295 /nfs/dbraw/zinc/92/12/95/1132921295.db2.gz JIIBMGPZCGPKPV-UHFFFAOYSA-N 1 1 338.367 3.900 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CCCC23CCC3)c1 ZINC001176372589 1132924217 /nfs/dbraw/zinc/92/42/17/1132924217.db2.gz HUSOJLAAGRBZCH-UHFFFAOYSA-N 1 1 325.206 3.876 20 5 EHBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937199 1133073048 /nfs/dbraw/zinc/07/30/48/1133073048.db2.gz YXRZKEPQVQGTDB-UXHICEINSA-N 1 1 340.423 3.725 20 5 EHBDMO OCCO[C@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769384868 1133273956 /nfs/dbraw/zinc/27/39/56/1133273956.db2.gz XRFKCKXJMHNSDF-IBGZPJMESA-N 1 1 335.447 3.966 20 5 EHBDMO COC(=O)C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769446988 1133291717 /nfs/dbraw/zinc/29/17/17/1133291717.db2.gz PVBBWFSJDAXAQY-SFHVURJKSA-N 1 1 349.430 3.757 20 5 EHBDMO C[NH+]1CCN(C(=O)CCc2c3ccccc3cc3ccccc32)CC1 ZINC001182408711 1133650135 /nfs/dbraw/zinc/65/01/35/1133650135.db2.gz GCXRFSKOMVEWAD-UHFFFAOYSA-N 1 1 332.447 3.700 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC001185097810 1134028190 /nfs/dbraw/zinc/02/81/90/1134028190.db2.gz DRHFDBUCSVYPNG-LBPRGKRZSA-N 1 1 349.460 3.666 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000774877082 1134085653 /nfs/dbraw/zinc/08/56/53/1134085653.db2.gz VYKICJUBPXHKBK-ZDUSSCGKSA-N 1 1 329.356 3.739 20 5 EHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788474715 1134129193 /nfs/dbraw/zinc/12/91/93/1134129193.db2.gz SNWCPZODEOOQOL-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc2cnccc21 ZINC001187063619 1134291742 /nfs/dbraw/zinc/29/17/42/1134291742.db2.gz KQQLRVQOHNTLFB-INIZCTEOSA-N 1 1 340.427 3.962 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329062 1134748907 /nfs/dbraw/zinc/74/89/07/1134748907.db2.gz NVNNDWBXFAZDSU-KSSFIOAISA-N 1 1 341.411 3.767 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC=C(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000792939894 1134821961 /nfs/dbraw/zinc/82/19/61/1134821961.db2.gz MMGLIJZUNPZQGM-UHFFFAOYSA-N 1 1 339.351 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC=C(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000792939894 1134821971 /nfs/dbraw/zinc/82/19/71/1134821971.db2.gz MMGLIJZUNPZQGM-UHFFFAOYSA-N 1 1 339.351 3.792 20 5 EHBDMO C[C@@]12CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(Cl)Cl ZINC000792916273 1134824286 /nfs/dbraw/zinc/82/42/86/1134824286.db2.gz XDQOEUWFYRKOPG-UONOGXRCSA-N 1 1 329.227 3.653 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192196258 1134977879 /nfs/dbraw/zinc/97/78/79/1134977879.db2.gz AZLOPFGKFAFTQW-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001192358644 1135005594 /nfs/dbraw/zinc/00/55/94/1135005594.db2.gz LWCVZTYHNYJPIX-CYBMUJFWSA-N 1 1 334.803 3.804 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001192358644 1135005596 /nfs/dbraw/zinc/00/55/96/1135005596.db2.gz LWCVZTYHNYJPIX-CYBMUJFWSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000775554012 1135073239 /nfs/dbraw/zinc/07/32/39/1135073239.db2.gz VAWWVEPEENVLPP-UHFFFAOYSA-N 1 1 346.770 3.756 20 5 EHBDMO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC001170508258 1135445577 /nfs/dbraw/zinc/44/55/77/1135445577.db2.gz RQEDFCQIJLZHDR-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC001170508258 1135445582 /nfs/dbraw/zinc/44/55/82/1135445582.db2.gz RQEDFCQIJLZHDR-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939164 1135486981 /nfs/dbraw/zinc/48/69/81/1135486981.db2.gz WXYJXKKZGOANJM-HZMBPMFUSA-N 1 1 347.242 3.885 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939164 1135486983 /nfs/dbraw/zinc/48/69/83/1135486983.db2.gz WXYJXKKZGOANJM-HZMBPMFUSA-N 1 1 347.242 3.885 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCSC[C@H]1C1CC1 ZINC001198270906 1135798460 /nfs/dbraw/zinc/79/84/60/1135798460.db2.gz SKZXLKIPADJJKB-HNNXBMFYSA-N 1 1 326.849 3.966 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1(O)CCCC1 ZINC000809966224 1135904108 /nfs/dbraw/zinc/90/41/08/1135904108.db2.gz VOVBRXQIJOFLLB-UHFFFAOYSA-N 1 1 333.215 3.639 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000809965762 1135904355 /nfs/dbraw/zinc/90/43/55/1135904355.db2.gz OULNSURWTIIPRV-MNOVXSKESA-N 1 1 345.226 3.760 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850651 1136261292 /nfs/dbraw/zinc/26/12/92/1136261292.db2.gz XTGQUSPTOIHAER-AUUYWEPGSA-N 1 1 344.411 3.547 20 5 EHBDMO CCC(C)(CC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174370 1136298205 /nfs/dbraw/zinc/29/82/05/1136298205.db2.gz ZFPUCMHHSJOWCK-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO CCC(C)(CC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174370 1136298207 /nfs/dbraw/zinc/29/82/07/1136298207.db2.gz ZFPUCMHHSJOWCK-INIZCTEOSA-N 1 1 334.416 3.539 20 5 EHBDMO C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+](C2CCC2)C1 ZINC000813630981 1136354565 /nfs/dbraw/zinc/35/45/65/1136354565.db2.gz UBNPOWRDABKORH-GFCCVEGCSA-N 1 1 346.456 3.515 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216719537 1136378222 /nfs/dbraw/zinc/37/82/22/1136378222.db2.gz XKOPXSPGDSVWOT-CYBMUJFWSA-N 1 1 328.368 3.907 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000776578109 1136443492 /nfs/dbraw/zinc/44/34/92/1136443492.db2.gz DLDWMERNLVLFJB-GOSISDBHSA-N 1 1 330.384 3.666 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3cccc(F)n3)o2)c1 ZINC000747935807 1136443968 /nfs/dbraw/zinc/44/39/68/1136443968.db2.gz OBORTIBRKRRBRR-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000853540630 1136542817 /nfs/dbraw/zinc/54/28/17/1136542817.db2.gz JERPMIXIANWBCP-LBPRGKRZSA-N 1 1 336.342 3.650 20 5 EHBDMO C/C(=C\C(=O)Nc1cc(C)c2[nH+]ccn2c1)c1ccc([N+](=O)[O-])cc1 ZINC000818057590 1136861166 /nfs/dbraw/zinc/86/11/66/1136861166.db2.gz TVNKNEIAYIDTGS-ZRDIBKRKSA-N 1 1 336.351 3.593 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(Cl)cc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000820664144 1137000273 /nfs/dbraw/zinc/00/02/73/1137000273.db2.gz JKDUGQGBNIBGJG-UHFFFAOYSA-N 1 1 341.814 3.842 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419327 1137095283 /nfs/dbraw/zinc/09/52/83/1137095283.db2.gz KGHAPCFSIXJUNV-CYBMUJFWSA-N 1 1 331.391 3.646 20 5 EHBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[NH+]1CCC2(CCCCC2)CC1 ZINC000794625844 1137221515 /nfs/dbraw/zinc/22/15/15/1137221515.db2.gz BXWWURGBIYVTHW-UHFFFAOYSA-N 1 1 345.399 3.507 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436974 1137222707 /nfs/dbraw/zinc/22/27/07/1137222707.db2.gz JXOIIJQSHFYJTJ-HNNXBMFYSA-N 1 1 326.343 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@]4(CC4(F)F)C3)co2)cc1 ZINC000844438605 1137223209 /nfs/dbraw/zinc/22/32/09/1137223209.db2.gz FDUWGVCPPKXWRD-INIZCTEOSA-N 1 1 349.337 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@]4(CC4(F)F)C3)co2)cc1 ZINC000844438605 1137223211 /nfs/dbraw/zinc/22/32/11/1137223211.db2.gz FDUWGVCPPKXWRD-INIZCTEOSA-N 1 1 349.337 3.871 20 5 EHBDMO C[C@H](c1cnn(C)c1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339076414 1137382380 /nfs/dbraw/zinc/38/23/80/1137382380.db2.gz SBNAFHYPPMLWMR-SNVBAGLBSA-N 1 1 342.321 3.540 20 5 EHBDMO C[C@H](c1cnn(C)c1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339076414 1137382382 /nfs/dbraw/zinc/38/23/82/1137382382.db2.gz SBNAFHYPPMLWMR-SNVBAGLBSA-N 1 1 342.321 3.540 20 5 EHBDMO COc1ccc2c(c1)OC(C)(C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC001171267919 1137386958 /nfs/dbraw/zinc/38/69/58/1137386958.db2.gz UNHXXJSVYRTICB-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc2c(c1)OC(C)(C)C[N@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC001171267919 1137386960 /nfs/dbraw/zinc/38/69/60/1137386960.db2.gz UNHXXJSVYRTICB-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308941 1137408631 /nfs/dbraw/zinc/40/86/31/1137408631.db2.gz VDKSTEAYKZWVOI-UKRRQHHQSA-N 1 1 334.416 3.537 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000122828624 1137470653 /nfs/dbraw/zinc/47/06/53/1137470653.db2.gz LOZOADODMYKPGH-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000122828624 1137470655 /nfs/dbraw/zinc/47/06/55/1137470655.db2.gz LOZOADODMYKPGH-WOPDTQHZSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000795122227 1137492931 /nfs/dbraw/zinc/49/29/31/1137492931.db2.gz QUPKPWHXWIJCLP-ZDUSSCGKSA-N 1 1 337.851 3.554 20 5 EHBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001171741355 1137511088 /nfs/dbraw/zinc/51/10/88/1137511088.db2.gz NMLIPYJQUVXDPC-OAHLLOKOSA-N 1 1 326.396 3.635 20 5 EHBDMO Cc1cccc(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1[N+](=O)[O-] ZINC000888570860 1137542314 /nfs/dbraw/zinc/54/23/14/1137542314.db2.gz TWKDQIGMNSQXPU-UHFFFAOYSA-N 1 1 340.383 3.541 20 5 EHBDMO C[C@H](NC[C@H](c1ccsc1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017905 1137564728 /nfs/dbraw/zinc/56/47/28/1137564728.db2.gz GUWQZFMHHLPXOD-XHDPSFHLSA-N 1 1 337.420 3.749 20 5 EHBDMO CCN(CC)c1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cn1 ZINC000872023905 1137565579 /nfs/dbraw/zinc/56/55/79/1137565579.db2.gz LBIJJCSVXCBBFD-CYBMUJFWSA-N 1 1 346.406 3.826 20 5 EHBDMO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039953 1137567071 /nfs/dbraw/zinc/56/70/71/1137567071.db2.gz WVDWBVCZCYYJPO-BBRMVZONSA-N 1 1 332.375 3.898 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](c1ccccc1F)[C@H](C)O ZINC000877609985 1137682884 /nfs/dbraw/zinc/68/28/84/1137682884.db2.gz GBFOYFXUSGLOTD-UGSOOPFHSA-N 1 1 332.375 3.562 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2nc(C3CCC3)no2)CC1 ZINC000877736331 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UNGCKJPWFFDCCG-MGPUTAFESA-N 1 1 338.407 3.830 20 5 EHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)c1cc2ccccc2o1 ZINC000176216730 1023882634 /nfs/dbraw/zinc/88/26/34/1023882634.db2.gz VYOCXYMTXQQJDA-ZDUSSCGKSA-N 1 1 328.372 3.621 20 5 EHBDMO Cc1ccn(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)n1 ZINC000434499042 1024099627 /nfs/dbraw/zinc/09/96/27/1024099627.db2.gz KLCPQLHUEDRQJU-UHFFFAOYSA-N 1 1 334.807 3.590 20 5 EHBDMO C[N@@H+](CCCc1ccc2c(c1)CCO2)CCc1cccc([N+](=O)[O-])c1 ZINC000574707006 1024211469 /nfs/dbraw/zinc/21/14/69/1024211469.db2.gz OPWXXDARHMQKGZ-UHFFFAOYSA-N 1 1 340.423 3.637 20 5 EHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500304 1024242864 /nfs/dbraw/zinc/24/28/64/1024242864.db2.gz SMICETROQZKRJV-GXFFZTMASA-N 1 1 327.222 3.978 20 5 EHBDMO COCC[N@@H+](C)CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000505582720 1024535354 /nfs/dbraw/zinc/53/53/54/1024535354.db2.gz VNMSJVXCUCVPEO-KRWDZBQOSA-N 1 1 343.427 3.716 20 5 EHBDMO 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1 1 347.459 3.967 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2cccs2)o1 ZINC000511078790 1025347831 /nfs/dbraw/zinc/34/78/31/1025347831.db2.gz BVVDWEFRRKKNQA-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2cccs2)o1 ZINC000511078790 1025347848 /nfs/dbraw/zinc/34/78/48/1025347848.db2.gz BVVDWEFRRKKNQA-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000521424640 1025382161 /nfs/dbraw/zinc/38/21/61/1025382161.db2.gz QWNHDIBXDHKWKR-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281738123 1025437706 /nfs/dbraw/zinc/43/77/06/1025437706.db2.gz BDPZHNJBQSAAKK-CYBMUJFWSA-N 1 1 344.390 3.651 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281771930 1025481804 /nfs/dbraw/zinc/48/18/04/1025481804.db2.gz DFGBLVAJCPIVAJ-CQSZACIVSA-N 1 1 326.400 3.512 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195300 1025663594 /nfs/dbraw/zinc/66/35/94/1025663594.db2.gz JQBOFFQFEQVNIO-CJNGLKHVSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000347195300 1025663603 /nfs/dbraw/zinc/66/36/03/1025663603.db2.gz JQBOFFQFEQVNIO-CJNGLKHVSA-N 1 1 327.384 3.582 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844011 1025858996 /nfs/dbraw/zinc/85/89/96/1025858996.db2.gz CSUXFGUWZZDHHW-MRXNPFEDSA-N 1 1 326.396 3.804 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000451355440 1025861579 /nfs/dbraw/zinc/86/15/79/1025861579.db2.gz VCNMCLQGFCRNPC-JZXOWHBKSA-N 1 1 348.443 3.509 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@@H]2CCSC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000530524379 1025981310 /nfs/dbraw/zinc/98/13/10/1025981310.db2.gz FKTNPMLQNMRWRB-DYVFJYSZSA-N 1 1 332.425 3.935 20 5 EHBDMO CCO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000451544964 1026092479 /nfs/dbraw/zinc/09/24/79/1026092479.db2.gz QMCOVEKPGLMZDI-ABAIWWIYSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H]1C ZINC000451544964 1026092494 /nfs/dbraw/zinc/09/24/94/1026092494.db2.gz QMCOVEKPGLMZDI-ABAIWWIYSA-N 1 1 346.349 3.861 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nc3c(s2)CCCC3)cc1Cl ZINC000896825891 1026100164 /nfs/dbraw/zinc/10/01/64/1026100164.db2.gz ZAJIEBXINQBNTR-UHFFFAOYSA-N 1 1 337.832 3.873 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000451622436 1026159558 /nfs/dbraw/zinc/15/95/58/1026159558.db2.gz ZXGOBXSASDKREG-PBHICJAKSA-N 1 1 334.391 3.515 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000530901689 1026387315 /nfs/dbraw/zinc/38/73/15/1026387315.db2.gz QALZDDPMZPDKGL-RDJZCZTQSA-N 1 1 349.475 3.687 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1C ZINC000452041895 1026453936 /nfs/dbraw/zinc/45/39/36/1026453936.db2.gz MZUGUGQOUVTPSS-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1C ZINC000452041895 1026453942 /nfs/dbraw/zinc/45/39/42/1026453942.db2.gz MZUGUGQOUVTPSS-UHFFFAOYSA-N 1 1 325.368 3.985 20 5 EHBDMO COC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000452100932 1026477046 /nfs/dbraw/zinc/47/70/46/1026477046.db2.gz IXZDMZSZVQPOPV-GFCCVEGCSA-N 1 1 346.349 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC000531211146 1026690207 /nfs/dbraw/zinc/69/02/07/1026690207.db2.gz ZADSHXPRMDNMBS-HXUWFJFHSA-N 1 1 340.423 3.819 20 5 EHBDMO C[N@H+](Cc1ccccc1)[C@@H](CNCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871575 1026865998 /nfs/dbraw/zinc/86/59/98/1026865998.db2.gz GVHSJWNKVYSZRJ-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871575 1026866004 /nfs/dbraw/zinc/86/60/04/1026866004.db2.gz GVHSJWNKVYSZRJ-FQEVSTJZSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CC[N@@H+](C)CC1 ZINC000272949625 1027192513 /nfs/dbraw/zinc/19/25/13/1027192513.db2.gz MRAIMZSQIOPHEJ-HNNXBMFYSA-N 1 1 345.446 3.768 20 5 EHBDMO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413172856 1027212218 /nfs/dbraw/zinc/21/22/18/1027212218.db2.gz GCZXUORFIXRFPA-DZGCQCFKSA-N 1 1 344.390 3.594 20 5 EHBDMO Cn1c2ccc(Nc3ncc([N+](=O)[O-])cc3F)cc2[nH+]c1C1CC1 ZINC000413212404 1027291293 /nfs/dbraw/zinc/29/12/93/1027291293.db2.gz RDCALCXWMWJOFC-UHFFFAOYSA-N 1 1 327.319 3.637 20 5 EHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611940059 1027641472 /nfs/dbraw/zinc/64/14/72/1027641472.db2.gz RDMICMYBXMOLNU-CYBMUJFWSA-N 1 1 338.367 3.804 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C(C)C)CC1 ZINC000533418056 1027836229 /nfs/dbraw/zinc/83/62/29/1027836229.db2.gz POWDWVBPAHFRIX-HNNXBMFYSA-N 1 1 333.432 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCc3[nH]c4ccccc4c3C2)cc1 ZINC000533513099 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IJAYVHUUSSWTMB-IBGZPJMESA-N 1 1 342.395 3.776 20 5 EHBDMO C[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000525781333 1030115887 /nfs/dbraw/zinc/11/58/87/1030115887.db2.gz CTXZGDOUOZLXMW-QGZVFWFLSA-N 1 1 339.439 3.691 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2cnc(C3CC3)o2)c2cc([N+](=O)[O-])ccc21 ZINC000453363158 1030177962 /nfs/dbraw/zinc/17/79/62/1030177962.db2.gz QMDADLTYUDSIIN-INIZCTEOSA-N 1 1 327.384 3.972 20 5 EHBDMO CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453439728 1030256418 /nfs/dbraw/zinc/25/64/18/1030256418.db2.gz MILYNYARJRFALQ-YQVWRLOYSA-N 1 1 342.443 3.832 20 5 EHBDMO COc1cc(C[NH+]2[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000525996557 1030291219 /nfs/dbraw/zinc/29/12/19/1030291219.db2.gz CXGIVQKTJJOELU-UWVGGRQHSA-N 1 1 348.321 3.527 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293462 1030527938 /nfs/dbraw/zinc/52/79/38/1030527938.db2.gz YJTYSAOZKAVYHG-LJQANCHMSA-N 1 1 326.396 3.767 20 5 EHBDMO 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1 1 342.395 3.779 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081589 1033696237 /nfs/dbraw/zinc/69/62/37/1033696237.db2.gz SMNLMMRBTQRECB-GJZGRUSLSA-N 1 1 347.459 3.661 20 5 EHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558829 1033706442 /nfs/dbraw/zinc/70/64/42/1033706442.db2.gz WXADVBLEUHXCPB-MRXNPFEDSA-N 1 1 340.358 3.863 20 5 EHBDMO COc1cc(C)c(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290247 1033718473 /nfs/dbraw/zinc/71/84/73/1033718473.db2.gz XNJDVYWLZXJJDQ-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290247 1033718489 /nfs/dbraw/zinc/71/84/89/1033718489.db2.gz XNJDVYWLZXJJDQ-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCOC1 ZINC000593674018 1033723641 /nfs/dbraw/zinc/72/36/41/1033723641.db2.gz LQUROVRTTIBCGD-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCOC1 ZINC000593674018 1033723656 /nfs/dbraw/zinc/72/36/56/1033723656.db2.gz LQUROVRTTIBCGD-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595331246 1033732028 /nfs/dbraw/zinc/73/20/28/1033732028.db2.gz SWUNBSREQFIVFR-HNNXBMFYSA-N 1 1 335.379 3.729 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599098556 1033732875 /nfs/dbraw/zinc/73/28/75/1033732875.db2.gz LTVIQWIUMRDFHY-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000595351752 1033776639 /nfs/dbraw/zinc/77/66/39/1033776639.db2.gz NRIJTCDZSHPPRJ-MRXNPFEDSA-N 1 1 329.400 3.879 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000595467664 1033821277 /nfs/dbraw/zinc/82/12/77/1033821277.db2.gz SPTZADJTEBLXAR-JZXOWHBKSA-N 1 1 336.407 3.640 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@]2(C)Cc2cccc(F)c2)c1[N+](=O)[O-] ZINC000595564067 1033844760 /nfs/dbraw/zinc/84/47/60/1033844760.db2.gz WETIFXKNCLFLEQ-KRWDZBQOSA-N 1 1 333.363 3.628 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3ccccc3C)CC2)c(C)c1[N+](=O)[O-] ZINC000170951668 1033869867 /nfs/dbraw/zinc/86/98/67/1033869867.db2.gz GPVAPRDQFHIRRL-UHFFFAOYSA-N 1 1 328.416 3.554 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000603871494 1033996330 /nfs/dbraw/zinc/99/63/30/1033996330.db2.gz NMITVNNAQRUFMT-UHFFFAOYSA-N 1 1 325.840 3.805 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787961 1033998735 /nfs/dbraw/zinc/99/87/35/1033998735.db2.gz LAZXWPQISLFDEP-FUHWJXTLSA-N 1 1 348.443 3.775 20 5 EHBDMO O=[N+]([O-])c1cc(NC[C@H]2CC[N@H+](C3CC3)C2)ccc1C(F)(F)F ZINC000596079347 1034071257 /nfs/dbraw/zinc/07/12/57/1034071257.db2.gz OUZAZLXXZAJNAL-SNVBAGLBSA-N 1 1 329.322 3.510 20 5 EHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093695 1034079591 /nfs/dbraw/zinc/07/95/91/1034079591.db2.gz DPIRGJCUGCTNFT-WBVHZDCISA-N 1 1 331.460 3.676 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677016 1034084768 /nfs/dbraw/zinc/08/47/68/1034084768.db2.gz GEZXEZSPZOTISK-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO O=[N+]([O-])c1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)ccc1C(F)(F)F ZINC000596109281 1034097434 /nfs/dbraw/zinc/09/74/34/1034097434.db2.gz UZRZZCIQECTQKX-SNVBAGLBSA-N 1 1 340.305 3.721 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)CC2 ZINC000596183679 1034101530 /nfs/dbraw/zinc/10/15/30/1034101530.db2.gz YUECJWROVSZGCB-UHFFFAOYSA-N 1 1 343.349 3.678 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000596244810 1034134043 /nfs/dbraw/zinc/13/40/43/1034134043.db2.gz UNSZKSFSQIUMPK-HNNXBMFYSA-N 1 1 343.349 3.536 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000596308862 1034165419 /nfs/dbraw/zinc/16/54/19/1034165419.db2.gz XCMITZQLDDEYHO-CYBMUJFWSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000604427981 1034375556 /nfs/dbraw/zinc/37/55/56/1034375556.db2.gz MVWJWWGIEUPJTK-QGZVFWFLSA-N 1 1 342.395 3.645 20 5 EHBDMO CC(C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(F)cc1 ZINC000171440500 1034397338 /nfs/dbraw/zinc/39/73/38/1034397338.db2.gz ZIDQYXQFCYNBMY-UHFFFAOYSA-N 1 1 346.358 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c(Cl)c1 ZINC000612402214 1034892976 /nfs/dbraw/zinc/89/29/76/1034892976.db2.gz VNGCYPZIWRSNMD-AWEZNQCLSA-N 1 1 331.803 3.708 20 5 EHBDMO CCOc1cc(Cn2c[nH+]c3c2C[C@H](C)[C@@H](C)C3)ccc1[N+](=O)[O-] ZINC000450997160 1035007833 /nfs/dbraw/zinc/00/78/33/1035007833.db2.gz HZGSGKQWHQYXGR-STQMWFEESA-N 1 1 329.400 3.609 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC12CCCCC2 ZINC000534728785 1035527587 /nfs/dbraw/zinc/52/75/87/1035527587.db2.gz OTTFKJIQWDDEBB-UHFFFAOYSA-N 1 1 331.416 3.640 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc(C4CC4)no3)C2)cc1 ZINC000595527663 1035923494 /nfs/dbraw/zinc/92/34/94/1035923494.db2.gz WOQMFCSVBDBRIG-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000463951743 1035993456 /nfs/dbraw/zinc/99/34/56/1035993456.db2.gz BVQRSDNXQODSDR-GJZGRUSLSA-N 1 1 348.447 3.596 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000492652214 1036112190 /nfs/dbraw/zinc/11/21/90/1036112190.db2.gz LBSGHDGRYFHYIQ-AWEZNQCLSA-N 1 1 344.411 3.762 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCOc2ccccc21 ZINC000589185020 1036297272 /nfs/dbraw/zinc/29/72/72/1036297272.db2.gz MMLZJDFXJCFUHO-INIZCTEOSA-N 1 1 326.396 3.635 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589209664 1036313298 /nfs/dbraw/zinc/31/32/98/1036313298.db2.gz QFBIVFKFHBHRAE-MRXNPFEDSA-N 1 1 340.427 3.617 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742948 1036601041 /nfs/dbraw/zinc/60/10/41/1036601041.db2.gz KHVSPHNMVGDLFF-OEAJRASXSA-N 1 1 338.473 3.808 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCCC[C@H]2CCO)c1 ZINC000590180601 1036788369 /nfs/dbraw/zinc/78/83/69/1036788369.db2.gz LDQPXJAIFDMYAI-ZDUSSCGKSA-N 1 1 346.349 3.741 20 5 EHBDMO C[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000180469528 1036871988 /nfs/dbraw/zinc/87/19/88/1036871988.db2.gz MWVWBTBHKHNSBR-YWZLYKJASA-N 1 1 339.439 3.757 20 5 EHBDMO C[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N(C)C1CC1 ZINC000180469528 1036872008 /nfs/dbraw/zinc/87/20/08/1036872008.db2.gz MWVWBTBHKHNSBR-YWZLYKJASA-N 1 1 339.439 3.757 20 5 EHBDMO C[N@@H+](CCOc1ccccc1F)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761504962 1037087726 /nfs/dbraw/zinc/08/77/26/1037087726.db2.gz BIALGYUOWLMQIE-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[C@@H](NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135627 1037088823 /nfs/dbraw/zinc/08/88/23/1037088823.db2.gz AJQSHDVZEQQYCE-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@@H](NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272135627 1037088838 /nfs/dbraw/zinc/08/88/38/1037088838.db2.gz AJQSHDVZEQQYCE-APWZRJJASA-N 1 1 339.439 3.595 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493250056 1037197337 /nfs/dbraw/zinc/19/73/37/1037197337.db2.gz CSYSSPXVCHKLGQ-MRXNPFEDSA-N 1 1 348.834 3.936 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493250056 1037197345 /nfs/dbraw/zinc/19/73/45/1037197345.db2.gz CSYSSPXVCHKLGQ-MRXNPFEDSA-N 1 1 348.834 3.936 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2OC)cc1[N+](=O)[O-] ZINC000188779335 1037245207 /nfs/dbraw/zinc/24/52/07/1037245207.db2.gz DIRKXTDRARJQON-QWHCGFSZSA-N 1 1 345.399 3.809 20 5 EHBDMO CC(C)N(C)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000191611063 1037281590 /nfs/dbraw/zinc/28/15/90/1037281590.db2.gz GFHCNMJMEJKGEL-UHFFFAOYSA-N 1 1 348.834 3.778 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCC[NH2+]CC2)s1 ZINC000591278508 1037316896 /nfs/dbraw/zinc/31/68/96/1037316896.db2.gz JJOFXAZZKLBCDT-ZDUSSCGKSA-N 1 1 331.441 3.555 20 5 EHBDMO CN(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076109669 1037325625 /nfs/dbraw/zinc/32/56/25/1037325625.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 1 1 339.439 3.549 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@H]2CC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601349 1037487327 /nfs/dbraw/zinc/48/73/27/1037487327.db2.gz BOXHHPOAESDGLA-ZBFHGGJFSA-N 1 1 336.432 3.631 20 5 EHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573407123 1037507632 /nfs/dbraw/zinc/50/76/32/1037507632.db2.gz FDNITPYINLYIAO-SFHVURJKSA-N 1 1 328.412 3.676 20 5 EHBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790590 1037534105 /nfs/dbraw/zinc/53/41/05/1037534105.db2.gz PFZNVOGXPLJXBL-QWQRMKEZSA-N 1 1 344.411 3.836 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCOC4(CCC4)C3)o2)c1 ZINC000130516188 1037781119 /nfs/dbraw/zinc/78/11/19/1037781119.db2.gz YHVXLNHJWVHGGW-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOC4(CCC4)C3)o2)c1 ZINC000130516188 1037781134 /nfs/dbraw/zinc/78/11/34/1037781134.db2.gz YHVXLNHJWVHGGW-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO CC(C)(C)OC(=O)C1(C)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000592158244 1037899482 /nfs/dbraw/zinc/89/94/82/1037899482.db2.gz ZVTQFZNCFGKQJG-UHFFFAOYSA-N 1 1 334.416 3.539 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664980 1038499863 /nfs/dbraw/zinc/49/98/63/1038499863.db2.gz ZNQXUGZVSLMRKT-AAEUAGOBSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664980 1038499867 /nfs/dbraw/zinc/49/98/67/1038499867.db2.gz ZNQXUGZVSLMRKT-AAEUAGOBSA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000538751731 1038515517 /nfs/dbraw/zinc/51/55/17/1038515517.db2.gz KKLZMCYQVAEUES-GOSISDBHSA-N 1 1 325.412 3.980 20 5 EHBDMO Cc1cc(N2CC[N@@H+](C)C[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461730029 1038590453 /nfs/dbraw/zinc/59/04/53/1038590453.db2.gz JRYHDNXUQMOLHJ-SFHVURJKSA-N 1 1 329.375 3.535 20 5 EHBDMO Cc1cc(N2CC[N@H+](C)C[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461730029 1038590459 /nfs/dbraw/zinc/59/04/59/1038590459.db2.gz JRYHDNXUQMOLHJ-SFHVURJKSA-N 1 1 329.375 3.535 20 5 EHBDMO Cc1cc(N[C@@H]2CCn3cc[nH+]c3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461932015 1038681515 /nfs/dbraw/zinc/68/15/15/1038681515.db2.gz APEUBZJHUONCMI-SNVBAGLBSA-N 1 1 340.305 3.545 20 5 EHBDMO COc1cc(C[N@@H+]2CCSC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507307 1039175804 /nfs/dbraw/zinc/17/58/04/1039175804.db2.gz VMYOVDMQUYROFQ-KRWDZBQOSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1cc(C[N@H+]2CCSC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507307 1039175812 /nfs/dbraw/zinc/17/58/12/1039175812.db2.gz VMYOVDMQUYROFQ-KRWDZBQOSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485763341 1039537033 /nfs/dbraw/zinc/53/70/33/1039537033.db2.gz BRNDNGKXKZWRDI-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO CC(C)[C@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000489388681 1039903835 /nfs/dbraw/zinc/90/38/35/1039903835.db2.gz JCBCIDDUTLDZEE-HXUWFJFHSA-N 1 1 347.462 3.800 20 5 EHBDMO CCOc1ccc(NC(=O)C[N@@H+](C)C2CCCCCC2)c([N+](=O)[O-])c1 ZINC000029166230 1040196564 /nfs/dbraw/zinc/19/65/64/1040196564.db2.gz PRCIYTYMWNLPAB-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO Cc1cc(N[C@@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555192531 1040266721 /nfs/dbraw/zinc/26/67/21/1040266721.db2.gz IYJNTJSFCZVRIF-SNVBAGLBSA-N 1 1 340.305 3.545 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]2C2CCC2)c1 ZINC000512622028 1040293408 /nfs/dbraw/zinc/29/34/08/1040293408.db2.gz HPWZCJADNDPVJS-AWEZNQCLSA-N 1 1 326.343 3.961 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490038972 1040301911 /nfs/dbraw/zinc/30/19/11/1040301911.db2.gz BFDBVCYSMOIBGQ-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000490092143 1040354913 /nfs/dbraw/zinc/35/49/13/1040354913.db2.gz YVCISCVTMHAOBR-BMGDILEWSA-N 1 1 348.443 3.629 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000486797687 1040457484 /nfs/dbraw/zinc/45/74/84/1040457484.db2.gz WWUIPFPYCIROOC-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO C[NH+](C)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000418119135 1040613815 /nfs/dbraw/zinc/61/38/15/1040613815.db2.gz XGQKUZUNGFDHRS-UHFFFAOYSA-N 1 1 349.818 3.692 20 5 EHBDMO CC(C)[N@H+](C)C[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000566649903 1041019398 /nfs/dbraw/zinc/01/93/98/1041019398.db2.gz PJZGTUDYWIXYAY-AWEZNQCLSA-N 1 1 331.416 3.673 20 5 EHBDMO CC(C)N(C)C[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000566649903 1041019414 /nfs/dbraw/zinc/01/94/14/1041019414.db2.gz PJZGTUDYWIXYAY-AWEZNQCLSA-N 1 1 331.416 3.673 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1[N+](=O)[O-] ZINC000433194882 1041041747 /nfs/dbraw/zinc/04/17/47/1041041747.db2.gz ZQORXXUTINHNRW-UHFFFAOYSA-N 1 1 342.729 3.825 20 5 EHBDMO CCc1ccc([C@H]2CCCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871431 1041204311 /nfs/dbraw/zinc/20/43/11/1041204311.db2.gz BEAXNIJYHRQLGZ-MRXNPFEDSA-N 1 1 332.404 3.564 20 5 EHBDMO CC(C)[C@@H](CO)[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000112657828 1042416620 /nfs/dbraw/zinc/41/66/20/1042416620.db2.gz KOKVQFXXWPPEQB-LJQANCHMSA-N 1 1 346.402 3.753 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000112657828 1042416623 /nfs/dbraw/zinc/41/66/23/1042416623.db2.gz KOKVQFXXWPPEQB-LJQANCHMSA-N 1 1 346.402 3.753 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278867102 1042762694 /nfs/dbraw/zinc/76/26/94/1042762694.db2.gz NISPVJKJLUOKHV-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1F ZINC000291235467 1042789305 /nfs/dbraw/zinc/78/93/05/1042789305.db2.gz UMBLVXLIQURAOC-YXJHDRRASA-N 1 1 336.407 3.640 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000432339477 1042972749 /nfs/dbraw/zinc/97/27/49/1042972749.db2.gz ITYXSOHXACWZBI-SWLSCSKDSA-N 1 1 335.835 3.701 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)nc1-c1ccccc1 ZINC000090090083 1043380719 /nfs/dbraw/zinc/38/07/19/1043380719.db2.gz DUUVGTTULUEXPY-HNNXBMFYSA-N 1 1 349.394 3.764 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898520 1043599600 /nfs/dbraw/zinc/59/96/00/1043599600.db2.gz YMKUBPLKMLTKQD-RDTXWAMCSA-N 1 1 328.416 3.926 20 5 EHBDMO COc1cccc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000185729243 1126994503 /nfs/dbraw/zinc/99/45/03/1126994503.db2.gz CBLGLXIFMSQYDV-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946919 1127558399 /nfs/dbraw/zinc/55/83/99/1127558399.db2.gz YVCKSHGHAKJKHG-INIZCTEOSA-N 1 1 336.395 3.700 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253073329 1120116428 /nfs/dbraw/zinc/11/64/28/1120116428.db2.gz OTENNZRWTPXREB-GHMZBOCLSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253073329 1120116431 /nfs/dbraw/zinc/11/64/31/1120116431.db2.gz OTENNZRWTPXREB-GHMZBOCLSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000554945287 1128917867 /nfs/dbraw/zinc/91/78/67/1128917867.db2.gz GQADKLUSSFVRDP-WBVHZDCISA-N 1 1 337.423 3.793 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2CCCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479641 1120511524 /nfs/dbraw/zinc/51/15/24/1120511524.db2.gz VFNXGYFIOWOILK-MJGOQNOKSA-N 1 1 344.411 3.998 20 5 EHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(O)c1 ZINC000494544615 1120590523 /nfs/dbraw/zinc/59/05/23/1120590523.db2.gz DUFOVEJCQGEDCZ-CQSZACIVSA-N 1 1 330.384 3.762 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@@H]12 ZINC000915210190 1121254485 /nfs/dbraw/zinc/25/44/85/1121254485.db2.gz WUHGRNYEGJIRFI-SKDZVZGDSA-N 1 1 328.416 3.803 20 5 EHBDMO Cc1cnc(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039582 1128977558 /nfs/dbraw/zinc/97/75/58/1128977558.db2.gz DWZQUFWAEDXCEL-RDJZCZTQSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000301075498 1121358571 /nfs/dbraw/zinc/35/85/71/1121358571.db2.gz FCUUQZBLNYAFTN-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000193589829 1121475421 /nfs/dbraw/zinc/47/54/21/1121475421.db2.gz ZPMBECGNYFALLW-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO C[C@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380203 1121598249 /nfs/dbraw/zinc/59/82/49/1121598249.db2.gz BRNLJXUGSOIIOA-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000113314280 1129000368 /nfs/dbraw/zinc/00/03/68/1129000368.db2.gz GROSOXKJSOGTPJ-LBPRGKRZSA-N 1 1 340.408 3.964 20 5 EHBDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000193855370 1121721933 /nfs/dbraw/zinc/72/19/33/1121721933.db2.gz CABIXIMAWBLGAY-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C(C)C)C1CCOCC1 ZINC000077323819 1129012503 /nfs/dbraw/zinc/01/25/03/1129012503.db2.gz DLCCZHFRPWHUND-UHFFFAOYSA-N 1 1 336.432 3.771 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151749 1122081301 /nfs/dbraw/zinc/08/13/01/1122081301.db2.gz KHXGGXPAFCGQDC-KGLIPLIRSA-N 1 1 339.395 3.541 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1Cc2ccccc2[C@H](C)C1 ZINC000916151749 1122081308 /nfs/dbraw/zinc/08/13/08/1122081308.db2.gz KHXGGXPAFCGQDC-KGLIPLIRSA-N 1 1 339.395 3.541 20 5 EHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176370 1122356884 /nfs/dbraw/zinc/35/68/84/1122356884.db2.gz AJDHYCUBDAYEHU-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176370 1122356892 /nfs/dbraw/zinc/35/68/92/1122356892.db2.gz AJDHYCUBDAYEHU-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO C[N@H+](CCCOc1ccc(F)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917046844 1122445072 /nfs/dbraw/zinc/44/50/72/1122445072.db2.gz UBOJRCYJCXUGRV-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917046844 1122445079 /nfs/dbraw/zinc/44/50/79/1122445079.db2.gz UBOJRCYJCXUGRV-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOCC2(CCCC2)C1 ZINC000615838775 1123884671 /nfs/dbraw/zinc/88/46/71/1123884671.db2.gz CHYYPNGXYRDDJB-WJDWOHSUSA-N 1 1 330.428 3.891 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(C4CCCC4)CC3)nc2c1 ZINC000618283300 1125036415 /nfs/dbraw/zinc/03/64/15/1125036415.db2.gz JMWJJHHFHXHNBF-UHFFFAOYSA-N 1 1 328.416 3.873 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000619531966 1125358560 /nfs/dbraw/zinc/35/85/60/1125358560.db2.gz KFFPWHWIKBQUAP-JQWIXIFHSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C(F)(F)F)CC[C@@H]1C ZINC000619531966 1125358562 /nfs/dbraw/zinc/35/85/62/1125358562.db2.gz KFFPWHWIKBQUAP-JQWIXIFHSA-N 1 1 332.322 3.766 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCc3ccc(O)cc3CC2)c1 ZINC000735490446 1131352433 /nfs/dbraw/zinc/35/24/33/1131352433.db2.gz LAPBNLZHEGEWAM-UHFFFAOYSA-N 1 1 332.787 3.555 20 5 EHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@H+]1C1CC1 ZINC000301846027 1129189861 /nfs/dbraw/zinc/18/98/61/1129189861.db2.gz ALBPLEWMCWDQED-ZFWWWQNUSA-N 1 1 338.411 3.694 20 5 EHBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845875 1129193567 /nfs/dbraw/zinc/19/35/67/1129193567.db2.gz TXXGTEDYCCIEBF-PKOBYXMFSA-N 1 1 339.395 3.655 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891196 1129283183 /nfs/dbraw/zinc/28/31/83/1129283183.db2.gz UNHCMNHRBYCPRR-RHSMWYFYSA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894153 1129288266 /nfs/dbraw/zinc/28/82/66/1129288266.db2.gz WWEOAMCRNSXCSQ-RHSMWYFYSA-N 1 1 346.818 3.809 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000068448957 1129371852 /nfs/dbraw/zinc/37/18/52/1129371852.db2.gz AKALMZUXNROEEQ-UHFFFAOYSA-N 1 1 339.823 3.840 20 5 EHBDMO Cc1nc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000716229533 1131371779 /nfs/dbraw/zinc/37/17/79/1131371779.db2.gz NMPVILUDZPTSDS-RHSMWYFYSA-N 1 1 340.427 3.621 20 5 EHBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092073641 1129532134 /nfs/dbraw/zinc/53/21/34/1129532134.db2.gz SBJSPKZBTVGACV-YXMGTMDOSA-N 1 1 346.427 3.663 20 5 EHBDMO CCCn1nc(C)c(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154276314 1129545630 /nfs/dbraw/zinc/54/56/30/1129545630.db2.gz FDEAMDQKHPDDRI-UHFFFAOYSA-N 1 1 342.443 3.983 20 5 EHBDMO CCCn1nc(C)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154276314 1129545633 /nfs/dbraw/zinc/54/56/33/1129545633.db2.gz FDEAMDQKHPDDRI-UHFFFAOYSA-N 1 1 342.443 3.983 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](n3cccn3)C2)cc1[N+](=O)[O-] ZINC000092967773 1129570392 /nfs/dbraw/zinc/57/03/92/1129570392.db2.gz MDLDLWNTKWRMAA-MRXNPFEDSA-N 1 1 328.416 3.752 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000330609976 1129641614 /nfs/dbraw/zinc/64/16/14/1129641614.db2.gz MUSTUFZWXDJIDU-QGZVFWFLSA-N 1 1 332.444 3.967 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000281116672 1129703516 /nfs/dbraw/zinc/70/35/16/1129703516.db2.gz XFGUYLVWYCAWSQ-CGTJXYLNSA-N 1 1 336.407 3.640 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000302012148 1129763255 /nfs/dbraw/zinc/76/32/55/1129763255.db2.gz ZFBPAWKQQFNWOL-DLBZAZTESA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000302012148 1129763257 /nfs/dbraw/zinc/76/32/57/1129763257.db2.gz ZFBPAWKQQFNWOL-DLBZAZTESA-N 1 1 333.338 3.730 20 5 EHBDMO Cc1cccc(NCCc2[nH+]ccn2Cc2ccccc2)c1[N+](=O)[O-] ZINC000302511805 1129780784 /nfs/dbraw/zinc/78/07/84/1129780784.db2.gz SUJOMCMIDIXYJT-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO O=C(CC[N@H+]1CCC2(C1)CCCCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000303923068 1129872959 /nfs/dbraw/zinc/87/29/59/1129872959.db2.gz PDAISLUNLDMQCJ-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO Cc1ccc(C)c(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429244837 1130320400 /nfs/dbraw/zinc/32/04/00/1130320400.db2.gz ICAPONFXHHQFGA-UHFFFAOYSA-N 1 1 341.411 3.675 20 5 EHBDMO CCc1cccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429253661 1130382960 /nfs/dbraw/zinc/38/29/60/1130382960.db2.gz KUSQTDLXJCSRNT-UHFFFAOYSA-N 1 1 341.411 3.621 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCC(C)C)CC1 ZINC000175114634 1130407913 /nfs/dbraw/zinc/40/79/13/1130407913.db2.gz OZERODKGQCKPEY-UHFFFAOYSA-N 1 1 336.432 3.631 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893301 1130853994 /nfs/dbraw/zinc/85/39/94/1130853994.db2.gz OYQRGHFUBZRXCT-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893301 1130853999 /nfs/dbraw/zinc/85/39/99/1130853999.db2.gz OYQRGHFUBZRXCT-SPYBWZPUSA-N 1 1 326.396 3.945 20 5 EHBDMO CC[NH+](CC)[C@H](C(=O)OCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000732350400 1130914334 /nfs/dbraw/zinc/91/43/34/1130914334.db2.gz TWHGVACDAVVVQM-INIZCTEOSA-N 1 1 348.424 3.783 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000742423497 1131724097 /nfs/dbraw/zinc/72/40/97/1131724097.db2.gz VGTFBWHSXCFCHW-MRXNPFEDSA-N 1 1 345.830 3.959 20 5 EHBDMO C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000742431374 1131729792 /nfs/dbraw/zinc/72/97/92/1131729792.db2.gz XXSLUIYRFCBGOJ-OAHLLOKOSA-N 1 1 343.402 3.835 20 5 EHBDMO COc1cccc2c1C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172921011 1131905428 /nfs/dbraw/zinc/90/54/28/1131905428.db2.gz NXVUQSHNRNJYDO-KRWDZBQOSA-N 1 1 338.407 3.867 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](CCO)c1ccccc1 ZINC000743857062 1131987711 /nfs/dbraw/zinc/98/77/11/1131987711.db2.gz SRVLHGDRJUEVPX-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](CCO)c1ccccc1 ZINC000743857062 1131987718 /nfs/dbraw/zinc/98/77/18/1131987718.db2.gz SRVLHGDRJUEVPX-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H]3CCC[C@@H]32)c1F ZINC001173196491 1131997023 /nfs/dbraw/zinc/99/70/23/1131997023.db2.gz NAAHBAXLNOBTRT-GUTXKFCHSA-N 1 1 336.407 3.938 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCN(C)C)c1ccccc1 ZINC001173215706 1132001971 /nfs/dbraw/zinc/00/19/71/1132001971.db2.gz YTWWSUCQZZNNCU-OXQOHEQNSA-N 1 1 341.455 3.808 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223485 1132005741 /nfs/dbraw/zinc/00/57/41/1132005741.db2.gz ANFJYUGABFRLNS-OXQOHEQNSA-N 1 1 339.439 3.515 20 5 EHBDMO COc1cccc2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173223963 1132005900 /nfs/dbraw/zinc/00/59/00/1132005900.db2.gz CJRGJRLXVZNVCP-CQSZACIVSA-N 1 1 326.396 3.593 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001173231065 1132009432 /nfs/dbraw/zinc/00/94/32/1132009432.db2.gz JGKGABKPWVFJSP-HNAYVOBHSA-N 1 1 332.444 3.807 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC001173232281 1132009478 /nfs/dbraw/zinc/00/94/78/1132009478.db2.gz AGTAKDGXOQJYAH-IFXJQAMLSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCCC(=O)c1cccnc1 ZINC001173232318 1132009680 /nfs/dbraw/zinc/00/96/80/1132009680.db2.gz FCTSOBXKKIMZOG-HNNXBMFYSA-N 1 1 341.411 3.516 20 5 EHBDMO C[C@@H]([NH2+]Cc1nc(-c2ccncc2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000746046887 1132354335 /nfs/dbraw/zinc/35/43/35/1132354335.db2.gz GHZOWYHBKQGIKI-GFCCVEGCSA-N 1 1 340.408 3.964 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746070428 1132364978 /nfs/dbraw/zinc/36/49/78/1132364978.db2.gz NDWPWZAWDCUJMK-UHFFFAOYSA-N 1 1 330.413 3.528 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738244515 1132551896 /nfs/dbraw/zinc/55/18/96/1132551896.db2.gz XMVHWNBTZQYFHI-GOSISDBHSA-N 1 1 336.395 3.911 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000738244515 1132551903 /nfs/dbraw/zinc/55/19/03/1132551903.db2.gz XMVHWNBTZQYFHI-GOSISDBHSA-N 1 1 336.395 3.911 20 5 EHBDMO CC[N@@H+](Cc1cccc(Br)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035070 1132636891 /nfs/dbraw/zinc/63/68/91/1132636891.db2.gz ADLOSRCAFXEMDG-HIFRSBDPSA-N 1 1 341.249 3.716 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048731 1132641830 /nfs/dbraw/zinc/64/18/30/1132641830.db2.gz BCEVZSGTKCSIOT-ZWNOBZJWSA-N 1 1 329.227 3.797 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057647 1132646419 /nfs/dbraw/zinc/64/64/19/1132646419.db2.gz WOSRAXVKTSOMDS-IKGGRYGDSA-N 1 1 338.398 3.632 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057647 1132646423 /nfs/dbraw/zinc/64/64/23/1132646423.db2.gz WOSRAXVKTSOMDS-IKGGRYGDSA-N 1 1 338.398 3.632 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC001169667948 1132814737 /nfs/dbraw/zinc/81/47/37/1132814737.db2.gz YFFZMRHXIDAXRE-WOJBJXKFSA-N 1 1 340.423 3.989 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177294666 1133047777 /nfs/dbraw/zinc/04/77/77/1133047777.db2.gz ONJUDYXXJUPIEV-FGRIUMGMSA-N 1 1 345.487 3.956 20 5 EHBDMO COCC[N@H+](Cc1cccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768553196 1133154850 /nfs/dbraw/zinc/15/48/50/1133154850.db2.gz BHLMSQKRPZFFCK-UHFFFAOYSA-N 1 1 340.832 3.958 20 5 EHBDMO COCC[N@@H+](Cc1cccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768553196 1133154853 /nfs/dbraw/zinc/15/48/53/1133154853.db2.gz BHLMSQKRPZFFCK-UHFFFAOYSA-N 1 1 340.832 3.958 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000768543571 1133158318 /nfs/dbraw/zinc/15/83/18/1133158318.db2.gz AXWLULBJFVARCX-UHFFFAOYSA-N 1 1 341.367 3.710 20 5 EHBDMO COc1ccc2nc(C[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)sc2c1 ZINC001179385884 1133248922 /nfs/dbraw/zinc/24/89/22/1133248922.db2.gz DJXHNKATJNMMIB-UHFFFAOYSA-N 1 1 343.408 3.811 20 5 EHBDMO CO[C@@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000769445079 1133281127 /nfs/dbraw/zinc/28/11/27/1133281127.db2.gz DSFVZGATEWAHJQ-MRXNPFEDSA-N 1 1 346.358 3.747 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000769445079 1133281131 /nfs/dbraw/zinc/28/11/31/1133281131.db2.gz DSFVZGATEWAHJQ-MRXNPFEDSA-N 1 1 346.358 3.747 20 5 EHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483383 1133288679 /nfs/dbraw/zinc/28/86/79/1133288679.db2.gz MNSYVIMCBYMZKI-IEJURRBGSA-N 1 1 340.423 3.972 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C/C=C\c2cccc(F)c2)CC1 ZINC001180497200 1133385453 /nfs/dbraw/zinc/38/54/53/1133385453.db2.gz DUUVOHDZFBBWBG-XQRVVYSFSA-N 1 1 341.386 3.569 20 5 EHBDMO CC[C@H](CSC)[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774640339 1133815100 /nfs/dbraw/zinc/81/51/00/1133815100.db2.gz RDBITTDCCDSFMF-LLVKDONJSA-N 1 1 342.852 3.629 20 5 EHBDMO C[C@@H]([NH2+]Cc1sc(N(C)C)nc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC001183779856 1133851943 /nfs/dbraw/zinc/85/19/43/1133851943.db2.gz RNLHTBBAWXLCEK-SECBINFHSA-N 1 1 340.836 3.622 20 5 EHBDMO COCC[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746651583 1133969410 /nfs/dbraw/zinc/96/94/10/1133969410.db2.gz BWNNWXAQRAGAEQ-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO COCC[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746651583 1133969413 /nfs/dbraw/zinc/96/94/13/1133969413.db2.gz BWNNWXAQRAGAEQ-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000746665464 1133981551 /nfs/dbraw/zinc/98/15/51/1133981551.db2.gz BHHMOAVZYJOYMX-SFHVURJKSA-N 1 1 346.814 3.994 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000746665464 1133981555 /nfs/dbraw/zinc/98/15/55/1133981555.db2.gz BHHMOAVZYJOYMX-SFHVURJKSA-N 1 1 346.814 3.994 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@H+]1CCCC[C@@H]1C ZINC001184856820 1133998928 /nfs/dbraw/zinc/99/89/28/1133998928.db2.gz MTYGYMMSRLNJFS-KBPBESRZSA-N 1 1 328.416 3.818 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3cc(C)ccc3C2)c([N+](=O)[O-])c1 ZINC001170354166 1134754400 /nfs/dbraw/zinc/75/44/00/1134754400.db2.gz HVZXSTBDMZJNNF-HNNXBMFYSA-N 1 1 340.423 3.901 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345844 1134759542 /nfs/dbraw/zinc/75/95/42/1134759542.db2.gz MXANIWHQPWSNIJ-RDTXWAMCSA-N 1 1 341.411 3.767 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792913112 1134823813 /nfs/dbraw/zinc/82/38/13/1134823813.db2.gz LXXBCWHCFXSCGY-KGLIPLIRSA-N 1 1 345.226 3.619 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199958 1134978905 /nfs/dbraw/zinc/97/89/05/1134978905.db2.gz PXVCSAZDSWHBLK-HZPDHXFCSA-N 1 1 347.459 3.988 20 5 EHBDMO C[N@@H+](CCN(Cc1ccccc1[N+](=O)[O-])C1CC1)Cc1ccccc1 ZINC001192391328 1135013365 /nfs/dbraw/zinc/01/33/65/1135013365.db2.gz RTCYHTOHBAJZOW-UHFFFAOYSA-N 1 1 339.439 3.691 20 5 EHBDMO Cc1cc[nH+]c(N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)c1 ZINC000804703423 1135179671 /nfs/dbraw/zinc/17/96/71/1135179671.db2.gz JPWOQHNHMRZDJX-UHFFFAOYSA-N 1 1 348.200 3.623 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC001193954721 1135206001 /nfs/dbraw/zinc/20/60/01/1135206001.db2.gz LDUBLLPGWHSNBP-ZHALLVOQSA-N 1 1 332.444 3.809 20 5 EHBDMO CCCC1CCC([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001194052307 1135222316 /nfs/dbraw/zinc/22/23/16/1135222316.db2.gz SMFVZMKGSIXJJO-UHFFFAOYSA-N 1 1 347.459 3.848 20 5 EHBDMO CCC1CCC([N@H+](CCO)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001194066900 1135224355 /nfs/dbraw/zinc/22/43/55/1135224355.db2.gz RQRYFQCUCHIAOU-UHFFFAOYSA-N 1 1 342.386 3.636 20 5 EHBDMO CCC1CCC([N@@H+](CCO)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001194066900 1135224359 /nfs/dbraw/zinc/22/43/59/1135224359.db2.gz RQRYFQCUCHIAOU-UHFFFAOYSA-N 1 1 342.386 3.636 20 5 EHBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001130524212 1135396884 /nfs/dbraw/zinc/39/68/84/1135396884.db2.gz ZADQZPASAKSUMD-UHFFFAOYSA-N 1 1 349.456 3.517 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C2CCCC2)C1 ZINC001195305310 1135409623 /nfs/dbraw/zinc/40/96/23/1135409623.db2.gz BOJPSZNUJBIURB-INIZCTEOSA-N 1 1 345.443 3.744 20 5 EHBDMO CC[C@@H]1C[C@H]1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC001195546584 1135438448 /nfs/dbraw/zinc/43/84/48/1135438448.db2.gz GZZTVRUFUNSORS-BZZMCLGOSA-N 1 1 332.444 3.746 20 5 EHBDMO CCOc1ccc(CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001198523890 1135827159 /nfs/dbraw/zinc/82/71/59/1135827159.db2.gz ACOSOKRDGYISAF-UHFFFAOYSA-N 1 1 328.412 3.976 20 5 EHBDMO CCc1cc(CCC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)on1 ZINC000809577591 1135853761 /nfs/dbraw/zinc/85/37/61/1135853761.db2.gz WAEOTHJGTPSZSL-UHFFFAOYSA-N 1 1 337.807 3.863 20 5 EHBDMO CCc1cc(CCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)on1 ZINC000809577591 1135853764 /nfs/dbraw/zinc/85/37/64/1135853764.db2.gz WAEOTHJGTPSZSL-UHFFFAOYSA-N 1 1 337.807 3.863 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCOCC1 ZINC000809969002 1135904688 /nfs/dbraw/zinc/90/46/88/1135904688.db2.gz LHLLHYSRDHXAQJ-UHFFFAOYSA-N 1 1 333.215 3.760 20 5 EHBDMO C[C@H](Cc1[nH]cc[nH+]1)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809960564 1135907011 /nfs/dbraw/zinc/90/70/11/1135907011.db2.gz QJMDYCUWOAJQBF-MRVPVSSYSA-N 1 1 330.171 3.773 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)s1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273948 1136128324 /nfs/dbraw/zinc/12/83/24/1136128324.db2.gz FNCPWWMGZXSYGZ-CQSZACIVSA-N 1 1 340.832 3.865 20 5 EHBDMO CC[C@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275031 1136129042 /nfs/dbraw/zinc/12/90/42/1136129042.db2.gz FOMIBXORJSPDOV-JKSUJKDBSA-N 1 1 332.425 3.699 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276943 1136130620 /nfs/dbraw/zinc/13/06/20/1136130620.db2.gz LXKCYTDSODXMBI-QZTJIDSGSA-N 1 1 330.359 3.604 20 5 EHBDMO COCc1csc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000850183121 1136218153 /nfs/dbraw/zinc/21/81/53/1136218153.db2.gz CSZWSOYQUZMBMU-UHFFFAOYSA-N 1 1 326.805 3.746 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847473 1136259444 /nfs/dbraw/zinc/25/94/44/1136259444.db2.gz DDMSFPDZTCEGED-IFXJQAMLSA-N 1 1 344.411 3.547 20 5 EHBDMO C[C@@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1ccccc1[N+](=O)[O-] ZINC000813876799 1136371026 /nfs/dbraw/zinc/37/10/26/1136371026.db2.gz YMQPECYPELYEEI-FUEDEBDSSA-N 1 1 348.424 3.580 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580589 1136444574 /nfs/dbraw/zinc/44/45/74/1136444574.db2.gz WQHYSQOCZCSCFH-SFHVURJKSA-N 1 1 332.375 3.678 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@](C)(O)c1ccccc1 ZINC000822516264 1137064108 /nfs/dbraw/zinc/06/41/08/1137064108.db2.gz JNBNMGQVXPBUIW-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1Cl ZINC000862540661 1137149213 /nfs/dbraw/zinc/14/92/13/1137149213.db2.gz IYIQTBSQHDEAIX-AWEZNQCLSA-N 1 1 332.787 3.943 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC(C)(C)C1 ZINC001171099486 1137196145 /nfs/dbraw/zinc/19/61/45/1137196145.db2.gz VWUQDIFXVSGSIZ-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc[nH+]c(N2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)CC2)c1 ZINC000865621477 1137299344 /nfs/dbraw/zinc/29/93/44/1137299344.db2.gz QQNJGSMMNKNOHQ-UHFFFAOYSA-N 1 1 348.353 3.562 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)c1 ZINC000846972734 1137377777 /nfs/dbraw/zinc/37/77/77/1137377777.db2.gz YJESTWKNCXGEEW-AWEZNQCLSA-N 1 1 331.803 3.941 20 5 EHBDMO CC[C@@H](CSC)[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000773255592 1137481725 /nfs/dbraw/zinc/48/17/25/1137481725.db2.gz MFLRNMCSSBWAEL-JTQLQIEISA-N 1 1 341.458 3.903 20 5 EHBDMO CC[C@@H](CSC)[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000773255592 1137481726 /nfs/dbraw/zinc/48/17/26/1137481726.db2.gz MFLRNMCSSBWAEL-JTQLQIEISA-N 1 1 341.458 3.903 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000874048328 1137609911 /nfs/dbraw/zinc/60/99/11/1137609911.db2.gz PNEKLSQOVXHYKC-OAHLLOKOSA-N 1 1 347.459 3.596 20 5 EHBDMO C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@H](C(F)(F)F)O1 ZINC000877825437 1137692346 /nfs/dbraw/zinc/69/23/46/1137692346.db2.gz ZYSXONRLJIAMFX-YABQJVKDSA-N 1 1 344.333 3.650 20 5 EHBDMO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@H](C(F)(F)F)O1 ZINC000877825437 1137692347 /nfs/dbraw/zinc/69/23/47/1137692347.db2.gz ZYSXONRLJIAMFX-YABQJVKDSA-N 1 1 344.333 3.650 20 5 EHBDMO CC(C)(O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000877835566 1137692937 /nfs/dbraw/zinc/69/29/37/1137692937.db2.gz UALYJWKLMSSAPP-AWEZNQCLSA-N 1 1 346.452 3.916 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497112 1137717959 /nfs/dbraw/zinc/71/79/59/1137717959.db2.gz QTVGNSHLRMFMIN-JHJVBQTASA-N 1 1 330.388 3.511 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901880 1137925175 /nfs/dbraw/zinc/92/51/75/1137925175.db2.gz JRXSICFUKJONQJ-AMTGTPFRSA-N 1 1 332.444 3.917 20 5 EHBDMO CCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC000885969647 1138029371 /nfs/dbraw/zinc/02/93/71/1138029371.db2.gz YYMXCEVGHXYGFR-AWEZNQCLSA-N 1 1 329.400 3.972 20 5 EHBDMO CCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC000885969647 1138029373 /nfs/dbraw/zinc/02/93/73/1138029373.db2.gz YYMXCEVGHXYGFR-AWEZNQCLSA-N 1 1 329.400 3.972 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000886022464 1138032871 /nfs/dbraw/zinc/03/28/71/1138032871.db2.gz CAWSCRNTSBCBHR-AWEZNQCLSA-N 1 1 329.425 3.604 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053814353 1138048213 /nfs/dbraw/zinc/04/82/13/1138048213.db2.gz YJYWEINLOBAPBZ-UHFFFAOYSA-N 1 1 330.331 3.579 20 5 EHBDMO CCCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ncsc2C1 ZINC000886265910 1138062952 /nfs/dbraw/zinc/06/29/52/1138062952.db2.gz URWXYVAPFCGRLW-AWEZNQCLSA-N 1 1 346.456 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Br)ccc2F)cc1 ZINC000037502475 1138081732 /nfs/dbraw/zinc/08/17/32/1138081732.db2.gz OPGXQNSVDGGMEY-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCSC1 ZINC000130489845 1138458228 /nfs/dbraw/zinc/45/82/28/1138458228.db2.gz IETNNCGKPUNESE-AWEZNQCLSA-N 1 1 335.454 3.656 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCSC1 ZINC000130489845 1138458229 /nfs/dbraw/zinc/45/82/29/1138458229.db2.gz IETNNCGKPUNESE-AWEZNQCLSA-N 1 1 335.454 3.656 20 5 EHBDMO CC[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000173931730 1139387698 /nfs/dbraw/zinc/38/76/98/1139387698.db2.gz MNWMVYIPUBFKRR-HNNXBMFYSA-N 1 1 347.440 3.620 20 5 EHBDMO CC(C)CCOC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177011962 1139593195 /nfs/dbraw/zinc/59/31/95/1139593195.db2.gz FVBMSQZUGKVAER-UHFFFAOYSA-N 1 1 347.415 3.763 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281923 1139824077 /nfs/dbraw/zinc/82/40/77/1139824077.db2.gz BOLIXRGAGDXEAI-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281923 1139824085 /nfs/dbraw/zinc/82/40/85/1139824085.db2.gz BOLIXRGAGDXEAI-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000183392247 1140034214 /nfs/dbraw/zinc/03/42/14/1140034214.db2.gz RNZVXZWIFKYFJD-WBVHZDCISA-N 1 1 330.384 3.584 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000183392270 1140034245 /nfs/dbraw/zinc/03/42/45/1140034245.db2.gz RNZVXZWIFKYFJD-RDJZCZTQSA-N 1 1 330.384 3.584 20 5 EHBDMO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000185235293 1140141479 /nfs/dbraw/zinc/14/14/79/1140141479.db2.gz LQFILSKARJMFIY-ZDUSSCGKSA-N 1 1 344.415 3.919 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000192190775 1140509066 /nfs/dbraw/zinc/50/90/66/1140509066.db2.gz RDCANXHLQMLPHH-CYBMUJFWSA-N 1 1 347.440 3.620 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(O)(c2ccccc2Cl)CC1 ZINC000193132519 1140565191 /nfs/dbraw/zinc/56/51/91/1140565191.db2.gz KCQRXLKGIJZGEA-UHFFFAOYSA-N 1 1 346.814 3.732 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687377 1141135629 /nfs/dbraw/zinc/13/56/29/1141135629.db2.gz TVZMAYBXGOUAOA-QZTJIDSGSA-N 1 1 330.359 3.604 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cn(C(C)(C)C)nc1C ZINC000430192184 1014745575 /nfs/dbraw/zinc/74/55/75/1014745575.db2.gz AUSXAVDGSYMRNS-GFCCVEGCSA-N 1 1 346.431 3.714 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCc2ccccc2C1 ZINC000430196375 1014813147 /nfs/dbraw/zinc/81/31/47/1014813147.db2.gz QYRIGMRLVCSBNC-QGZVFWFLSA-N 1 1 326.396 3.593 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000183243862 1125486319 /nfs/dbraw/zinc/48/63/19/1125486319.db2.gz KVOCBPDMEOGUTA-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000183243862 1125486321 /nfs/dbraw/zinc/48/63/21/1125486321.db2.gz KVOCBPDMEOGUTA-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC000692958650 1015033821 /nfs/dbraw/zinc/03/38/21/1015033821.db2.gz YTZSCBZDGPRNJN-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000430216893 1015061690 /nfs/dbraw/zinc/06/16/90/1015061690.db2.gz GLMLCPXFXQTZLG-LLVKDONJSA-N 1 1 335.429 3.870 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000430216893 1015061701 /nfs/dbraw/zinc/06/17/01/1015061701.db2.gz GLMLCPXFXQTZLG-LLVKDONJSA-N 1 1 335.429 3.870 20 5 EHBDMO CC(=O)Nc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000126980401 1015149557 /nfs/dbraw/zinc/14/95/57/1015149557.db2.gz HKGWBKHNNOTUNT-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1O ZINC000154464151 1015869957 /nfs/dbraw/zinc/86/99/57/1015869957.db2.gz PDMREIOTNHGVRJ-UHFFFAOYSA-N 1 1 330.384 3.720 20 5 EHBDMO CC(C)[C@H]1[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527941 1016953962 /nfs/dbraw/zinc/95/39/62/1016953962.db2.gz NJYBVTZHILJHEM-LZCIBIBXSA-N 1 1 330.428 3.745 20 5 EHBDMO CC(C)(C)n1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501159 1032680348 /nfs/dbraw/zinc/68/03/48/1032680348.db2.gz PARZJEHSTJVMKI-QGZVFWFLSA-N 1 1 342.443 3.926 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952391 1017350881 /nfs/dbraw/zinc/35/08/81/1017350881.db2.gz QQRGAABWCLIUQZ-OCCSQVGLSA-N 1 1 331.441 3.553 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000610004698 1017982153 /nfs/dbraw/zinc/98/21/53/1017982153.db2.gz ZOIUXOIATFKMRN-MRXNPFEDSA-N 1 1 342.370 3.829 20 5 EHBDMO O=C(c1ccc(F)cc1)[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000610004698 1017982160 /nfs/dbraw/zinc/98/21/60/1017982160.db2.gz ZOIUXOIATFKMRN-MRXNPFEDSA-N 1 1 342.370 3.829 20 5 EHBDMO CC[N@H+](CCc1nccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119539026 1018169545 /nfs/dbraw/zinc/16/95/45/1018169545.db2.gz HYJOJIDWPJYURM-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO CC[N@@H+](CCc1nccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119539026 1018169551 /nfs/dbraw/zinc/16/95/51/1018169551.db2.gz HYJOJIDWPJYURM-UHFFFAOYSA-N 1 1 325.821 3.769 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3[nH]cnc3C2)c2ccccc2)c1 ZINC000377799747 1018393453 /nfs/dbraw/zinc/39/34/53/1018393453.db2.gz YWSRMZCRZGKJLG-OXJNMPFZSA-N 1 1 348.406 3.554 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000064915971 1018717074 /nfs/dbraw/zinc/71/70/74/1018717074.db2.gz QJQGRMXYQGBGPK-CJNGLKHVSA-N 1 1 329.375 3.981 20 5 EHBDMO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)NCc1csc([N+](=O)[O-])c1 ZINC000398036558 1018955865 /nfs/dbraw/zinc/95/58/65/1018955865.db2.gz NKFJLKOAQDVSFN-KRWDZBQOSA-N 1 1 347.484 3.903 20 5 EHBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NCc1csc([N+](=O)[O-])c1 ZINC000398036558 1018955880 /nfs/dbraw/zinc/95/58/80/1018955880.db2.gz NKFJLKOAQDVSFN-KRWDZBQOSA-N 1 1 347.484 3.903 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000025447893 1018981761 /nfs/dbraw/zinc/98/17/61/1018981761.db2.gz QWVVMFCSNMGONE-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412992 1019643958 /nfs/dbraw/zinc/64/39/58/1019643958.db2.gz FQJGSDCNOXFQJS-MTIYJEKLSA-N 1 1 348.406 3.905 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000513697455 1020464027 /nfs/dbraw/zinc/46/40/27/1020464027.db2.gz NRLVDZUUMPCFJR-GOSISDBHSA-N 1 1 342.443 3.978 20 5 EHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501009920 1020645430 /nfs/dbraw/zinc/64/54/30/1020645430.db2.gz GECIJMWBGYYDQU-INIZCTEOSA-N 1 1 333.432 3.824 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000361032303 1020891875 /nfs/dbraw/zinc/89/18/75/1020891875.db2.gz OREAQPCDRXTXAB-CQSZACIVSA-N 1 1 329.400 3.536 20 5 EHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837396 1021262558 /nfs/dbraw/zinc/26/25/58/1021262558.db2.gz DXSXNWJGDRJLCH-CVEARBPZSA-N 1 1 345.399 3.516 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000247353885 1021624975 /nfs/dbraw/zinc/62/49/75/1021624975.db2.gz XDIJAMQUBZNTHA-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000127274904 1021670865 /nfs/dbraw/zinc/67/08/65/1021670865.db2.gz SUSAXAMKTUKPHK-CHWSQXEVSA-N 1 1 330.388 3.513 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)s1 ZINC000051233142 1021808943 /nfs/dbraw/zinc/80/89/43/1021808943.db2.gz XNHUKQXSIWZHAW-UHFFFAOYSA-N 1 1 326.805 3.821 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)n1 ZINC000178201360 1022100023 /nfs/dbraw/zinc/10/00/23/1022100023.db2.gz LHOKEVPWLAWQKO-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000441403182 1022233121 /nfs/dbraw/zinc/23/31/21/1022233121.db2.gz GDCVMMUKBVBQMD-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000441403182 1022233137 /nfs/dbraw/zinc/23/31/37/1022233137.db2.gz GDCVMMUKBVBQMD-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000602686078 1033066098 /nfs/dbraw/zinc/06/60/98/1033066098.db2.gz VKHLNCMMLGMELX-FUHWJXTLSA-N 1 1 340.427 3.659 20 5 EHBDMO Cn1ccnc1[C@@H](C1CC1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000602686080 1033067975 /nfs/dbraw/zinc/06/79/75/1033067975.db2.gz VKHLNCMMLGMELX-SJLPKXTDSA-N 1 1 340.427 3.659 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1C ZINC000602691240 1033071780 /nfs/dbraw/zinc/07/17/80/1033071780.db2.gz PBPGWZMKHVHVQF-UHFFFAOYSA-N 1 1 339.317 3.915 20 5 EHBDMO CC(C)[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438480985 1022703031 /nfs/dbraw/zinc/70/30/31/1022703031.db2.gz UDZWINBNJSCPSV-VXGBXAGGSA-N 1 1 339.823 3.553 20 5 EHBDMO CC(C)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438480985 1022703040 /nfs/dbraw/zinc/70/30/40/1022703040.db2.gz UDZWINBNJSCPSV-VXGBXAGGSA-N 1 1 339.823 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H](CCO)CC1 ZINC000602693293 1033073771 /nfs/dbraw/zinc/07/37/71/1033073771.db2.gz FJXRZFUUQHYYNG-LBPRGKRZSA-N 1 1 346.349 3.598 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc(C)n1 ZINC000602695573 1033076179 /nfs/dbraw/zinc/07/61/79/1033076179.db2.gz APPLTJYYMUNLCZ-UHFFFAOYSA-N 1 1 339.317 3.915 20 5 EHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675769 1033079155 /nfs/dbraw/zinc/07/91/55/1033079155.db2.gz NEQNHMIFNNKDIG-NXEZZACHSA-N 1 1 343.305 3.899 20 5 EHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602675769 1033079168 /nfs/dbraw/zinc/07/91/68/1033079168.db2.gz NEQNHMIFNNKDIG-NXEZZACHSA-N 1 1 343.305 3.899 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000729469206 1022842309 /nfs/dbraw/zinc/84/23/09/1022842309.db2.gz KKXWUDMVLQHCJI-CQSZACIVSA-N 1 1 340.358 3.531 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000602704178 1033092202 /nfs/dbraw/zinc/09/22/02/1033092202.db2.gz GFYWRZHYQZIAOA-LBPRGKRZSA-N 1 1 336.260 3.845 20 5 EHBDMO CC[N@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)[C@H](C)C1 ZINC000341770830 1023299583 /nfs/dbraw/zinc/29/95/83/1023299583.db2.gz JVNQSRSWSXCHBB-OAHLLOKOSA-N 1 1 333.435 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000248427139 1024089237 /nfs/dbraw/zinc/08/92/37/1024089237.db2.gz OOZQBERVYYPXTJ-KSSFIOAISA-N 1 1 349.862 3.697 20 5 EHBDMO COc1ccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000522269025 1024127577 /nfs/dbraw/zinc/12/75/77/1024127577.db2.gz SDJGWZVSTAVXFO-IBGZPJMESA-N 1 1 326.396 3.983 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641876 1024301751 /nfs/dbraw/zinc/30/17/51/1024301751.db2.gz MRWWXEVIYQOYGL-UONOGXRCSA-N 1 1 333.432 3.600 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493502 /nfs/dbraw/zinc/49/35/02/1024493502.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493550 /nfs/dbraw/zinc/49/35/50/1024493550.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 1 1 333.476 3.880 20 5 EHBDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493555 /nfs/dbraw/zinc/49/35/55/1024493555.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 1 1 333.476 3.880 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000895482805 1024562731 /nfs/dbraw/zinc/56/27/31/1024562731.db2.gz YQFIDFWYAQVLAB-IBGZPJMESA-N 1 1 342.395 3.724 20 5 EHBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343883 1024667140 /nfs/dbraw/zinc/66/71/40/1024667140.db2.gz WDPPMVPAQJPMLM-CYBMUJFWSA-N 1 1 346.383 3.628 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]([C@H]4CCCO4)C3)o2)cc1 ZINC000895843870 1024890945 /nfs/dbraw/zinc/89/09/45/1024890945.db2.gz JESKMVLCRAJWGS-MAUKXSAKSA-N 1 1 342.395 3.856 20 5 EHBDMO Cc1cccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000071949629 1024892704 /nfs/dbraw/zinc/89/27/04/1024892704.db2.gz KJZYYXKLAKZZDY-UHFFFAOYSA-N 1 1 325.412 3.534 20 5 EHBDMO COc1cc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185528 1024900977 /nfs/dbraw/zinc/90/09/77/1024900977.db2.gz DYBSKHLKUGOSBA-WMLDXEAASA-N 1 1 341.411 3.851 20 5 EHBDMO NC(=O)c1ccc(C[N@H+]2CCCC3(CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000346676810 1025012637 /nfs/dbraw/zinc/01/26/37/1025012637.db2.gz KPJXMGFOUKHXFN-UHFFFAOYSA-N 1 1 345.443 3.630 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccc(F)cn2)CC1 ZINC000602902579 1033251138 /nfs/dbraw/zinc/25/11/38/1033251138.db2.gz DKUAUUMYWXWNTF-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000072014193 1025148075 /nfs/dbraw/zinc/14/80/75/1025148075.db2.gz AGHQZTPGQFCQTO-UHFFFAOYSA-N 1 1 344.411 3.547 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000515333665 1025175566 /nfs/dbraw/zinc/17/55/66/1025175566.db2.gz ZSWZTAMRQRHYIU-LJQANCHMSA-N 1 1 326.396 3.649 20 5 EHBDMO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000436311838 1025574302 /nfs/dbraw/zinc/57/43/02/1025574302.db2.gz XVIUJYGWTNQQBW-WDEREUQCSA-N 1 1 346.353 3.683 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318944 1025582988 /nfs/dbraw/zinc/58/29/88/1025582988.db2.gz PXQAMXQWYDQGOR-WDEREUQCSA-N 1 1 346.353 3.541 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200895 1025641968 /nfs/dbraw/zinc/64/19/68/1025641968.db2.gz OGEPLPOIFJVRNC-DYVFJYSZSA-N 1 1 327.384 3.582 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425559237 1025752273 /nfs/dbraw/zinc/75/22/73/1025752273.db2.gz ZBIRJJJWWAJTCR-QGZVFWFLSA-N 1 1 334.391 3.515 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505870418 1026089581 /nfs/dbraw/zinc/08/95/81/1026089581.db2.gz WZMIACGYTYQRSO-HNNXBMFYSA-N 1 1 342.395 3.504 20 5 EHBDMO CC(C)(C)c1noc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451560753 1026113059 /nfs/dbraw/zinc/11/30/59/1026113059.db2.gz IGXPCUIDYUCDEB-AWEZNQCLSA-N 1 1 344.415 3.655 20 5 EHBDMO CC(C)(C)c1noc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451560753 1026113072 /nfs/dbraw/zinc/11/30/72/1026113072.db2.gz IGXPCUIDYUCDEB-AWEZNQCLSA-N 1 1 344.415 3.655 20 5 EHBDMO CCc1ccc([C@H]([NH2+]CC2=CCCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000562044678 1026265065 /nfs/dbraw/zinc/26/50/65/1026265065.db2.gz LXQIBNDXXIPEQA-LJQANCHMSA-N 1 1 342.395 3.776 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451845307 1026338873 /nfs/dbraw/zinc/33/88/73/1026338873.db2.gz UPBYLBDEZLBMDP-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451845307 1026338885 /nfs/dbraw/zinc/33/88/85/1026338885.db2.gz UPBYLBDEZLBMDP-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186438429 1026902447 /nfs/dbraw/zinc/90/24/47/1026902447.db2.gz XJQWKXHIDJBSRI-FKIZTMCRSA-N 1 1 336.391 3.739 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924954783 1027789027 /nfs/dbraw/zinc/78/90/27/1027789027.db2.gz LDIBKSMUTZGSLH-CQSZACIVSA-N 1 1 343.427 3.516 20 5 EHBDMO Cc1nc2ccccc2nc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292262701 1027945853 /nfs/dbraw/zinc/94/58/53/1027945853.db2.gz YSJMWKBBYZOEGE-UHFFFAOYSA-N 1 1 336.395 3.871 20 5 EHBDMO Cc1cnc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668094 1028066896 /nfs/dbraw/zinc/06/68/96/1028066896.db2.gz NRPXYXQGNBOLEV-BBRMVZONSA-N 1 1 346.456 3.855 20 5 EHBDMO CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414715210 1028158070 /nfs/dbraw/zinc/15/80/70/1028158070.db2.gz MSUINIBHQAUMCE-MRXNPFEDSA-N 1 1 343.427 3.819 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444700083 1028173726 /nfs/dbraw/zinc/17/37/26/1028173726.db2.gz NVKXKZFTLGUYBG-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444700083 1028173734 /nfs/dbraw/zinc/17/37/34/1028173734.db2.gz NVKXKZFTLGUYBG-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764442 1028252133 /nfs/dbraw/zinc/25/21/33/1028252133.db2.gz BESVWZLVJPCVKH-GOSISDBHSA-N 1 1 336.432 3.509 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC([NH3+])(CC)CC ZINC000423287904 1028324795 /nfs/dbraw/zinc/32/47/95/1028324795.db2.gz PEVHAWXOHCJRNT-CYBMUJFWSA-N 1 1 325.478 3.573 20 5 EHBDMO CC[N@H+](C)[C@@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000504222480 1028511236 /nfs/dbraw/zinc/51/12/36/1028511236.db2.gz FCKKEEWAKDDMEG-MRXNPFEDSA-N 1 1 338.367 3.686 20 5 EHBDMO CC[N@@H+](C)[C@@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000504222480 1028511246 /nfs/dbraw/zinc/51/12/46/1028511246.db2.gz FCKKEEWAKDDMEG-MRXNPFEDSA-N 1 1 338.367 3.686 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000445255347 1028664108 /nfs/dbraw/zinc/66/41/08/1028664108.db2.gz SMZUGOOCBUVIBB-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000523841169 1028668918 /nfs/dbraw/zinc/66/89/18/1028668918.db2.gz QPVZGRYFLMIVLZ-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000523841169 1028668924 /nfs/dbraw/zinc/66/89/24/1028668924.db2.gz QPVZGRYFLMIVLZ-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000532901484 1029044365 /nfs/dbraw/zinc/04/43/65/1029044365.db2.gz PRBSPPWFRHAFKF-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000532901484 1029044379 /nfs/dbraw/zinc/04/43/79/1029044379.db2.gz PRBSPPWFRHAFKF-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532918390 1029069403 /nfs/dbraw/zinc/06/94/03/1029069403.db2.gz TVWJNQJALFDRQG-QANKJYHBSA-N 1 1 345.443 3.742 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc([N+](=O)[O-])c(OCC)c1 ZINC000192235008 1029629032 /nfs/dbraw/zinc/62/90/32/1029629032.db2.gz JJRORETVCYNKDB-UHFFFAOYSA-N 1 1 346.431 3.669 20 5 EHBDMO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000508679539 1029634557 /nfs/dbraw/zinc/63/45/57/1029634557.db2.gz MNUQIUWUZOOGIZ-HNNXBMFYSA-N 1 1 346.818 3.638 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)[C@H]1C=C[C@H](CO)C1 ZINC000347387822 1029721973 /nfs/dbraw/zinc/72/19/73/1029721973.db2.gz ZOXCAMRCBVLWBC-HOCLYGCPSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)[C@H]1C=C[C@H](CO)C1 ZINC000347387822 1029721980 /nfs/dbraw/zinc/72/19/80/1029721980.db2.gz ZOXCAMRCBVLWBC-HOCLYGCPSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCC(F)(F)F)cs2)c1 ZINC000525195533 1029739358 /nfs/dbraw/zinc/73/93/58/1029739358.db2.gz JHCQUGXLRFQNDF-UHFFFAOYSA-N 1 1 331.319 3.760 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000343224599 1029810144 /nfs/dbraw/zinc/81/01/44/1029810144.db2.gz YRXOKEUVWOVAEF-ZDUSSCGKSA-N 1 1 342.399 3.550 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC ZINC000446976812 1029871074 /nfs/dbraw/zinc/87/10/74/1029871074.db2.gz YLXUNEBUEAXHOE-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC ZINC000446976812 1029871082 /nfs/dbraw/zinc/87/10/82/1029871082.db2.gz YLXUNEBUEAXHOE-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO CCS[C@@H]1CCCC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509648918 1029945708 /nfs/dbraw/zinc/94/57/08/1029945708.db2.gz CXSIPVLEOCIPJL-GFCCVEGCSA-N 1 1 330.400 3.981 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509648918 1029945725 /nfs/dbraw/zinc/94/57/25/1029945725.db2.gz CXSIPVLEOCIPJL-GFCCVEGCSA-N 1 1 330.400 3.981 20 5 EHBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000525996555 1030292481 /nfs/dbraw/zinc/29/24/81/1030292481.db2.gz CXGIVQKTJJOELU-AOOOYVTPSA-N 1 1 348.321 3.527 20 5 EHBDMO COc1cc(C[N@@H+]2[C@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000525996555 1030292493 /nfs/dbraw/zinc/29/24/93/1030292493.db2.gz CXGIVQKTJJOELU-AOOOYVTPSA-N 1 1 348.321 3.527 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000159854317 1030399139 /nfs/dbraw/zinc/39/91/39/1030399139.db2.gz WUGBNKBHCASEEA-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000159854317 1030399157 /nfs/dbraw/zinc/39/91/57/1030399157.db2.gz WUGBNKBHCASEEA-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO C[C@H](CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729482 1030441576 /nfs/dbraw/zinc/44/15/76/1030441576.db2.gz NWROGQFDYQHODM-NVXWUHKLSA-N 1 1 340.427 3.670 20 5 EHBDMO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000482499968 1030480751 /nfs/dbraw/zinc/48/07/51/1030480751.db2.gz HCQYLGBFPGUWIJ-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000482499968 1030480758 /nfs/dbraw/zinc/48/07/58/1030480758.db2.gz HCQYLGBFPGUWIJ-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117186 1030978037 /nfs/dbraw/zinc/97/80/37/1030978037.db2.gz OUIHPDHDRBPAJK-CYBMUJFWSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117186 1030978053 /nfs/dbraw/zinc/97/80/53/1030978053.db2.gz OUIHPDHDRBPAJK-CYBMUJFWSA-N 1 1 340.358 3.600 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC1CC1)CC1CCC1 ZINC000483282960 1031087923 /nfs/dbraw/zinc/08/79/23/1031087923.db2.gz GWYFHQDTULXGEM-UHFFFAOYSA-N 1 1 345.443 3.744 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCc1nccs1)C(C)C ZINC000179050991 1031741880 /nfs/dbraw/zinc/74/18/80/1031741880.db2.gz OAMATBRLPNJGDZ-UHFFFAOYSA-N 1 1 349.456 3.903 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000111171365 1031757917 /nfs/dbraw/zinc/75/79/17/1031757917.db2.gz SLBUOSIAZLSPDF-AWEZNQCLSA-N 1 1 334.807 3.509 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487854 1033369950 /nfs/dbraw/zinc/36/99/50/1033369950.db2.gz NYBDKGJUYQAWRW-ZFWWWQNUSA-N 1 1 334.445 3.508 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000594615398 1033479993 /nfs/dbraw/zinc/47/99/93/1033479993.db2.gz OBQFYSBQKXHBCL-LBPRGKRZSA-N 1 1 332.425 3.669 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292775 1033555088 /nfs/dbraw/zinc/55/50/88/1033555088.db2.gz NEMYBXOUWMBCEA-DOTOQJQBSA-N 1 1 346.456 3.570 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1COc2ccc(C)cc21 ZINC000595022886 1033616690 /nfs/dbraw/zinc/61/66/90/1033616690.db2.gz QDWJLKHZQJMGCF-WBMJQRKESA-N 1 1 328.368 3.696 20 5 EHBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(F)(F)C(C)(C)C ZINC000595109998 1033693490 /nfs/dbraw/zinc/69/34/90/1033693490.db2.gz YKTAAYCHDPXYQX-LLVKDONJSA-N 1 1 343.374 3.583 20 5 EHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCOC1 ZINC000593674021 1033724378 /nfs/dbraw/zinc/72/43/78/1033724378.db2.gz LQUROVRTTIBCGD-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCOC1 ZINC000593674021 1033724392 /nfs/dbraw/zinc/72/43/92/1033724392.db2.gz LQUROVRTTIBCGD-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000595497030 1033831780 /nfs/dbraw/zinc/83/17/80/1033831780.db2.gz LIMYIXHYXIIJNG-OAHLLOKOSA-N 1 1 338.766 3.601 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545134 1033856384 /nfs/dbraw/zinc/85/63/84/1033856384.db2.gz ONLPOFYETGAMMF-OAHLLOKOSA-N 1 1 327.384 3.661 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1COc2ccccc2O1 ZINC000603838773 1033950559 /nfs/dbraw/zinc/95/05/59/1033950559.db2.gz HWYGQQXPKVOZCW-MRXNPFEDSA-N 1 1 342.395 3.565 20 5 EHBDMO COc1ccc(OCC[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000595702327 1033953343 /nfs/dbraw/zinc/95/33/43/1033953343.db2.gz ISSOQIWGMKQJIM-MRXNPFEDSA-N 1 1 346.358 3.568 20 5 EHBDMO COc1ccc(OCC[N@H+]2CC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000595702327 1033953353 /nfs/dbraw/zinc/95/33/53/1033953353.db2.gz ISSOQIWGMKQJIM-MRXNPFEDSA-N 1 1 346.358 3.568 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000603859676 1033984877 /nfs/dbraw/zinc/98/48/77/1033984877.db2.gz QXBZWTKINNHOER-GASCZTMLSA-N 1 1 342.443 3.923 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754777 1033985483 /nfs/dbraw/zinc/98/54/83/1033985483.db2.gz BULVCDAIMWZLBJ-STQMWFEESA-N 1 1 348.378 3.777 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584502 1034026228 /nfs/dbraw/zinc/02/62/28/1034026228.db2.gz ADZICILGQCIYDR-QLFBSQMISA-N 1 1 348.443 3.956 20 5 EHBDMO CCc1ccc(C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000599668143 1034077161 /nfs/dbraw/zinc/07/71/61/1034077161.db2.gz DJXKWKFPRPLDRV-UHFFFAOYSA-N 1 1 329.400 3.833 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC([C@](C)(O)C(F)(F)F)CC1 ZINC000547346100 1034218759 /nfs/dbraw/zinc/21/87/59/1034218759.db2.gz VKANYZFJFOPGQC-NHYWBVRUSA-N 1 1 346.349 3.681 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000604484461 1034388073 /nfs/dbraw/zinc/38/80/73/1034388073.db2.gz PMMTYFLFIMXJLW-INIZCTEOSA-N 1 1 328.368 3.646 20 5 EHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000604493506 1034400846 /nfs/dbraw/zinc/40/08/46/1034400846.db2.gz VOBYBQKDVYIGCY-UHFFFAOYSA-N 1 1 334.441 3.990 20 5 EHBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000302947726 1034443339 /nfs/dbraw/zinc/44/33/39/1034443339.db2.gz NCDSONKBDKYFCK-MRXNPFEDSA-N 1 1 333.435 3.602 20 5 EHBDMO C[N@H+](Cc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061781326 1034513106 /nfs/dbraw/zinc/51/31/06/1034513106.db2.gz LRBXVUGKSCKUCI-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO C[N@@H+](Cc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061781326 1034513114 /nfs/dbraw/zinc/51/31/14/1034513114.db2.gz LRBXVUGKSCKUCI-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO CC[N@H+](Cc1cccs1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000179720454 1034584018 /nfs/dbraw/zinc/58/40/18/1034584018.db2.gz IZOWGRIRHHMQTF-UHFFFAOYSA-N 1 1 336.413 3.696 20 5 EHBDMO CC[N@@H+](Cc1cccs1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000179720454 1034584027 /nfs/dbraw/zinc/58/40/27/1034584027.db2.gz IZOWGRIRHHMQTF-UHFFFAOYSA-N 1 1 336.413 3.696 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)o2)c1 ZINC000597203871 1034607768 /nfs/dbraw/zinc/60/77/68/1034607768.db2.gz AFXJJBSCNKLITM-IBGZPJMESA-N 1 1 342.395 3.592 20 5 EHBDMO CC1=C(c2ccco2)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000548930073 1034940971 /nfs/dbraw/zinc/94/09/71/1034940971.db2.gz FEWRPDQNDCLJNM-UHFFFAOYSA-N 1 1 328.368 3.746 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000065968758 1035047503 /nfs/dbraw/zinc/04/75/03/1035047503.db2.gz SOSQWNKAFDUJSB-OAHLLOKOSA-N 1 1 343.402 3.613 20 5 EHBDMO CC(C)CCC1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001167690595 1035207631 /nfs/dbraw/zinc/20/76/31/1035207631.db2.gz STCPNKNTFBUPKH-UHFFFAOYSA-N 1 1 347.459 3.706 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1 ZINC000412001715 1035273943 /nfs/dbraw/zinc/27/39/43/1035273943.db2.gz QTIXEPGQNPTGGT-IBGZPJMESA-N 1 1 338.407 3.949 20 5 EHBDMO COc1ccc(OCC[N@@H+](CC(C)C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001168164622 1035552728 /nfs/dbraw/zinc/55/27/28/1035552728.db2.gz RGGSCNMOHXAEEX-UHFFFAOYSA-N 1 1 338.448 3.986 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c1 ZINC000540906903 1035786210 /nfs/dbraw/zinc/78/62/10/1035786210.db2.gz AJWCMXNXBDGEAW-CVEARBPZSA-N 1 1 347.459 3.694 20 5 EHBDMO C[N@@H+](CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CCCC1 ZINC000582611031 1036041994 /nfs/dbraw/zinc/04/19/94/1036041994.db2.gz JCCWWWWYGGBTFX-HNNXBMFYSA-N 1 1 345.365 3.662 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2cc(C)no2)ccc1[N+](=O)[O-] ZINC000492631882 1036094639 /nfs/dbraw/zinc/09/46/39/1036094639.db2.gz QMSRNWQNWKQQFO-AWEZNQCLSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cc(C)no2)ccc1[N+](=O)[O-] ZINC000492631882 1036094657 /nfs/dbraw/zinc/09/46/57/1036094657.db2.gz QMSRNWQNWKQQFO-AWEZNQCLSA-N 1 1 331.372 3.627 20 5 EHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000492652216 1036111780 /nfs/dbraw/zinc/11/17/80/1036111780.db2.gz LBSGHDGRYFHYIQ-CQSZACIVSA-N 1 1 344.411 3.762 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492729411 1036218509 /nfs/dbraw/zinc/21/85/09/1036218509.db2.gz RZJOUGZHSMDSFA-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](O)C1CC1 ZINC000589197042 1036304066 /nfs/dbraw/zinc/30/40/66/1036304066.db2.gz VGJGAQJHJOCOTR-MRXNPFEDSA-N 1 1 332.425 3.526 20 5 EHBDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000589210515 1036313523 /nfs/dbraw/zinc/31/35/23/1036313523.db2.gz NKEJLVKCYGJOBZ-IBGZPJMESA-N 1 1 344.411 3.839 20 5 EHBDMO COc1ccc(OCC[N@@H+](C2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000610367643 1036440092 /nfs/dbraw/zinc/44/00/92/1036440092.db2.gz MBQNACNURNYJQS-UHFFFAOYSA-N 1 1 334.416 3.779 20 5 EHBDMO C[C@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000310852782 1036638574 /nfs/dbraw/zinc/63/85/74/1036638574.db2.gz AVXQRNAGHFYDER-HXUWFJFHSA-N 1 1 339.439 3.597 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000191290403 1036886246 /nfs/dbraw/zinc/88/62/46/1036886246.db2.gz UFBXARJLCPAHDZ-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO CCOc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000590659571 1036996283 /nfs/dbraw/zinc/99/62/83/1036996283.db2.gz AOZGZINAIWZBDH-INIZCTEOSA-N 1 1 341.411 3.768 20 5 EHBDMO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+](C)Cc1ccccc1 ZINC000761527954 1037103874 /nfs/dbraw/zinc/10/38/74/1037103874.db2.gz VLERBTQVPCOXTE-AWEZNQCLSA-N 1 1 347.846 3.858 20 5 EHBDMO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+](C)Cc1ccccc1 ZINC000761527954 1037103919 /nfs/dbraw/zinc/10/39/19/1037103919.db2.gz VLERBTQVPCOXTE-AWEZNQCLSA-N 1 1 347.846 3.858 20 5 EHBDMO CO[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390316 1037620280 /nfs/dbraw/zinc/62/02/80/1037620280.db2.gz ZNXWRVLFIYPQAX-IBGZPJMESA-N 1 1 326.396 3.947 20 5 EHBDMO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538726461 1038507477 /nfs/dbraw/zinc/50/74/77/1038507477.db2.gz SVZFNYZBJSJCBU-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538726461 1038507480 /nfs/dbraw/zinc/50/74/80/1038507480.db2.gz SVZFNYZBJSJCBU-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO CC[N@@H+](CCNc1cc(C)c([N+](=O)[O-])cc1F)CCC(F)(F)F ZINC000461933924 1038682497 /nfs/dbraw/zinc/68/24/97/1038682497.db2.gz HYZHHADHYGPJAH-UHFFFAOYSA-N 1 1 337.317 3.729 20 5 EHBDMO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000539376790 1038867082 /nfs/dbraw/zinc/86/70/82/1038867082.db2.gz KJOHZKHXLZVPRC-UONOGXRCSA-N 1 1 341.411 3.835 20 5 EHBDMO CC(C)(C)c1ccc(NC(=O)[C@@H]2CCCc3[nH+]ccn32)cc1[N+](=O)[O-] ZINC000488348770 1039108853 /nfs/dbraw/zinc/10/88/53/1039108853.db2.gz OFVPRFWFPBCVCC-AWEZNQCLSA-N 1 1 342.399 3.605 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478039568 1039140726 /nfs/dbraw/zinc/14/07/26/1039140726.db2.gz GFXLNHFCEUTPLX-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO C[C@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000478443357 1039456067 /nfs/dbraw/zinc/45/60/67/1039456067.db2.gz JUMRSLOTVWULCT-NSHDSACASA-N 1 1 344.802 3.986 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000480505403 1039616622 /nfs/dbraw/zinc/61/66/22/1039616622.db2.gz MHUQWBVZLKEVKS-KRWDZBQOSA-N 1 1 340.427 3.541 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489106245 1039626362 /nfs/dbraw/zinc/62/63/62/1039626362.db2.gz PPYXQCDENILANO-MRXNPFEDSA-N 1 1 342.395 3.949 20 5 EHBDMO C[C@@H](C[NH+](C)C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000554727037 1039634200 /nfs/dbraw/zinc/63/42/00/1039634200.db2.gz UCAQNWLXNKEOEZ-NSHDSACASA-N 1 1 337.807 3.548 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCO)CC1CCCCC1 ZINC000485884329 1039671668 /nfs/dbraw/zinc/67/16/68/1039671668.db2.gz RLBIHMWTBJUYAH-UHFFFAOYSA-N 1 1 326.824 3.623 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177919 1039701347 /nfs/dbraw/zinc/70/13/47/1039701347.db2.gz UFNRFKHHGYNPEY-INIZCTEOSA-N 1 1 342.395 3.602 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000417347368 1039709859 /nfs/dbraw/zinc/70/98/59/1039709859.db2.gz HAQHCGVBQVHKQZ-CSMYWGQOSA-N 1 1 326.400 3.854 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298577 1039813513 /nfs/dbraw/zinc/81/35/13/1039813513.db2.gz WZEQYKDAVIBUKV-NEPJUHHUSA-N 1 1 341.839 3.943 20 5 EHBDMO CC(C)CO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549472542 1039959276 /nfs/dbraw/zinc/95/92/76/1039959276.db2.gz XIAILNLYEJCWGM-CQSZACIVSA-N 1 1 346.349 3.861 20 5 EHBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549472542 1039959291 /nfs/dbraw/zinc/95/92/91/1039959291.db2.gz XIAILNLYEJCWGM-CQSZACIVSA-N 1 1 346.349 3.861 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1nc2cccc(Cl)c2n1C ZINC000479423514 1040210491 /nfs/dbraw/zinc/21/04/91/1040210491.db2.gz PWYREGZZWRKSHQ-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](c4cccc(F)c4)C3)nc2c1 ZINC000489883372 1040219608 /nfs/dbraw/zinc/21/96/08/1040219608.db2.gz OKQHLCBZNWZKSH-CYBMUJFWSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4cccc(F)c4)C3)nc2c1 ZINC000489883372 1040219625 /nfs/dbraw/zinc/21/96/25/1040219625.db2.gz OKQHLCBZNWZKSH-CYBMUJFWSA-N 1 1 340.358 3.600 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CCCCC1 ZINC000573771616 1040377779 /nfs/dbraw/zinc/37/77/79/1040377779.db2.gz YJTROQGJPRLOJB-UHFFFAOYSA-N 1 1 333.432 3.805 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCS1 ZINC000555461284 1040620493 /nfs/dbraw/zinc/62/04/93/1040620493.db2.gz ZLMNXLRLYKCTMA-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCS1 ZINC000555461284 1040620503 /nfs/dbraw/zinc/62/05/03/1040620503.db2.gz ZLMNXLRLYKCTMA-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)CC(C)(C)C1 ZINC000542247172 1040650365 /nfs/dbraw/zinc/65/03/65/1040650365.db2.gz OPSJXTAFLYANIJ-CYBMUJFWSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1ccc2nc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000278839639 1041682037 /nfs/dbraw/zinc/68/20/37/1041682037.db2.gz USPZNGSHRKMIDN-SFHVURJKSA-N 1 1 336.395 3.718 20 5 EHBDMO COc1cc(C[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778436 1041841117 /nfs/dbraw/zinc/84/11/17/1041841117.db2.gz ZEPCXNOROFWZAZ-UHFFFAOYSA-N 1 1 344.358 3.969 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](CCO)C2)s1 ZINC000093106417 1041873486 /nfs/dbraw/zinc/87/34/86/1041873486.db2.gz IZSLTAUWJUCDKF-AWEZNQCLSA-N 1 1 346.452 3.918 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000048820017 1042420136 /nfs/dbraw/zinc/42/01/36/1042420136.db2.gz PINBAKSYDOKNMH-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000585756017 1043025487 /nfs/dbraw/zinc/02/54/87/1043025487.db2.gz CZXIUOBQVIAZNT-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccn1 ZINC000279412902 1044064042 /nfs/dbraw/zinc/06/40/42/1044064042.db2.gz FAWJOSZKLOEZEP-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)n[nH]1 ZINC000272883589 1127097316 /nfs/dbraw/zinc/09/73/16/1127097316.db2.gz CSXGXZKHBJVIFV-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)[nH]n1 ZINC000272883589 1127097321 /nfs/dbraw/zinc/09/73/21/1127097321.db2.gz CSXGXZKHBJVIFV-UHFFFAOYSA-N 1 1 334.807 3.659 20 5 EHBDMO O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCCC[N@H+]3C3CC3)sc2c1 ZINC000764940158 1127552473 /nfs/dbraw/zinc/55/24/73/1127552473.db2.gz FXUAOWQRKVNPTB-ZDUSSCGKSA-N 1 1 332.429 3.633 20 5 EHBDMO Cc1nn(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c2ccc([N+](=O)[O-])cc12 ZINC000764928033 1127553729 /nfs/dbraw/zinc/55/37/29/1127553729.db2.gz DKXQRDAVTFSKGX-KWOWKCNFSA-N 1 1 340.427 3.721 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2nccc(C)c2[N+](=O)[O-])cc1F ZINC000301294443 1127735069 /nfs/dbraw/zinc/73/50/69/1127735069.db2.gz OOYVZVULEGLXSG-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000171709265 1121480411 /nfs/dbraw/zinc/48/04/11/1121480411.db2.gz LGFPHKNOZCDBRK-OAHLLOKOSA-N 1 1 345.446 3.602 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000122683331 1121522950 /nfs/dbraw/zinc/52/29/50/1121522950.db2.gz ZBHGKOVUIYECET-KGLIPLIRSA-N 1 1 329.400 3.770 20 5 EHBDMO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccnc1 ZINC000113314282 1129000164 /nfs/dbraw/zinc/00/01/64/1129000164.db2.gz GROSOXKJSOGTPJ-GFCCVEGCSA-N 1 1 340.408 3.964 20 5 EHBDMO C[C@H](c1ccccc1F)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000916987448 1122424592 /nfs/dbraw/zinc/42/45/92/1122424592.db2.gz TYZHHGJMSZFZEW-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO O=C(C[NH+]1CCC(C2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000917131422 1122527496 /nfs/dbraw/zinc/52/74/96/1122527496.db2.gz OHUVEJBIRNTSKF-UHFFFAOYSA-N 1 1 345.443 3.826 20 5 EHBDMO Cc1ccc(N2CCC(Nc3c(F)cc([N+](=O)[O-])cc3F)CC2)[nH+]c1 ZINC000301792236 1129086088 /nfs/dbraw/zinc/08/60/88/1129086088.db2.gz OKLASCFITIJNCJ-UHFFFAOYSA-N 1 1 348.353 3.657 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCc2ccccc21 ZINC000557049272 1123283540 /nfs/dbraw/zinc/28/35/40/1123283540.db2.gz WDVSFJYHZLJNLS-SFHVURJKSA-N 1 1 336.395 3.981 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)cs1 ZINC000114193016 1129123624 /nfs/dbraw/zinc/12/36/24/1129123624.db2.gz NJSRJWHSLFRISS-MRXNPFEDSA-N 1 1 332.425 3.528 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)cs1 ZINC000114193016 1129123626 /nfs/dbraw/zinc/12/36/26/1129123626.db2.gz NJSRJWHSLFRISS-MRXNPFEDSA-N 1 1 332.425 3.528 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000609560415 1123608829 /nfs/dbraw/zinc/60/88/29/1123608829.db2.gz QQLASKFKHVQNQO-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610004143 1123712297 /nfs/dbraw/zinc/71/22/97/1123712297.db2.gz BDXCKDUTKZCWMP-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610004143 1123712298 /nfs/dbraw/zinc/71/22/98/1123712298.db2.gz BDXCKDUTKZCWMP-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@H]12 ZINC000182507074 1125322003 /nfs/dbraw/zinc/32/20/03/1125322003.db2.gz ZOMHRVPJMGIDPC-WQVCFCJDSA-N 1 1 342.399 3.655 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000619531967 1125358332 /nfs/dbraw/zinc/35/83/32/1125358332.db2.gz KFFPWHWIKBQUAP-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C(F)(F)F)CC[C@H]1C ZINC000619531967 1125358334 /nfs/dbraw/zinc/35/83/34/1125358334.db2.gz KFFPWHWIKBQUAP-PWSUYJOCSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000619531678 1125358519 /nfs/dbraw/zinc/35/85/19/1125358519.db2.gz RGBZNEDSPGCGIO-KRWDZBQOSA-N 1 1 328.368 3.646 20 5 EHBDMO Cn1c2ccc(Nc3ccc([N+](=O)[O-])cn3)cc2[nH+]c1C(C)(C)C ZINC000301891189 1129289172 /nfs/dbraw/zinc/28/91/72/1129289172.db2.gz UMSWQSHBNKKMEA-UHFFFAOYSA-N 1 1 325.372 3.918 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC(C)(C)C1 ZINC000543182044 1129316319 /nfs/dbraw/zinc/31/63/19/1129316319.db2.gz NCNACEOJEUHGGI-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)c(F)c1 ZINC000301915219 1129346884 /nfs/dbraw/zinc/34/68/84/1129346884.db2.gz VGUKRBFFWXTONX-WBVHZDCISA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)c(F)c1 ZINC000301915219 1129346886 /nfs/dbraw/zinc/34/68/86/1129346886.db2.gz VGUKRBFFWXTONX-WBVHZDCISA-N 1 1 333.338 3.730 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938967 1129385227 /nfs/dbraw/zinc/38/52/27/1129385227.db2.gz XQZDCIBXUHPQOP-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)cc1OC ZINC000922541639 1129568866 /nfs/dbraw/zinc/56/88/66/1129568866.db2.gz RGVHXYMHNRKABI-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1nc2c(s1)CCCC2 ZINC000922699297 1129630980 /nfs/dbraw/zinc/63/09/80/1129630980.db2.gz DEQYVOKJIKYTNW-UHFFFAOYSA-N 1 1 331.441 3.837 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235370 1129672864 /nfs/dbraw/zinc/67/28/64/1129672864.db2.gz QCRDQFUORISOLM-STQMWFEESA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1cc(NC[C@@H](C)C[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302054561 1129766140 /nfs/dbraw/zinc/76/61/40/1129766140.db2.gz ACHNLTWTCCXCDO-CYBMUJFWSA-N 1 1 328.416 3.595 20 5 EHBDMO CCCC[N@@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788039 1129841354 /nfs/dbraw/zinc/84/13/54/1129841354.db2.gz QLEBCFBIOQDKTP-NSHDSACASA-N 1 1 327.812 3.697 20 5 EHBDMO CCCC[N@@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788236 1129841613 /nfs/dbraw/zinc/84/16/13/1129841613.db2.gz QLEBCFBIOQDKTP-LLVKDONJSA-N 1 1 327.812 3.697 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000304785582 1129902176 /nfs/dbraw/zinc/90/21/76/1129902176.db2.gz OKOPZWXTGXKPDX-ZBFHGGJFSA-N 1 1 332.425 3.744 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC000031005033 1129937333 /nfs/dbraw/zinc/93/73/33/1129937333.db2.gz ZAXBVPVONXIUDM-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000031005033 1129937336 /nfs/dbraw/zinc/93/73/36/1129937336.db2.gz ZAXBVPVONXIUDM-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1C ZINC000429230107 1130100356 /nfs/dbraw/zinc/10/03/56/1130100356.db2.gz JRUWJLNEPRYXJP-UHFFFAOYSA-N 1 1 341.411 3.675 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000245710534 1130297555 /nfs/dbraw/zinc/29/75/55/1130297555.db2.gz FGHSMVRJFPVCSV-IUODEOHRSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000245710534 1130297557 /nfs/dbraw/zinc/29/75/57/1130297557.db2.gz FGHSMVRJFPVCSV-IUODEOHRSA-N 1 1 341.415 3.531 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893303 1130853933 /nfs/dbraw/zinc/85/39/33/1130853933.db2.gz OYQRGHFUBZRXCT-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000731893303 1130853937 /nfs/dbraw/zinc/85/39/37/1130853937.db2.gz OYQRGHFUBZRXCT-ZRGWGRIASA-N 1 1 326.396 3.945 20 5 EHBDMO Cc1cc(C(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)[nH]1 ZINC000348048835 1131127941 /nfs/dbraw/zinc/12/79/41/1131127941.db2.gz AKRBXTGEEXWUBQ-UHFFFAOYSA-N 1 1 329.400 3.633 20 5 EHBDMO Cc1cc(C(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)[nH]1 ZINC000348048835 1131127944 /nfs/dbraw/zinc/12/79/44/1131127944.db2.gz AKRBXTGEEXWUBQ-UHFFFAOYSA-N 1 1 329.400 3.633 20 5 EHBDMO Cc1nn(C)c(Nc2ccc([NH+]3CCCCCC3)cc2)c1[N+](=O)[O-] ZINC000734141501 1131203288 /nfs/dbraw/zinc/20/32/88/1131203288.db2.gz NKTNDUDNHUZVJJ-UHFFFAOYSA-N 1 1 329.404 3.761 20 5 EHBDMO Cc1nn(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742156814 1131694876 /nfs/dbraw/zinc/69/48/76/1131694876.db2.gz KZNMDEPVZBGGCE-QGZVFWFLSA-N 1 1 328.416 3.901 20 5 EHBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742156814 1131694878 /nfs/dbraw/zinc/69/48/78/1131694878.db2.gz KZNMDEPVZBGGCE-QGZVFWFLSA-N 1 1 328.416 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@@H]3CC(F)(F)C[C@@H]3C1)CC2 ZINC001172902713 1131885280 /nfs/dbraw/zinc/88/52/80/1131885280.db2.gz BTKULUXRZGJUQM-OWCLPIDISA-N 1 1 336.382 3.819 20 5 EHBDMO O=C1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@@H]12 ZINC001172908404 1131887625 /nfs/dbraw/zinc/88/76/25/1131887625.db2.gz MDOITLZGSHBJDY-QRQLOZEOSA-N 1 1 342.439 3.676 20 5 EHBDMO COC[C@@]12CCC[C@@H]1C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908557 1131888484 /nfs/dbraw/zinc/88/84/84/1131888484.db2.gz OGIIBAHHDYYEDP-HBFSDRIKSA-N 1 1 344.455 3.591 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H]3CCC[C@@H]3C2)c1F ZINC001173178275 1131992214 /nfs/dbraw/zinc/99/22/14/1131992214.db2.gz ACFXDYLKKMQTEN-BFHYXJOUSA-N 1 1 336.407 3.796 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2ccccc2)c1F ZINC001173184662 1131994354 /nfs/dbraw/zinc/99/43/54/1131994354.db2.gz NYIBZUKAZWCKTR-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCN(C)C)c1ccccc1 ZINC001173215707 1132001823 /nfs/dbraw/zinc/00/18/23/1132001823.db2.gz YTWWSUCQZZNNCU-UZLBHIALSA-N 1 1 341.455 3.808 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCN(C)C)c1ccccc1 ZINC001173215705 1132001986 /nfs/dbraw/zinc/00/19/86/1132001986.db2.gz YTWWSUCQZZNNCU-OXJNMPFZSA-N 1 1 341.455 3.808 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001173227875 1132007781 /nfs/dbraw/zinc/00/77/81/1132007781.db2.gz SFKVVKZDQFDNCA-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC001173232279 1132009706 /nfs/dbraw/zinc/00/97/06/1132009706.db2.gz AGTAKDGXOQJYAH-AUUYWEPGSA-N 1 1 344.386 3.818 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](Cc1ccccc1)CC(C)(C)O ZINC001173233475 1132010589 /nfs/dbraw/zinc/01/05/89/1132010589.db2.gz WWWHLNQGGWCBTB-INIZCTEOSA-N 1 1 342.439 3.799 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539511 1132780996 /nfs/dbraw/zinc/78/09/96/1132780996.db2.gz OLJXNAQUIOADKG-CRAIPNDOSA-N 1 1 332.444 3.921 20 5 EHBDMO Nc1ccc2cc3ccc(Nc4ccc5nn[nH]c5c4)cc3[nH+]c2c1 ZINC001176003351 1132817422 /nfs/dbraw/zinc/81/74/22/1132817422.db2.gz AQNYMYBTSRQXHN-UHFFFAOYSA-N 1 1 326.363 3.985 20 5 EHBDMO Nc1ccc2cc3ccc(Nc4ccc5n[nH]nc5c4)cc3[nH+]c2c1 ZINC001176003351 1132817430 /nfs/dbraw/zinc/81/74/30/1132817430.db2.gz AQNYMYBTSRQXHN-UHFFFAOYSA-N 1 1 326.363 3.985 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1OC ZINC000766843425 1132868063 /nfs/dbraw/zinc/86/80/63/1132868063.db2.gz JBUHDMDPBHFSDL-HNNXBMFYSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000768542360 1133153955 /nfs/dbraw/zinc/15/39/55/1133153955.db2.gz VOVFQTGBSGTCHM-GFCCVEGCSA-N 1 1 326.824 3.764 20 5 EHBDMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC001169999462 1133223693 /nfs/dbraw/zinc/22/36/93/1133223693.db2.gz GBLXQPYPHAKDHQ-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO CSC[C@@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769517387 1133308735 /nfs/dbraw/zinc/30/87/35/1133308735.db2.gz UWOJUIFZDLLLMJ-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO CSC[C@@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769517387 1133308740 /nfs/dbraw/zinc/30/87/40/1133308740.db2.gz UWOJUIFZDLLLMJ-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000769853828 1133351943 /nfs/dbraw/zinc/35/19/43/1133351943.db2.gz KEEWQWGWRLNFBI-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000769853828 1133351949 /nfs/dbraw/zinc/35/19/49/1133351949.db2.gz KEEWQWGWRLNFBI-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001181999435 1133560729 /nfs/dbraw/zinc/56/07/29/1133560729.db2.gz YIUBKVUZEZEKDQ-KRWDZBQOSA-N 1 1 334.423 3.596 20 5 EHBDMO Cc1ccccc1CC1C[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC001182990374 1133754564 /nfs/dbraw/zinc/75/45/64/1133754564.db2.gz PNZDQWVDOFRUNS-UHFFFAOYSA-N 1 1 337.379 3.719 20 5 EHBDMO Cc1cc(NCCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])s1 ZINC001184821546 1133994683 /nfs/dbraw/zinc/99/46/83/1133994683.db2.gz SYUNJHGZIGUJFT-UHFFFAOYSA-N 1 1 331.441 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1F ZINC000788483599 1134130149 /nfs/dbraw/zinc/13/01/49/1134130149.db2.gz UAVMGKUCBIVSCF-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO Cc1c(C[NH2+][C@H]2COCc3cccc(Cl)c32)cccc1[N+](=O)[O-] ZINC000788777305 1134174236 /nfs/dbraw/zinc/17/42/36/1134174236.db2.gz OYHOOYYYTHAKQO-HNNXBMFYSA-N 1 1 332.787 3.918 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CC1CCCC1 ZINC000788817658 1134176043 /nfs/dbraw/zinc/17/60/43/1134176043.db2.gz GHQGQUBRKLOXPL-HNNXBMFYSA-N 1 1 326.824 3.621 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CC1CCCC1 ZINC000788817658 1134176047 /nfs/dbraw/zinc/17/60/47/1134176047.db2.gz GHQGQUBRKLOXPL-HNNXBMFYSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001187081683 1134296629 /nfs/dbraw/zinc/29/66/29/1134296629.db2.gz OTRRHGQOGIIJEC-OAHLLOKOSA-N 1 1 340.427 3.962 20 5 EHBDMO CC(C)[C@H]1CN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C ZINC001187362065 1134326918 /nfs/dbraw/zinc/32/69/18/1134326918.db2.gz SWMVTXLZERPIML-CYBMUJFWSA-N 1 1 332.231 3.678 20 5 EHBDMO CC(C)[C@H]1CN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC001187362065 1134326924 /nfs/dbraw/zinc/32/69/24/1134326924.db2.gz SWMVTXLZERPIML-CYBMUJFWSA-N 1 1 332.231 3.678 20 5 EHBDMO CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000792355334 1134680381 /nfs/dbraw/zinc/68/03/81/1134680381.db2.gz RIZRZAOKKHZSNG-KBPBESRZSA-N 1 1 346.349 3.539 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000792355340 1134680781 /nfs/dbraw/zinc/68/07/81/1134680781.db2.gz RIZRZAOKKHZSNG-KGLIPLIRSA-N 1 1 346.349 3.539 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+]2CCCC(F)(F)[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335139 1134752569 /nfs/dbraw/zinc/75/25/69/1134752569.db2.gz LQJLLCNQEZMEKT-XHDPSFHLSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC(F)(F)[C@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335139 1134752574 /nfs/dbraw/zinc/75/25/74/1134752574.db2.gz LQJLLCNQEZMEKT-XHDPSFHLSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352937 1134754444 /nfs/dbraw/zinc/75/44/44/1134754444.db2.gz UXLQYHAPMPFGMH-GFCCVEGCSA-N 1 1 349.818 3.715 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170342613 1134758449 /nfs/dbraw/zinc/75/84/49/1134758449.db2.gz MMCSBLPDLJUDMO-HNNXBMFYSA-N 1 1 328.412 3.975 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170347629 1134759442 /nfs/dbraw/zinc/75/94/42/1134759442.db2.gz SOEYYEWWNAGYMY-HNNXBMFYSA-N 1 1 344.411 3.545 20 5 EHBDMO CN(CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC001191682329 1134899572 /nfs/dbraw/zinc/89/95/72/1134899572.db2.gz PQAPSIRHYHCXDL-UHFFFAOYSA-N 1 1 325.412 3.696 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192213382 1134981588 /nfs/dbraw/zinc/98/15/88/1134981588.db2.gz IHPLHGOLBBFRLH-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@@H]1c2cc(F)cc(F)c2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001192213382 1134981591 /nfs/dbraw/zinc/98/15/91/1134981591.db2.gz IHPLHGOLBBFRLH-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804669070 1135162965 /nfs/dbraw/zinc/16/29/65/1135162965.db2.gz QJXOIERLYCYNGD-UHFFFAOYSA-N 1 1 347.802 3.999 20 5 EHBDMO CC(C)(C)CC(C)(C)[NH+]1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC001194359293 1135258816 /nfs/dbraw/zinc/25/88/16/1135258816.db2.gz VRWLSPQBPTZCDO-UHFFFAOYSA-N 1 1 349.475 3.633 20 5 EHBDMO CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000805840168 1135333843 /nfs/dbraw/zinc/33/38/43/1135333843.db2.gz MMTQTRMJJPTKFD-GOEBONIOSA-N 1 1 332.425 3.773 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001196328504 1135546087 /nfs/dbraw/zinc/54/60/87/1135546087.db2.gz BETXAGFVHUYZSS-WCQYABFASA-N 1 1 339.823 3.840 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001196328504 1135546093 /nfs/dbraw/zinc/54/60/93/1135546093.db2.gz BETXAGFVHUYZSS-WCQYABFASA-N 1 1 339.823 3.840 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@@H](C4CC4)C3)c2)c1 ZINC000808230212 1135632701 /nfs/dbraw/zinc/63/27/01/1135632701.db2.gz GWRPIHXARIERKT-MRXNPFEDSA-N 1 1 326.400 3.538 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC001197639454 1135722185 /nfs/dbraw/zinc/72/21/85/1135722185.db2.gz QAIKAGYXHPYBHC-CYBMUJFWSA-N 1 1 348.349 3.741 20 5 EHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761690 1135729205 /nfs/dbraw/zinc/72/92/05/1135729205.db2.gz QNAMVDLEQMFLHH-RTBURBONSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1Cl ZINC000809758410 1135887856 /nfs/dbraw/zinc/88/78/56/1135887856.db2.gz MFVUIQLNSTXQAX-UKRRQHHQSA-N 1 1 338.835 3.887 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000809965766 1135904409 /nfs/dbraw/zinc/90/44/09/1135904409.db2.gz OULNSURWTIIPRV-WDEREUQCSA-N 1 1 345.226 3.760 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000776279799 1136133795 /nfs/dbraw/zinc/13/37/95/1136133795.db2.gz XZQHMGCUIUITKC-GOSISDBHSA-N 1 1 342.351 3.517 20 5 EHBDMO Cc1ccc([C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278195 1136133860 /nfs/dbraw/zinc/13/38/60/1136133860.db2.gz SNIKGPBPMFXYHI-RTBURBONSA-N 1 1 326.396 3.774 20 5 EHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000852066243 1136430749 /nfs/dbraw/zinc/43/07/49/1136430749.db2.gz MXBDBMKSLIXGSA-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582931 1136442335 /nfs/dbraw/zinc/44/23/35/1136442335.db2.gz DHHYJAJJTFQEHK-RBUKOAKNSA-N 1 1 326.396 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@H]2Cc2ccccc2)cc1 ZINC000776581260 1136444685 /nfs/dbraw/zinc/44/46/85/1136444685.db2.gz GEQAPSOUFLUXIZ-PMACEKPBSA-N 1 1 340.423 3.725 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597662 1136459389 /nfs/dbraw/zinc/45/93/89/1136459389.db2.gz JRQSRFKYPXMKRF-VLXJIEOASA-N 1 1 344.386 3.775 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3CC2(c2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000852761082 1136483797 /nfs/dbraw/zinc/48/37/97/1136483797.db2.gz GSRGNQPVXYHGCM-UHFFFAOYSA-N 1 1 339.351 3.624 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3CC2(c2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000852761082 1136483801 /nfs/dbraw/zinc/48/38/01/1136483801.db2.gz GSRGNQPVXYHGCM-UHFFFAOYSA-N 1 1 339.351 3.624 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000814641931 1136488529 /nfs/dbraw/zinc/48/85/29/1136488529.db2.gz MGISQZGIWNSWHZ-OAHLLOKOSA-N 1 1 341.367 3.883 20 5 EHBDMO CN(c1ccc(C(F)F)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000853617590 1136549734 /nfs/dbraw/zinc/54/97/34/1136549734.db2.gz GMFDKFMVYGMSMW-FUNVUKJBSA-N 1 1 325.359 3.594 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000853746951 1136560332 /nfs/dbraw/zinc/56/03/32/1136560332.db2.gz MSOIGERZHJOVEY-NSHDSACASA-N 1 1 334.445 3.737 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H](CCO)CC1 ZINC000817296724 1136794221 /nfs/dbraw/zinc/79/42/21/1136794221.db2.gz KFOQKEBOGMDXPF-NSHDSACASA-N 1 1 347.242 3.886 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H](CCO)CC1 ZINC000817296724 1136794224 /nfs/dbraw/zinc/79/42/24/1136794224.db2.gz KFOQKEBOGMDXPF-NSHDSACASA-N 1 1 347.242 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000817365632 1136803819 /nfs/dbraw/zinc/80/38/19/1136803819.db2.gz RDKXCAAJFSCGOV-LLVKDONJSA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000817365632 1136803822 /nfs/dbraw/zinc/80/38/22/1136803822.db2.gz RDKXCAAJFSCGOV-LLVKDONJSA-N 1 1 342.321 3.566 20 5 EHBDMO CC(C)c1ccc([C@H]([NH3+])CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951847 1136851174 /nfs/dbraw/zinc/85/11/74/1136851174.db2.gz BCKFXLQUZIRPPA-SCLBCKFNSA-N 1 1 342.443 3.651 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c(OC)c1 ZINC000859634351 1137023763 /nfs/dbraw/zinc/02/37/63/1137023763.db2.gz YGVWZZKWUUMSRS-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000173480079 1137160077 /nfs/dbraw/zinc/16/00/77/1137160077.db2.gz RXLGMFDNNKOHMP-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](CSc1ccccc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362092 1137215334 /nfs/dbraw/zinc/21/53/34/1137215334.db2.gz XSEZFLYHLCEVTM-KDOFPFPSSA-N 1 1 346.452 3.741 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)ccc1[N+](=O)[O-] ZINC000844439014 1137223033 /nfs/dbraw/zinc/22/30/33/1137223033.db2.gz HKAZSTVOMRKYCA-HNNXBMFYSA-N 1 1 326.343 3.615 20 5 EHBDMO C[C@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000795119018 1137491706 /nfs/dbraw/zinc/49/17/06/1137491706.db2.gz BAROTQSWAZVRAH-ZDUSSCGKSA-N 1 1 337.851 3.554 20 5 EHBDMO CCOc1cc(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001171635692 1137504431 /nfs/dbraw/zinc/50/44/31/1137504431.db2.gz GEZGFJFOHDBRIB-OAHLLOKOSA-N 1 1 348.443 3.917 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)OC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001171635692 1137504433 /nfs/dbraw/zinc/50/44/33/1137504433.db2.gz GEZGFJFOHDBRIB-OAHLLOKOSA-N 1 1 348.443 3.917 20 5 EHBDMO C[NH+]1CCC2(CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)CC1 ZINC000877684126 1137685726 /nfs/dbraw/zinc/68/57/26/1137685726.db2.gz HNLBNNMLCFDVPY-UHFFFAOYSA-N 1 1 337.851 3.556 20 5 EHBDMO C[C@@H]1[C@@H](C)CC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878165123 1137705329 /nfs/dbraw/zinc/70/53/29/1137705329.db2.gz RPXACHOXKHZGFK-VHSXEESVSA-N 1 1 336.779 3.529 20 5 EHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399659 1137714309 /nfs/dbraw/zinc/71/43/09/1137714309.db2.gz PNGCDXXNPJEVBO-FZKQIMNGSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497110 1137717937 /nfs/dbraw/zinc/71/79/37/1137717937.db2.gz QTVGNSHLRMFMIN-AGIUHOORSA-N 1 1 330.388 3.511 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC(C)(C)C1 ZINC000878541795 1137719603 /nfs/dbraw/zinc/71/96/03/1137719603.db2.gz UATMRUCJMXKSDR-LBPRGKRZSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc4c(o3)CCCC4)C2)cc1 ZINC000878677837 1137724799 /nfs/dbraw/zinc/72/47/99/1137724799.db2.gz DXLKPWSDONYLSH-HNNXBMFYSA-N 1 1 341.411 3.841 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4c(o3)CCCC4)C2)cc1 ZINC000878677837 1137724800 /nfs/dbraw/zinc/72/48/00/1137724800.db2.gz DXLKPWSDONYLSH-HNNXBMFYSA-N 1 1 341.411 3.841 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000880053264 1137766813 /nfs/dbraw/zinc/76/68/13/1137766813.db2.gz LAANDGBXACQOOK-BXUZGUMPSA-N 1 1 332.322 3.617 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@H](C(F)(F)F)CC1 ZINC000880053264 1137766814 /nfs/dbraw/zinc/76/68/14/1137766814.db2.gz LAANDGBXACQOOK-BXUZGUMPSA-N 1 1 332.322 3.617 20 5 EHBDMO COc1ccc2oc([C@H](C)[NH2+]Cc3cccnc3[N+](=O)[O-])c(C)c2c1 ZINC000886129847 1138050029 /nfs/dbraw/zinc/05/00/29/1138050029.db2.gz PFBWUPVCNNNUAI-LBPRGKRZSA-N 1 1 341.367 3.904 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2ncccn2)C1 ZINC000886685949 1138115128 /nfs/dbraw/zinc/11/51/28/1138115128.db2.gz HGJWUBWRTKQUAU-HUUCEWRRSA-N 1 1 326.400 3.634 20 5 EHBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000091413233 1138219453 /nfs/dbraw/zinc/21/94/53/1138219453.db2.gz SUQSJWCHIWQBAE-APPDUMDISA-N 1 1 336.338 3.911 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000122436115 1138258368 /nfs/dbraw/zinc/25/83/68/1138258368.db2.gz SQGIVXWCKXMHBU-MRXNPFEDSA-N 1 1 345.355 3.753 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000123078693 1138266033 /nfs/dbraw/zinc/26/60/33/1138266033.db2.gz XWJJRVJVCAPJGK-AGIUHOORSA-N 1 1 330.388 3.684 20 5 EHBDMO CC(C)[N@@H+](C)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264977536 1138692840 /nfs/dbraw/zinc/69/28/40/1138692840.db2.gz SMZUGJAOFYTFFZ-UHFFFAOYSA-N 1 1 348.472 3.538 20 5 EHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccnc(Cl)c3)CC2)cc1 ZINC000174240684 1139407904 /nfs/dbraw/zinc/40/79/04/1139407904.db2.gz MUMSMMNSWSLZDN-UHFFFAOYSA-N 1 1 347.802 3.687 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C2CCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403462 1139831987 /nfs/dbraw/zinc/83/19/87/1139831987.db2.gz WLVXRACUKDAIRG-AWEZNQCLSA-N 1 1 335.448 3.517 20 5 EHBDMO COC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000181436043 1139906757 /nfs/dbraw/zinc/90/67/57/1139906757.db2.gz YJLRUJBXUHHTOM-INIZCTEOSA-N 1 1 336.338 3.659 20 5 EHBDMO CCN(C(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271582818 1141402127 /nfs/dbraw/zinc/40/21/27/1141402127.db2.gz CLHGRDAVVKZEGS-HUUCEWRRSA-N 1 1 341.411 3.687 20 5 EHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275498 1141491891 /nfs/dbraw/zinc/49/18/91/1141491891.db2.gz BYVYDFNBGKKQDA-GJZGRUSLSA-N 1 1 334.416 3.710 20 5 EHBDMO C[C@@H]1[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1(C)C ZINC000536668689 1032066849 /nfs/dbraw/zinc/06/68/49/1032066849.db2.gz JUTNETODAANSRX-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1(C)C ZINC000536668689 1032066866 /nfs/dbraw/zinc/06/68/66/1032066866.db2.gz JUTNETODAANSRX-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000430160273 1014484544 /nfs/dbraw/zinc/48/45/44/1014484544.db2.gz FWIYKJFUIJRHTA-SPQRHKFCSA-N 1 1 330.428 3.747 20 5 EHBDMO COc1cc(CNc2ccc(C3CCC3)c[nH+]2)c([N+](=O)[O-])cc1OC ZINC000339564906 1015000777 /nfs/dbraw/zinc/00/07/77/1015000777.db2.gz RNRQSYMGNFBBDI-UHFFFAOYSA-N 1 1 343.383 3.887 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430219872 1015089601 /nfs/dbraw/zinc/08/96/01/1015089601.db2.gz ODSXFXQTKIQRGJ-GOSISDBHSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1OC ZINC000127056867 1015209565 /nfs/dbraw/zinc/20/95/65/1015209565.db2.gz GNSOKZARYOQXBD-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000134506505 1015573802 /nfs/dbraw/zinc/57/38/02/1015573802.db2.gz ZBYZVIBEMKBAJZ-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000134506505 1015573812 /nfs/dbraw/zinc/57/38/12/1015573812.db2.gz ZBYZVIBEMKBAJZ-QGZVFWFLSA-N 1 1 332.375 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cc1 ZINC000339905526 1015873759 /nfs/dbraw/zinc/87/37/59/1015873759.db2.gz MGMABUBANYZJQR-QGZVFWFLSA-N 1 1 336.395 3.609 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000066696107 1016412937 /nfs/dbraw/zinc/41/29/37/1016412937.db2.gz FSVJFQOYXBYQQM-MRXNPFEDSA-N 1 1 332.425 3.838 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000066696107 1016412944 /nfs/dbraw/zinc/41/29/44/1016412944.db2.gz FSVJFQOYXBYQQM-MRXNPFEDSA-N 1 1 332.425 3.838 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038863 1032264023 /nfs/dbraw/zinc/26/40/23/1032264023.db2.gz UERRIUXWVZNHJE-BEFAXECRSA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038863 1032264033 /nfs/dbraw/zinc/26/40/33/1032264033.db2.gz UERRIUXWVZNHJE-BEFAXECRSA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038863 1032264046 /nfs/dbraw/zinc/26/40/46/1032264046.db2.gz UERRIUXWVZNHJE-BEFAXECRSA-N 1 1 331.460 3.682 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000449453421 1032569992 /nfs/dbraw/zinc/56/99/92/1032569992.db2.gz MVZABNRCWVNIBJ-YDMZIXHMSA-N 1 1 330.428 3.624 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](CO)c1ccccc1 ZINC000449460829 1032577235 /nfs/dbraw/zinc/57/72/35/1032577235.db2.gz ZYNGXDJNWKVRJB-ILCZHQDMSA-N 1 1 326.396 3.664 20 5 EHBDMO CC1(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]CC1 ZINC000414940888 1017338626 /nfs/dbraw/zinc/33/86/26/1017338626.db2.gz KVXAHNXJSKHVNI-UHFFFAOYSA-N 1 1 331.441 3.555 20 5 EHBDMO O=C(C[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000177397433 1017654147 /nfs/dbraw/zinc/65/41/47/1017654147.db2.gz YHKIDCIRQSSIPG-AWEZNQCLSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000177397433 1017654152 /nfs/dbraw/zinc/65/41/52/1017654152.db2.gz YHKIDCIRQSSIPG-AWEZNQCLSA-N 1 1 330.409 3.894 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC[N@H+](C2CCCC2)CC1 ZINC000593461532 1032717884 /nfs/dbraw/zinc/71/78/84/1032717884.db2.gz LPBQQMKBSLORKK-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO CCC[C@H](Cc1ccccc1)[N@@H+](CCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001167306697 1017728500 /nfs/dbraw/zinc/72/85/00/1017728500.db2.gz IGQYRKRDMGHIGH-GOSISDBHSA-N 1 1 344.459 3.952 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)s1 ZINC000103458354 1017854761 /nfs/dbraw/zinc/85/47/61/1017854761.db2.gz UNQLUPQAGPNZST-UHFFFAOYSA-N 1 1 342.424 3.918 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)s1 ZINC000103458354 1017854786 /nfs/dbraw/zinc/85/47/86/1017854786.db2.gz UNQLUPQAGPNZST-UHFFFAOYSA-N 1 1 342.424 3.918 20 5 EHBDMO Cc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)ccc1[N+](=O)[O-] ZINC000278820989 1018501270 /nfs/dbraw/zinc/50/12/70/1018501270.db2.gz JEAGORYNLDZBLX-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000322407061 1019086926 /nfs/dbraw/zinc/08/69/26/1019086926.db2.gz XMEBHTCUMLYYBG-VXGBXAGGSA-N 1 1 329.322 3.652 20 5 EHBDMO COC(=O)c1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513386901 1019595174 /nfs/dbraw/zinc/59/51/74/1019595174.db2.gz RWQNGSLYXACFEW-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO C[C@H]1[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1(C)C ZINC000537624760 1019915687 /nfs/dbraw/zinc/91/56/87/1019915687.db2.gz OZZTVFAVVWRAPB-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1(C)C ZINC000537624760 1019915693 /nfs/dbraw/zinc/91/56/93/1019915693.db2.gz OZZTVFAVVWRAPB-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CC1 ZINC000602441513 1032888736 /nfs/dbraw/zinc/88/87/36/1032888736.db2.gz NXSXRWNLRVMXMH-LLVKDONJSA-N 1 1 334.807 3.707 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CC1 ZINC000602441513 1032888752 /nfs/dbraw/zinc/88/87/52/1032888752.db2.gz NXSXRWNLRVMXMH-LLVKDONJSA-N 1 1 334.807 3.707 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000093870288 1032917323 /nfs/dbraw/zinc/91/73/23/1032917323.db2.gz MSMMPSGWHNIFKM-MRXNPFEDSA-N 1 1 342.443 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610505562 1020868715 /nfs/dbraw/zinc/86/87/15/1020868715.db2.gz PKUINJYQCACINJ-GOSISDBHSA-N 1 1 330.359 3.950 20 5 EHBDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449616944 1032936698 /nfs/dbraw/zinc/93/66/98/1032936698.db2.gz FQFGWOMDRKIMOB-CQSZACIVSA-N 1 1 344.411 3.838 20 5 EHBDMO C[N@@H+](CCc1ccncc1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602608650 1033026673 /nfs/dbraw/zinc/02/66/73/1033026673.db2.gz VEHYDFAJKJXWTC-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccccc1[N+](=O)[O-] ZINC000303804915 1022512406 /nfs/dbraw/zinc/51/24/06/1022512406.db2.gz HKEQZMYNLDXXGI-INIZCTEOSA-N 1 1 325.412 3.696 20 5 EHBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)c1[N+](=O)[O-] ZINC000894581053 1022584989 /nfs/dbraw/zinc/58/49/89/1022584989.db2.gz FUTPMSUQIKUCFM-UHFFFAOYSA-N 1 1 346.358 3.615 20 5 EHBDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602683108 1033082354 /nfs/dbraw/zinc/08/23/54/1033082354.db2.gz IHLDWNGDWSHWMD-CYBMUJFWSA-N 1 1 346.349 3.597 20 5 EHBDMO CC(C)OC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000536348508 1022967088 /nfs/dbraw/zinc/96/70/88/1022967088.db2.gz IZWNAQLZGCZLJD-UHFFFAOYSA-N 1 1 345.399 3.639 20 5 EHBDMO COC(=O)c1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507152440 1023160543 /nfs/dbraw/zinc/16/05/43/1023160543.db2.gz UEGQPPZQUSRGGL-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO COC(=O)c1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507152440 1023160546 /nfs/dbraw/zinc/16/05/46/1023160546.db2.gz UEGQPPZQUSRGGL-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO Cc1cccc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)n21 ZINC000507186519 1023169498 /nfs/dbraw/zinc/16/94/98/1023169498.db2.gz FTQKWIWWWUAPSW-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000536417720 1023240268 /nfs/dbraw/zinc/24/02/68/1023240268.db2.gz XYVZCDZIYCUYPL-CYBMUJFWSA-N 1 1 334.441 3.976 20 5 EHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000610705516 1023276585 /nfs/dbraw/zinc/27/65/85/1023276585.db2.gz RIBLUEHQPADKBV-KRWDZBQOSA-N 1 1 342.395 3.647 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])s2)cc1F ZINC000063254815 1033144307 /nfs/dbraw/zinc/14/43/07/1033144307.db2.gz MUYIPFJQFKQEBA-UHFFFAOYSA-N 1 1 332.360 3.902 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)s1 ZINC000065208837 1023916770 /nfs/dbraw/zinc/91/67/70/1023916770.db2.gz JZXXORFGTRGUQN-UHFFFAOYSA-N 1 1 326.805 3.821 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc2c1CCOC2)C1CC1 ZINC000602796975 1033172426 /nfs/dbraw/zinc/17/24/26/1033172426.db2.gz LEASYKMHMQHCQX-UHFFFAOYSA-N 1 1 338.407 3.832 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2c1CCOC2)C1CC1 ZINC000602796975 1033172440 /nfs/dbraw/zinc/17/24/40/1033172440.db2.gz LEASYKMHMQHCQX-UHFFFAOYSA-N 1 1 338.407 3.832 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000176270086 1023949113 /nfs/dbraw/zinc/94/91/13/1023949113.db2.gz MSIRLEVTEFGLMH-LJQANCHMSA-N 1 1 348.406 3.591 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1F ZINC000895200237 1023959351 /nfs/dbraw/zinc/95/93/51/1023959351.db2.gz PQGOBJHJFPKXKU-CQSZACIVSA-N 1 1 334.347 3.689 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc3ccccc3n2C2CC2)cc1[N+](=O)[O-] ZINC000184772992 1024244104 /nfs/dbraw/zinc/24/41/04/1024244104.db2.gz MAWRXRCDXAZDRK-UHFFFAOYSA-N 1 1 336.395 3.878 20 5 EHBDMO Cc1noc(C2CC[NH+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000091835702 1024411483 /nfs/dbraw/zinc/41/14/83/1024411483.db2.gz AKWCJZKGESBONU-UHFFFAOYSA-N 1 1 344.415 3.789 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883985 1033233467 /nfs/dbraw/zinc/23/34/67/1033233467.db2.gz AFVYLFHFBCOFBK-MRXNPFEDSA-N 1 1 334.379 3.528 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025424237 1024928471 /nfs/dbraw/zinc/92/84/71/1024928471.db2.gz MLAVLXUQLUPQKO-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025424237 1024928483 /nfs/dbraw/zinc/92/84/83/1024928483.db2.gz MLAVLXUQLUPQKO-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO CO[C@H]1CC[C@H](C)[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926392 1024980625 /nfs/dbraw/zinc/98/06/25/1024980625.db2.gz DPJJLVOSBGUPNN-LRDDRELGSA-N 1 1 347.440 3.718 20 5 EHBDMO CO[C@H]1CC[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000895926392 1024980632 /nfs/dbraw/zinc/98/06/32/1024980632.db2.gz DPJJLVOSBGUPNN-LRDDRELGSA-N 1 1 347.440 3.718 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123991 1025034551 /nfs/dbraw/zinc/03/45/51/1025034551.db2.gz SHVSOWIRZUZHPQ-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO CC[C@@H](C)c1nnc([C@@H](C)[NH2+]CC=Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000277436423 1025096023 /nfs/dbraw/zinc/09/60/23/1025096023.db2.gz NZZYEAJBZJLFKI-SKFMMRCFSA-N 1 1 329.404 3.590 20 5 EHBDMO C[C@@H]1CSCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000934303743 1025349085 /nfs/dbraw/zinc/34/90/85/1025349085.db2.gz KWTQFRAHZMRUMH-GFCCVEGCSA-N 1 1 333.413 3.577 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000438996711 1025385180 /nfs/dbraw/zinc/38/51/80/1025385180.db2.gz PPOLSGIVJKGAMM-XCRHUMRWSA-N 1 1 336.407 3.640 20 5 EHBDMO C[C@H]1[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000310399062 1025494364 /nfs/dbraw/zinc/49/43/64/1025494364.db2.gz UBVDILRTWNRYBB-LRDDRELGSA-N 1 1 346.818 3.718 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000443067261 1025684113 /nfs/dbraw/zinc/68/41/13/1025684113.db2.gz FHGZWFYMPSLDEI-KBPBESRZSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000521847965 1025717256 /nfs/dbraw/zinc/71/72/56/1025717256.db2.gz CHPUTPHEIWYELX-ZBFHGGJFSA-N 1 1 340.427 3.514 20 5 EHBDMO C[C@H](C[NH3+])CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414887143 1025864503 /nfs/dbraw/zinc/86/45/03/1025864503.db2.gz YVBCKKDXPDCHMK-GFCCVEGCSA-N 1 1 349.818 3.725 20 5 EHBDMO C[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000530495484 1025945885 /nfs/dbraw/zinc/94/58/85/1025945885.db2.gz QDPZCEGLPGBSJD-QGZVFWFLSA-N 1 1 332.425 3.670 20 5 EHBDMO CCOC(=O)CCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544904 1026092581 /nfs/dbraw/zinc/09/25/81/1026092581.db2.gz GEDVJZGBYYYQFD-INIZCTEOSA-N 1 1 334.416 3.508 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000127647642 1026237017 /nfs/dbraw/zinc/23/70/17/1026237017.db2.gz YPKBDQCXWQOYMG-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127881541 1026600592 /nfs/dbraw/zinc/60/05/92/1026600592.db2.gz IFYAMQOEUQGVSF-OAHLLOKOSA-N 1 1 348.447 3.598 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000531202476 1026684017 /nfs/dbraw/zinc/68/40/17/1026684017.db2.gz ZPWOFXDEQVNEJP-PBHICJAKSA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000078338118 1027686656 /nfs/dbraw/zinc/68/66/56/1027686656.db2.gz YOQVSVIAXRKXSG-BBRMVZONSA-N 1 1 346.456 3.855 20 5 EHBDMO COc1cc(C[NH2+]Cc2c(C)oc3ccccc32)c([N+](=O)[O-])cc1O ZINC000183922161 1027706155 /nfs/dbraw/zinc/70/61/55/1027706155.db2.gz JWNKCCIYOAAOEI-UHFFFAOYSA-N 1 1 342.351 3.653 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](C4CCCC4)C3)n2)cc1 ZINC000420958745 1027928817 /nfs/dbraw/zinc/92/88/17/1027928817.db2.gz CLPIMNJYUZYSMP-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC[C@H](c1ccc(F)cc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496892 1028090639 /nfs/dbraw/zinc/09/06/39/1028090639.db2.gz TUFRHUSGOXDCPR-NVXWUHKLSA-N 1 1 344.390 3.766 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000523332954 1028180519 /nfs/dbraw/zinc/18/05/19/1028180519.db2.gz VHCRJFHGPLOASP-MRXNPFEDSA-N 1 1 347.462 3.848 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H](O)CC34CCC4)o2)c1 ZINC000421380632 1028341741 /nfs/dbraw/zinc/34/17/41/1028341741.db2.gz YQTDKUPWCPRRMS-INIZCTEOSA-N 1 1 342.395 3.734 20 5 EHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]CC1 ZINC000414756657 1028573517 /nfs/dbraw/zinc/57/35/17/1028573517.db2.gz VQXQINJIOAJONV-AWEZNQCLSA-N 1 1 345.468 3.897 20 5 EHBDMO CO[C@@H](C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000583156218 1029039642 /nfs/dbraw/zinc/03/96/42/1029039642.db2.gz MQFAJBAZTNGMKR-IBGZPJMESA-N 1 1 326.396 3.947 20 5 EHBDMO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739817 1029048348 /nfs/dbraw/zinc/04/83/48/1029048348.db2.gz JHNRTGOLNAWXPN-VXGBXAGGSA-N 1 1 336.823 3.606 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533288750 1029580713 /nfs/dbraw/zinc/58/07/13/1029580713.db2.gz YOVUDFKPJKPRIR-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000347387821 1029720390 /nfs/dbraw/zinc/72/03/90/1029720390.db2.gz ZOXCAMRCBVLWBC-GOEBONIOSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000347387821 1029720399 /nfs/dbraw/zinc/72/03/99/1029720399.db2.gz ZOXCAMRCBVLWBC-GOEBONIOSA-N 1 1 344.436 3.596 20 5 EHBDMO CCOc1ccc2c(c1)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000441094293 1029792837 /nfs/dbraw/zinc/79/28/37/1029792837.db2.gz JMYRABPVDWYWNJ-UHFFFAOYSA-N 1 1 326.396 3.594 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000481763716 1029929543 /nfs/dbraw/zinc/92/95/43/1029929543.db2.gz ONNGHFDZOMRNFU-ZYHUDNBSSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)cc1[N+](=O)[O-] ZINC000481763716 1029929557 /nfs/dbraw/zinc/92/95/57/1029929557.db2.gz ONNGHFDZOMRNFU-ZYHUDNBSSA-N 1 1 332.322 3.766 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000525636775 1029987413 /nfs/dbraw/zinc/98/74/13/1029987413.db2.gz LJVIFZZPLRZQQS-KRWDZBQOSA-N 1 1 326.396 3.538 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCc3sccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441250918 1030154490 /nfs/dbraw/zinc/15/44/90/1030154490.db2.gz AYBLORAWNWMANJ-LBPRGKRZSA-N 1 1 348.424 3.663 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])n1 ZINC000159856803 1030386362 /nfs/dbraw/zinc/38/63/62/1030386362.db2.gz VATMLYRYLYDUNS-MRXNPFEDSA-N 1 1 327.384 3.514 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623421 1030793164 /nfs/dbraw/zinc/79/31/64/1030793164.db2.gz AFUFJFGCNGIEKP-IAQYHMDHSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC(C)(C)C1 ZINC000483101600 1030956899 /nfs/dbraw/zinc/95/68/99/1030956899.db2.gz HSJBNQRPOAINQG-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483246059 1031056382 /nfs/dbraw/zinc/05/63/82/1031056382.db2.gz RWIOYWUCQRFFFF-CQSZACIVSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000483631316 1031254437 /nfs/dbraw/zinc/25/44/37/1031254437.db2.gz BFBFSIUMDKPDEM-HNNXBMFYSA-N 1 1 344.411 3.632 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC000611797332 1031288297 /nfs/dbraw/zinc/28/82/97/1031288297.db2.gz UZYDNWKXJSGFCJ-KBPBESRZSA-N 1 1 338.835 3.887 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343559070 1031397674 /nfs/dbraw/zinc/39/76/74/1031397674.db2.gz BMAWNEFCSFKXJG-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(C)c1OC ZINC000594519189 1033425406 /nfs/dbraw/zinc/42/54/06/1033425406.db2.gz FCMAQMXJVHOMTO-UHFFFAOYSA-N 1 1 330.384 3.600 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594603454 1033447838 /nfs/dbraw/zinc/44/78/38/1033447838.db2.gz VJSZVSRQCIOUKG-DOTOQJQBSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccsc1C(F)(F)F ZINC000598962789 1033598087 /nfs/dbraw/zinc/59/80/87/1033598087.db2.gz LHEUHWVQXRJSAX-UHFFFAOYSA-N 1 1 346.330 3.974 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccnc(SC)c1 ZINC000595013033 1033606923 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PIOLWKHWNACIJD-RDTXWAMCSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC000595081036 1033696281 /nfs/dbraw/zinc/69/62/81/1033696281.db2.gz PIOLWKHWNACIJD-RDTXWAMCSA-N 1 1 329.444 3.579 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@]3(CCCc4ccccc43)C2)c1[N+](=O)[O-] ZINC000595339400 1033731190 /nfs/dbraw/zinc/73/11/90/1033731190.db2.gz OBOYBBUZYKGAOE-LJQANCHMSA-N 1 1 341.411 3.761 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599163109 1033780070 /nfs/dbraw/zinc/78/00/70/1033780070.db2.gz AZGHGTWRFOMUSR-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000595383841 1033784290 /nfs/dbraw/zinc/78/42/90/1033784290.db2.gz PFRMYFXSEIGNHP-KRWDZBQOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000595383841 1033784305 /nfs/dbraw/zinc/78/43/05/1033784305.db2.gz PFRMYFXSEIGNHP-KRWDZBQOSA-N 1 1 329.375 3.810 20 5 EHBDMO C[C@H](CCO)[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694701 1033803329 /nfs/dbraw/zinc/80/33/29/1033803329.db2.gz QGXVPDLDYFUOPN-CYBMUJFWSA-N 1 1 348.374 3.729 20 5 EHBDMO CCc1ccc([C@H]2CCC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2)cc1 ZINC000595481782 1033808928 /nfs/dbraw/zinc/80/89/28/1033808928.db2.gz AVXGCRKHHIQODY-INIZCTEOSA-N 1 1 329.400 3.833 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000595526606 1033841830 /nfs/dbraw/zinc/84/18/30/1033841830.db2.gz UWCOBFUTBKKTJB-CVEARBPZSA-N 1 1 334.391 3.515 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1C[C@H]2C[C@H]2C1)[C@H]1CC[C@H](O)CC1 ZINC000595562352 1033844306 /nfs/dbraw/zinc/84/43/06/1033844306.db2.gz ISPOPTKQQMPXAS-UXCMUTLZSA-N 1 1 344.455 3.746 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000595553798 1033858741 /nfs/dbraw/zinc/85/87/41/1033858741.db2.gz NRASDKAVIPHIBQ-QGZVFWFLSA-N 1 1 334.391 3.515 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855099 1033981357 /nfs/dbraw/zinc/98/13/57/1033981357.db2.gz CSSSROPQTXFHNY-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855099 1033981370 /nfs/dbraw/zinc/98/13/70/1033981370.db2.gz CSSSROPQTXFHNY-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677014 1034084543 /nfs/dbraw/zinc/08/45/43/1034084543.db2.gz GEZXEZSPZOTISK-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO CC[N@@H+](CCNc1cc(C)sc1[N+](=O)[O-])CCC(F)(F)F ZINC000596211681 1034119892 /nfs/dbraw/zinc/11/98/92/1034119892.db2.gz YDQUJZFGBTVIKJ-UHFFFAOYSA-N 1 1 325.356 3.651 20 5 EHBDMO Cc1cc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c([N+](=O)[O-])s1 ZINC000596238575 1034131508 /nfs/dbraw/zinc/13/15/08/1034131508.db2.gz OIVMFKRJYSVIFT-UHFFFAOYSA-N 1 1 332.429 3.880 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604013121 1034138046 /nfs/dbraw/zinc/13/80/46/1034138046.db2.gz LZKMCUMGLRLEGW-KRWDZBQOSA-N 1 1 344.386 3.820 20 5 EHBDMO COc1cc(N[C@@H]2CC[N@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336137 1034179025 /nfs/dbraw/zinc/17/90/25/1034179025.db2.gz NAYWQKQIFSODNZ-SNVBAGLBSA-N 1 1 327.812 3.542 20 5 EHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1CCC1CCCCC1 ZINC000534136284 1034182480 /nfs/dbraw/zinc/18/24/80/1034182480.db2.gz BOYLEADRFWXLIW-QGZVFWFLSA-N 1 1 347.459 3.581 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000179394941 1034276388 /nfs/dbraw/zinc/27/63/88/1034276388.db2.gz WZHXLBPFUMNNSY-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397387 1034280319 /nfs/dbraw/zinc/28/03/19/1034280319.db2.gz IVNIQRFEIFZRBQ-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO Cc1ccc(CN[C@H](C)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000310310076 1034315868 /nfs/dbraw/zinc/31/58/68/1034315868.db2.gz SYDBNZJSVOGAQP-MRXNPFEDSA-N 1 1 327.428 3.513 20 5 EHBDMO Cc1ccc(CN[C@H](C)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000310310076 1034315883 /nfs/dbraw/zinc/31/58/83/1034315883.db2.gz SYDBNZJSVOGAQP-MRXNPFEDSA-N 1 1 327.428 3.513 20 5 EHBDMO C[C@H]1CCC[N@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CCO)c1 ZINC000596647170 1034345522 /nfs/dbraw/zinc/34/55/22/1034345522.db2.gz DOBQNGJLPIPZJC-HNNXBMFYSA-N 1 1 340.423 3.781 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC/C=C\c3ccccc3)C2)nc1 ZINC000450556369 1034520074 /nfs/dbraw/zinc/52/00/74/1034520074.db2.gz AVTHHOJQMCSCAH-RLXIPRIJSA-N 1 1 338.411 3.580 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccnn3CC3CC3)C2)cc1 ZINC000597136929 1034557759 /nfs/dbraw/zinc/55/77/59/1034557759.db2.gz CBQCJWARMIQSDH-QGZVFWFLSA-N 1 1 340.427 3.581 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@](O)(C3CC3)C2)o1 ZINC000597206032 1034592482 /nfs/dbraw/zinc/59/24/82/1034592482.db2.gz POFZWIVDHVHUIF-IBGZPJMESA-N 1 1 342.395 3.592 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000548935526 1034996747 /nfs/dbraw/zinc/99/67/47/1034996747.db2.gz NPJNEEFUFFVPRK-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927676 1035078082 /nfs/dbraw/zinc/07/80/82/1035078082.db2.gz SQCFBAMUSNDDLZ-DOTOQJQBSA-N 1 1 332.787 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927676 1035078087 /nfs/dbraw/zinc/07/80/87/1035078087.db2.gz SQCFBAMUSNDDLZ-DOTOQJQBSA-N 1 1 332.787 3.556 20 5 EHBDMO COc1cc(C[N@H+](C)CCOc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463468852 1035536473 /nfs/dbraw/zinc/53/64/73/1035536473.db2.gz HIAQUOKOZUEIHD-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO COc1cc(C[N@@H+](C)CCOc2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463468852 1035536484 /nfs/dbraw/zinc/53/64/84/1035536484.db2.gz HIAQUOKOZUEIHD-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000178053724 1035613945 /nfs/dbraw/zinc/61/39/45/1035613945.db2.gz WRBJVFQARRYNRI-QGZVFWFLSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000178053724 1035613955 /nfs/dbraw/zinc/61/39/55/1035613955.db2.gz WRBJVFQARRYNRI-QGZVFWFLSA-N 1 1 329.375 3.810 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCO1 ZINC000511504783 1035905079 /nfs/dbraw/zinc/90/50/79/1035905079.db2.gz AMEBYCYLYMQKHH-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000464102574 1036125621 /nfs/dbraw/zinc/12/56/21/1036125621.db2.gz BCRNGCWYOVSRTN-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO CCOc1cc(C[N@H+](Cc2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000492776088 1036280699 /nfs/dbraw/zinc/28/06/99/1036280699.db2.gz UDDWWGPBMAPBDS-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000492776088 1036280715 /nfs/dbraw/zinc/28/07/15/1036280715.db2.gz UDDWWGPBMAPBDS-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](COC)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492776070 1036281454 /nfs/dbraw/zinc/28/14/54/1036281454.db2.gz TYZYJYFGYNSHMH-INIZCTEOSA-N 1 1 348.374 3.610 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000026224067 1036394213 /nfs/dbraw/zinc/39/42/13/1036394213.db2.gz MJUMXTVZNBMEOX-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000026226302 1036418410 /nfs/dbraw/zinc/41/84/10/1036418410.db2.gz YZHBCFZVTKKYET-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133524 1036566846 /nfs/dbraw/zinc/56/68/46/1036566846.db2.gz DXBGFJMOFRBVPT-LBPRGKRZSA-N 1 1 342.342 3.579 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000152411610 1036597077 /nfs/dbraw/zinc/59/70/77/1036597077.db2.gz DGGCNARREVOJIK-HNNXBMFYSA-N 1 1 349.475 3.940 20 5 EHBDMO Cc1ccc([C@H](O)C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000174709957 1036615660 /nfs/dbraw/zinc/61/56/60/1036615660.db2.gz OXOQQNWJKIQPGN-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO Cc1ccc([C@H](O)C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000174709957 1036615666 /nfs/dbraw/zinc/61/56/66/1036615666.db2.gz OXOQQNWJKIQPGN-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000237675199 1036852431 /nfs/dbraw/zinc/85/24/31/1036852431.db2.gz VBXYIYBWMWBLBH-CYBMUJFWSA-N 1 1 325.840 3.602 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000443663761 1036976531 /nfs/dbraw/zinc/97/65/31/1036976531.db2.gz YVLVVXCRERNYMZ-KGLIPLIRSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC(C)(C)C[C@H]1C ZINC000412031153 1036991375 /nfs/dbraw/zinc/99/13/75/1036991375.db2.gz AMUPJCXCPXKGKX-NEPJUHHUSA-N 1 1 330.388 3.826 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539820977 1037243213 /nfs/dbraw/zinc/24/32/13/1037243213.db2.gz TZVWITFZARBKCS-AWEZNQCLSA-N 1 1 330.432 3.863 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)o1 ZINC000539891721 1037314988 /nfs/dbraw/zinc/31/49/88/1037314988.db2.gz ZJAGFPLPTUJVIX-YOEHRIQHSA-N 1 1 342.395 3.856 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@@H]2CC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601346 1037486551 /nfs/dbraw/zinc/48/65/51/1037486551.db2.gz BOXHHPOAESDGLA-GOEBONIOSA-N 1 1 336.432 3.631 20 5 EHBDMO CC[N@@H+](CCC1CC1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883250 1037553582 /nfs/dbraw/zinc/55/35/82/1037553582.db2.gz BCSWVQAHHDNSMV-NSHDSACASA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000290515051 1037829164 /nfs/dbraw/zinc/82/91/64/1037829164.db2.gz PUUPRLWNQGZQES-MRXNPFEDSA-N 1 1 349.456 3.557 20 5 EHBDMO CCOc1cc(C[NH2+]C2(c3ccccc3OC)CC2)ccc1[N+](=O)[O-] ZINC000592145240 1037866268 /nfs/dbraw/zinc/86/62/68/1037866268.db2.gz SQXLMRZHROYEBL-UHFFFAOYSA-N 1 1 342.395 3.781 20 5 EHBDMO C[C@@H](NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395494 1037939434 /nfs/dbraw/zinc/93/94/34/1037939434.db2.gz CLFCZSMZUUSPLT-ZTNFWEORSA-N 1 1 339.439 3.591 20 5 EHBDMO C[C@@H](NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395494 1037939446 /nfs/dbraw/zinc/93/94/46/1037939446.db2.gz CLFCZSMZUUSPLT-ZTNFWEORSA-N 1 1 339.439 3.591 20 5 EHBDMO CCC1CCC([N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C2CC2)CC1 ZINC000053169652 1037941810 /nfs/dbraw/zinc/94/18/10/1037941810.db2.gz USTRLUGOHKITEW-UHFFFAOYSA-N 1 1 345.443 3.627 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198794 1037943582 /nfs/dbraw/zinc/94/35/82/1037943582.db2.gz VEMHYIQHBODJLP-KRWDZBQOSA-N 1 1 332.400 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@H]3C3CCC3)o2)cc1 ZINC000592198765 1037943919 /nfs/dbraw/zinc/94/39/19/1037943919.db2.gz SGJFKDBSDBHXHL-INIZCTEOSA-N 1 1 342.399 3.799 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592529432 1038028571 /nfs/dbraw/zinc/02/85/71/1038028571.db2.gz ZIRDBJVHHPMVQO-DDITZMBXSA-N 1 1 330.428 3.889 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1 ZINC000532643398 1038213500 /nfs/dbraw/zinc/21/35/00/1038213500.db2.gz CXGHBKHRLTVCHF-UHFFFAOYSA-N 1 1 348.406 3.803 20 5 EHBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123758 1038359982 /nfs/dbraw/zinc/35/99/82/1038359982.db2.gz JOZUNRCOLRYLMO-DGCLKSJQSA-N 1 1 346.349 3.597 20 5 EHBDMO C[Si](C)(C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC001167733754 1038367959 /nfs/dbraw/zinc/36/79/59/1038367959.db2.gz CHEGVQWGUNVPLF-UHFFFAOYSA-N 1 1 340.499 3.714 20 5 EHBDMO C[C@H]1CCN(C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739851 1038504282 /nfs/dbraw/zinc/50/42/82/1038504282.db2.gz NRWLYCVRFHPQIN-AWEZNQCLSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@H]1CC[N@H+](C)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739851 1038504298 /nfs/dbraw/zinc/50/42/98/1038504298.db2.gz NRWLYCVRFHPQIN-AWEZNQCLSA-N 1 1 345.468 3.849 20 5 EHBDMO C[C@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739851 1038504307 /nfs/dbraw/zinc/50/43/07/1038504307.db2.gz NRWLYCVRFHPQIN-AWEZNQCLSA-N 1 1 345.468 3.849 20 5 EHBDMO CCOc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000015293042 1039088382 /nfs/dbraw/zinc/08/83/82/1039088382.db2.gz NNGGZSQNITZNIR-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000015293042 1039088401 /nfs/dbraw/zinc/08/84/01/1039088401.db2.gz NNGGZSQNITZNIR-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432786701 1039188185 /nfs/dbraw/zinc/18/81/85/1039188185.db2.gz DOCUPYAYQPJKNN-LLVKDONJSA-N 1 1 326.343 3.961 20 5 EHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Cl)c(Cl)c1 ZINC000478424268 1039445527 /nfs/dbraw/zinc/44/55/27/1039445527.db2.gz DACBECVLIVEIDU-UHFFFAOYSA-N 1 1 343.214 3.620 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128182296 1039458225 /nfs/dbraw/zinc/45/82/25/1039458225.db2.gz WIQHNOSVHOTQFU-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000488897225 1039463010 /nfs/dbraw/zinc/46/30/10/1039463010.db2.gz MNXMIICPPIKLRL-ZDUSSCGKSA-N 1 1 346.818 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328262 1039672702 /nfs/dbraw/zinc/67/27/02/1039672702.db2.gz SFFPXTDINIHVMQ-JTDSTZFVSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CC[N@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328262 1039672704 /nfs/dbraw/zinc/67/27/04/1039672704.db2.gz SFFPXTDINIHVMQ-JTDSTZFVSA-N 1 1 329.444 3.579 20 5 EHBDMO C[C@@H](c1cccc(Nc2c(F)cccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000553034042 1039720470 /nfs/dbraw/zinc/72/04/70/1039720470.db2.gz RFCHJMNJEUTPSS-ZDUSSCGKSA-N 1 1 345.374 3.871 20 5 EHBDMO CCOc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000894082028 1040037423 /nfs/dbraw/zinc/03/74/23/1040037423.db2.gz OAEFGMVHAQTYEU-UHFFFAOYSA-N 1 1 344.289 3.895 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCOc2ccccc2F)C2CC2)c1 ZINC000490043415 1040318021 /nfs/dbraw/zinc/31/80/21/1040318021.db2.gz QBWDHRWULWJQGK-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1 ZINC000027588850 1040700499 /nfs/dbraw/zinc/70/04/99/1040700499.db2.gz XNDKLLHUEAFGDR-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1 ZINC000027588850 1040700509 /nfs/dbraw/zinc/70/05/09/1040700509.db2.gz XNDKLLHUEAFGDR-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000182279117 1040771010 /nfs/dbraw/zinc/77/10/10/1040771010.db2.gz UUWQADNHVOSOKZ-SNVBAGLBSA-N 1 1 334.759 3.828 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000311199279 1040832714 /nfs/dbraw/zinc/83/27/14/1040832714.db2.gz JQLUJGYFYYDNDL-IBGZPJMESA-N 1 1 340.427 3.622 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000491066964 1040899457 /nfs/dbraw/zinc/89/94/57/1040899457.db2.gz PLBQAZWULQPQLD-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])c2cnccc12)Cc1ccccc1 ZINC000053582859 1040915617 /nfs/dbraw/zinc/91/56/17/1040915617.db2.gz NCYONHCIZOAMBF-UHFFFAOYSA-N 1 1 336.395 3.687 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](c1ccccc1)C1(CO)CCC1 ZINC000433321154 1041279194 /nfs/dbraw/zinc/27/91/94/1041279194.db2.gz NEBHTPCMGRLDPW-SFHVURJKSA-N 1 1 344.386 3.727 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)c(F)c1 ZINC000481708350 1041288243 /nfs/dbraw/zinc/28/82/43/1041288243.db2.gz AWUSZONRWXHFEU-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c(F)c1 ZINC000481708350 1041288255 /nfs/dbraw/zinc/28/82/55/1041288255.db2.gz AWUSZONRWXHFEU-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507293 1041394756 /nfs/dbraw/zinc/39/47/56/1041394756.db2.gz BDSDDNUMFNHJTO-JTQLQIEISA-N 1 1 329.322 3.571 20 5 EHBDMO COc1cc(C[N@@H+]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093460322 1042315774 /nfs/dbraw/zinc/31/57/74/1042315774.db2.gz ZNKKKJPLYBOINM-UHFFFAOYSA-N 1 1 348.321 3.529 20 5 EHBDMO COc1cc(C[N@H+]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093460322 1042315777 /nfs/dbraw/zinc/31/57/77/1042315777.db2.gz ZNKKKJPLYBOINM-UHFFFAOYSA-N 1 1 348.321 3.529 20 5 EHBDMO Cc1cc(C[C@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000279114933 1043372984 /nfs/dbraw/zinc/37/29/84/1043372984.db2.gz PMSDKPHVTNPSSR-GTNSWQLSSA-N 1 1 328.416 3.570 20 5 EHBDMO COC(=O)c1ccc(Cl)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000182110604 1043722153 /nfs/dbraw/zinc/72/21/53/1043722153.db2.gz DUWRSYUJQFWZLK-LLVKDONJSA-N 1 1 348.786 3.886 20 5 EHBDMO C[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C(C1CC1)C1CC1 ZINC000728900667 1043786039 /nfs/dbraw/zinc/78/60/39/1043786039.db2.gz OMWQXXCLEASQAN-UHFFFAOYSA-N 1 1 326.400 3.536 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c2ncccc12 ZINC000301404587 1127742145 /nfs/dbraw/zinc/74/21/45/1127742145.db2.gz SSEKZXRKSRNZFI-CYBMUJFWSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571447 1128105062 /nfs/dbraw/zinc/10/50/62/1128105062.db2.gz REQQJRMIDGTPNJ-QWRGUYRKSA-N 1 1 344.358 3.683 20 5 EHBDMO CC(=O)c1cc(NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553297684 1128406106 /nfs/dbraw/zinc/40/61/06/1128406106.db2.gz HIAUHYGASVKTMT-OKILXGFUSA-N 1 1 333.432 3.577 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1 ZINC000326686163 1128430199 /nfs/dbraw/zinc/43/01/99/1128430199.db2.gz IUXMHICALQSZCN-OTWHNJEPSA-N 1 1 332.444 3.543 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000027557527 1128483566 /nfs/dbraw/zinc/48/35/66/1128483566.db2.gz CMRKXCPSKBMOCN-CYBMUJFWSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000027557527 1128483570 /nfs/dbraw/zinc/48/35/70/1128483570.db2.gz CMRKXCPSKBMOCN-CYBMUJFWSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000198098237 1128640234 /nfs/dbraw/zinc/64/02/34/1128640234.db2.gz MYZGHFZOGBLKPN-CYBMUJFWSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000198098237 1128640235 /nfs/dbraw/zinc/64/02/35/1128640235.db2.gz MYZGHFZOGBLKPN-CYBMUJFWSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c(C)n2)cc1F ZINC000301634745 1128777069 /nfs/dbraw/zinc/77/70/69/1128777069.db2.gz KLJKYFFUFQVJOO-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO Cc1nc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651004 1128849494 /nfs/dbraw/zinc/84/94/94/1128849494.db2.gz JUODLXGCXRDQAN-DYVFJYSZSA-N 1 1 346.456 3.855 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542929756 1128855881 /nfs/dbraw/zinc/85/58/81/1128855881.db2.gz GYBBSAGJJOBKQV-AWEZNQCLSA-N 1 1 325.840 3.554 20 5 EHBDMO CC1(C)CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000609196395 1120544324 /nfs/dbraw/zinc/54/43/24/1120544324.db2.gz OGALGCRUCWIJKB-UHFFFAOYSA-N 1 1 345.468 3.753 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301057352 1121203240 /nfs/dbraw/zinc/20/32/40/1121203240.db2.gz BBYYIQWOAXWXMS-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC000193508019 1121371884 /nfs/dbraw/zinc/37/18/84/1121371884.db2.gz CYSOSXMHXFKUOK-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC000193508019 1121371894 /nfs/dbraw/zinc/37/18/94/1121371894.db2.gz CYSOSXMHXFKUOK-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000487980431 1121423727 /nfs/dbraw/zinc/42/37/27/1121423727.db2.gz LDILULHGNGUCOP-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000487980431 1121423729 /nfs/dbraw/zinc/42/37/29/1121423729.db2.gz LDILULHGNGUCOP-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1 ZINC000609234516 1121859691 /nfs/dbraw/zinc/85/96/91/1121859691.db2.gz TXCICFYAXWBQJH-LJQANCHMSA-N 1 1 326.396 3.601 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2OC(C)C)cc1[N+](=O)[O-] ZINC000324618889 1121946010 /nfs/dbraw/zinc/94/60/10/1121946010.db2.gz QUFKASMROHIPSG-CQSZACIVSA-N 1 1 329.400 3.936 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000301189935 1122321067 /nfs/dbraw/zinc/32/10/67/1122321067.db2.gz LURSTZFXMPVHLG-UHFFFAOYSA-N 1 1 340.427 3.547 20 5 EHBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154339666 1122564534 /nfs/dbraw/zinc/56/45/34/1122564534.db2.gz XMVIHCHCPFVECL-MDYRTPRTSA-N 1 1 340.423 3.815 20 5 EHBDMO CC1CCC([N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C2CC2)CC1 ZINC000917438428 1122602507 /nfs/dbraw/zinc/60/25/07/1122602507.db2.gz QIFMFGMUOICDPM-UHFFFAOYSA-N 1 1 328.416 3.945 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917454074 1122611152 /nfs/dbraw/zinc/61/11/52/1122611152.db2.gz HNKPORXRMHVWPY-UHFFFAOYSA-N 1 1 331.420 3.569 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3CF)o2)c([N+](=O)[O-])c1 ZINC000556950616 1123230272 /nfs/dbraw/zinc/23/02/72/1123230272.db2.gz GZMKIMHQQSZLOZ-LBPRGKRZSA-N 1 1 334.347 3.797 20 5 EHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3CF)o2)c([N+](=O)[O-])c1 ZINC000556950616 1123230274 /nfs/dbraw/zinc/23/02/74/1123230274.db2.gz GZMKIMHQQSZLOZ-LBPRGKRZSA-N 1 1 334.347 3.797 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000556968288 1123244772 /nfs/dbraw/zinc/24/47/72/1123244772.db2.gz YMYIGSIJUWXSHC-CRYBKOLWSA-N 1 1 328.412 3.642 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000556968288 1123244777 /nfs/dbraw/zinc/24/47/77/1123244777.db2.gz YMYIGSIJUWXSHC-CRYBKOLWSA-N 1 1 328.412 3.642 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609625622 1123627940 /nfs/dbraw/zinc/62/79/40/1123627940.db2.gz CXKDLVUASJAOFQ-KRWDZBQOSA-N 1 1 326.396 3.983 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000114494586 1129152386 /nfs/dbraw/zinc/15/23/86/1129152386.db2.gz YOWJKMFTCGJXMQ-IBGZPJMESA-N 1 1 343.427 3.664 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000114494586 1129152388 /nfs/dbraw/zinc/15/23/88/1129152388.db2.gz YOWJKMFTCGJXMQ-IBGZPJMESA-N 1 1 343.427 3.664 20 5 EHBDMO CN(C)c1nc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000618984974 1125256927 /nfs/dbraw/zinc/25/69/27/1125256927.db2.gz URRDWXYMZCMPNF-HNNXBMFYSA-N 1 1 346.456 3.630 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000446843445 1125334980 /nfs/dbraw/zinc/33/49/80/1125334980.db2.gz NNLUWKOSCRDPHK-JBXOJTMHSA-N 1 1 340.427 3.611 20 5 EHBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687114 1129180694 /nfs/dbraw/zinc/18/06/94/1129180694.db2.gz SBJSPKZBTVGACV-HWYHOQROSA-N 1 1 346.427 3.663 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894154 1129290969 /nfs/dbraw/zinc/29/09/69/1129290969.db2.gz WWEOAMCRNSXCSQ-WMLDXEAASA-N 1 1 346.818 3.809 20 5 EHBDMO CC(C)OCCC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000265840338 1129363494 /nfs/dbraw/zinc/36/34/94/1129363494.db2.gz GANIEMNYZZGMAJ-UHFFFAOYSA-N 1 1 347.415 3.539 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000069063751 1129419780 /nfs/dbraw/zinc/41/97/80/1129419780.db2.gz GXZHICVHUDNBNK-NWDGAFQWSA-N 1 1 347.802 3.926 20 5 EHBDMO O=[N+]([O-])c1ccsc1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301974780 1129466043 /nfs/dbraw/zinc/46/60/43/1129466043.db2.gz BBSLKGWBCGOOFQ-OAHLLOKOSA-N 1 1 331.441 3.633 20 5 EHBDMO CCN(CC)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000393178416 1129737803 /nfs/dbraw/zinc/73/78/03/1129737803.db2.gz SECTUPWONDWFOS-LJQANCHMSA-N 1 1 345.418 3.907 20 5 EHBDMO COc1cc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000347778502 1129749466 /nfs/dbraw/zinc/74/94/66/1129749466.db2.gz DORDLMLZTDNABW-OAHLLOKOSA-N 1 1 333.413 3.609 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000302159533 1129770821 /nfs/dbraw/zinc/77/08/21/1129770821.db2.gz ONNNCLCCSKJVNR-ZDUSSCGKSA-N 1 1 327.388 3.503 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1 ZINC000304785579 1129902143 /nfs/dbraw/zinc/90/21/43/1129902143.db2.gz OKOPZWXTGXKPDX-GDBMZVCRSA-N 1 1 332.425 3.744 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)cs1 ZINC000173985025 1130327749 /nfs/dbraw/zinc/32/77/49/1130327749.db2.gz GDADBKFBDACWIW-HNNXBMFYSA-N 1 1 332.425 3.695 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000245923006 1130332161 /nfs/dbraw/zinc/33/21/61/1130332161.db2.gz OEWLRVLEYBEWHV-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000245923006 1130332167 /nfs/dbraw/zinc/33/21/67/1130332167.db2.gz OEWLRVLEYBEWHV-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174200804 1130340714 /nfs/dbraw/zinc/34/07/14/1130340714.db2.gz AXDGODWIZOQRKZ-QGZVFWFLSA-N 1 1 330.388 3.657 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)c1 ZINC000174878150 1130389890 /nfs/dbraw/zinc/38/98/90/1130389890.db2.gz KVFZCBRWCCSRSM-HXUWFJFHSA-N 1 1 348.406 3.591 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209174 1130898174 /nfs/dbraw/zinc/89/81/74/1130898174.db2.gz JQVPMXOVOWKHQH-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000732209174 1130898181 /nfs/dbraw/zinc/89/81/81/1130898181.db2.gz JQVPMXOVOWKHQH-VCBZYWHSSA-N 1 1 326.396 3.945 20 5 EHBDMO COc1cc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000347963416 1131106613 /nfs/dbraw/zinc/10/66/13/1131106613.db2.gz PCYYTJWKQOTPAZ-OAHLLOKOSA-N 1 1 333.413 3.609 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000740881338 1131553204 /nfs/dbraw/zinc/55/32/04/1131553204.db2.gz AJXPUBJYJHEEDN-OCCSQVGLSA-N 1 1 325.840 3.553 20 5 EHBDMO COc1ccccc1C[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908358 1131888460 /nfs/dbraw/zinc/88/84/60/1131888460.db2.gz CGTKGFPCPUMYKD-SFHVURJKSA-N 1 1 340.423 3.983 20 5 EHBDMO COCC[C@H]1CCCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914776 1131903257 /nfs/dbraw/zinc/90/32/57/1131903257.db2.gz ISFWITFZGABKJF-QZTJIDSGSA-N 1 1 332.444 3.733 20 5 EHBDMO CCC[N@@H+](C1CCOCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922587 1131906873 /nfs/dbraw/zinc/90/68/73/1131906873.db2.gz YYFRTNICJWEKKV-QGZVFWFLSA-N 1 1 332.444 3.733 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001173181903 1131993325 /nfs/dbraw/zinc/99/33/25/1131993325.db2.gz QGBRFVHCPJKKPB-SJKOYZFVSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@@](C)(F)C2)c1F ZINC001173181903 1131993331 /nfs/dbraw/zinc/99/33/31/1131993331.db2.gz QGBRFVHCPJKKPB-SJKOYZFVSA-N 1 1 342.386 3.888 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cnc(Cl)s1 ZINC001173224351 1132005317 /nfs/dbraw/zinc/00/53/17/1132005317.db2.gz DWOVPAMMJBMARF-SNVBAGLBSA-N 1 1 325.821 3.768 20 5 EHBDMO CCC[N@H+](Cc1ccc(F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746034536 1132351349 /nfs/dbraw/zinc/35/13/49/1132351349.db2.gz UHVKJXUNEZNVKZ-UHFFFAOYSA-N 1 1 342.374 3.953 20 5 EHBDMO CN(c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000746391176 1132507130 /nfs/dbraw/zinc/50/71/30/1132507130.db2.gz ZKUBBCOMKVOUQV-LJQANCHMSA-N 1 1 325.412 3.696 20 5 EHBDMO CCC(CC)CCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001174949218 1132515595 /nfs/dbraw/zinc/51/55/95/1132515595.db2.gz WBOYMOOPBHFWCV-UHFFFAOYSA-N 1 1 335.448 3.990 20 5 EHBDMO Cc1ccccc1[C@@H](C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001175015007 1132530148 /nfs/dbraw/zinc/53/01/48/1132530148.db2.gz HIHRQWMAIIVLMQ-CYBMUJFWSA-N 1 1 338.367 3.804 20 5 EHBDMO Cc1c(C[N@H+]2CCN(c3ccccc3F)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC001169927329 1132906092 /nfs/dbraw/zinc/90/60/92/1132906092.db2.gz FFRZYGNSOSGIOH-AWEZNQCLSA-N 1 1 343.402 3.753 20 5 EHBDMO Cc1c(C[N@@H+]2CCN(c3ccccc3F)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC001169927329 1132906098 /nfs/dbraw/zinc/90/60/98/1132906098.db2.gz FFRZYGNSOSGIOH-AWEZNQCLSA-N 1 1 343.402 3.753 20 5 EHBDMO CCCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1c(C)oc(C)c1C ZINC001176364866 1132922716 /nfs/dbraw/zinc/92/27/16/1132922716.db2.gz IBOFVOFMXPKANA-UHFFFAOYSA-N 1 1 334.420 3.612 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000804351540 1132985010 /nfs/dbraw/zinc/98/50/10/1132985010.db2.gz BYPNHNBQJLPXNV-CQSZACIVSA-N 1 1 333.432 3.721 20 5 EHBDMO C[C@H]1CSCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001176827732 1133002423 /nfs/dbraw/zinc/00/24/23/1133002423.db2.gz HYYNCHZCYZMLJZ-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@H]1CSCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001176827732 1133002426 /nfs/dbraw/zinc/00/24/26/1133002426.db2.gz HYYNCHZCYZMLJZ-JTQLQIEISA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@@H]1CSCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001176827733 1133002605 /nfs/dbraw/zinc/00/26/05/1133002605.db2.gz HYYNCHZCYZMLJZ-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO C[C@@H]1CSCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001176827733 1133002612 /nfs/dbraw/zinc/00/26/12/1133002612.db2.gz HYYNCHZCYZMLJZ-SNVBAGLBSA-N 1 1 334.363 3.941 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773667048 1133064465 /nfs/dbraw/zinc/06/44/65/1133064465.db2.gz KLKZNJZTWWGKMP-UHFFFAOYSA-N 1 1 329.787 3.933 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773667048 1133064467 /nfs/dbraw/zinc/06/44/67/1133064467.db2.gz KLKZNJZTWWGKMP-UHFFFAOYSA-N 1 1 329.787 3.933 20 5 EHBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936026 1133072402 /nfs/dbraw/zinc/07/24/02/1133072402.db2.gz OJGMATXFUBRMSZ-UXHICEINSA-N 1 1 340.423 3.725 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246257 1133250704 /nfs/dbraw/zinc/25/07/04/1133250704.db2.gz YOWMXNWIGUYFLE-UYAOXDASSA-N 1 1 340.423 3.991 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(C)(C)Oc1ccccc1 ZINC001181154981 1133460703 /nfs/dbraw/zinc/46/07/03/1133460703.db2.gz XOKHHUXHTRCHDJ-UHFFFAOYSA-N 1 1 328.412 3.927 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000746672036 1133990814 /nfs/dbraw/zinc/99/08/14/1133990814.db2.gz FAAFRPDYJFNKTA-MRXNPFEDSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000746672036 1133990816 /nfs/dbraw/zinc/99/08/16/1133990816.db2.gz FAAFRPDYJFNKTA-MRXNPFEDSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826211 1134026824 /nfs/dbraw/zinc/02/68/24/1134026824.db2.gz LYFBRKSBJYRBIJ-MRXNPFEDSA-N 1 1 341.367 3.710 20 5 EHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907257 1134115685 /nfs/dbraw/zinc/11/56/85/1134115685.db2.gz GHVBJHIXGZQUFS-GUYCJALGSA-N 1 1 341.367 3.881 20 5 EHBDMO COc1nsc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1Cl ZINC001203665274 1134356708 /nfs/dbraw/zinc/35/67/08/1134356708.db2.gz KQYNORWVAPEDDQ-QMMMGPOBSA-N 1 1 327.793 3.564 20 5 EHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000747077154 1134694351 /nfs/dbraw/zinc/69/43/51/1134694351.db2.gz RVLPNQYTWZXNIE-INIZCTEOSA-N 1 1 343.431 3.711 20 5 EHBDMO COC(=O)c1csc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC001190529289 1134712723 /nfs/dbraw/zinc/71/27/23/1134712723.db2.gz QSYKVCLQOHZJPC-UHFFFAOYSA-N 1 1 348.424 3.854 20 5 EHBDMO COC(=O)c1csc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC001190529289 1134712726 /nfs/dbraw/zinc/71/27/26/1134712726.db2.gz QSYKVCLQOHZJPC-UHFFFAOYSA-N 1 1 348.424 3.854 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344942 1134758889 /nfs/dbraw/zinc/75/88/89/1134758889.db2.gz FSOCCLMTBDCXFX-DGCLKSJQSA-N 1 1 328.359 3.512 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170347091 1134759491 /nfs/dbraw/zinc/75/94/91/1134759491.db2.gz QCDNSUIFYCCBNI-OAHLLOKOSA-N 1 1 340.423 3.983 20 5 EHBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204366 1134815248 /nfs/dbraw/zinc/81/52/48/1134815248.db2.gz SQTXHELUKBAAOM-ZBFHGGJFSA-N 1 1 326.824 3.884 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@@H+](C1CCCC1)CC2 ZINC000792913084 1134824153 /nfs/dbraw/zinc/82/41/53/1134824153.db2.gz LDKSSHIWJMSCOZ-UHFFFAOYSA-N 1 1 325.206 3.658 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c2c1C[N@H+](C1CCCC1)CC2 ZINC000792913084 1134824159 /nfs/dbraw/zinc/82/41/59/1134824159.db2.gz LDKSSHIWJMSCOZ-UHFFFAOYSA-N 1 1 325.206 3.658 20 5 EHBDMO COCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC001193974791 1135208261 /nfs/dbraw/zinc/20/82/61/1135208261.db2.gz CKHAOLVFLRTEFN-WFASDCNBSA-N 1 1 326.824 3.885 20 5 EHBDMO CC[C@H]1C[N@@H+](CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325122 1135257035 /nfs/dbraw/zinc/25/70/35/1135257035.db2.gz QCTLGZVJTYAVNA-ZDUSSCGKSA-N 1 1 345.365 3.530 20 5 EHBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834344 1135332618 /nfs/dbraw/zinc/33/26/18/1135332618.db2.gz FWOAMEDKWYVDSD-ROUUACIJSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC001195305312 1135410194 /nfs/dbraw/zinc/41/01/94/1135410194.db2.gz BOJPSZNUJBIURB-MRXNPFEDSA-N 1 1 345.443 3.744 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@](C)(c2cccc(F)c2)C1 ZINC001195851590 1135475480 /nfs/dbraw/zinc/47/54/80/1135475480.db2.gz LQBBESJWKNJXLI-LJQANCHMSA-N 1 1 344.386 3.906 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000807916041 1135589178 /nfs/dbraw/zinc/58/91/78/1135589178.db2.gz KXMVLDLMOUKFQK-QGZVFWFLSA-N 1 1 343.383 3.639 20 5 EHBDMO CC(C)([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000766920383 1135809908 /nfs/dbraw/zinc/80/99/08/1135809908.db2.gz OXVXIDHBCHSRQX-UHFFFAOYSA-N 1 1 347.802 3.755 20 5 EHBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809982044 1135908643 /nfs/dbraw/zinc/90/86/43/1135908643.db2.gz GLAQYVQLRMOKCL-BMIGLBTASA-N 1 1 347.242 3.885 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000810011196 1135914019 /nfs/dbraw/zinc/91/40/19/1135914019.db2.gz GGOFQZRIKBOYLA-HNNXBMFYSA-N 1 1 345.226 3.904 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000810011196 1135914023 /nfs/dbraw/zinc/91/40/23/1135914023.db2.gz GGOFQZRIKBOYLA-HNNXBMFYSA-N 1 1 345.226 3.904 20 5 EHBDMO CCCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000810125323 1135923939 /nfs/dbraw/zinc/92/39/39/1135923939.db2.gz UAZLBYOOLZEISB-GFCCVEGCSA-N 1 1 325.384 3.573 20 5 EHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277950 1136131000 /nfs/dbraw/zinc/13/10/00/1136131000.db2.gz RCXCWRVQXBIEEE-MOPGFXCFSA-N 1 1 326.396 3.774 20 5 EHBDMO CC(C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)=C1CCCC1 ZINC000813173310 1136298025 /nfs/dbraw/zinc/29/80/25/1136298025.db2.gz YOJBWBDAOGNARA-SFHVURJKSA-N 1 1 344.411 3.603 20 5 EHBDMO CC(C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)=C1CCCC1 ZINC000813173310 1136298029 /nfs/dbraw/zinc/29/80/29/1136298029.db2.gz YOJBWBDAOGNARA-SFHVURJKSA-N 1 1 344.411 3.603 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC([C@H](O)c2ccccc2)CC1 ZINC000851719548 1136401210 /nfs/dbraw/zinc/40/12/10/1136401210.db2.gz MLACXFNWWWUXOS-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583164 1136441935 /nfs/dbraw/zinc/44/19/35/1136441935.db2.gz YPNOSGWVYQUSKZ-ROUUACIJSA-N 1 1 348.349 3.744 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583102 1136441986 /nfs/dbraw/zinc/44/19/86/1136441986.db2.gz WJNYXEAIAMOZGM-CRAIPNDOSA-N 1 1 346.814 3.771 20 5 EHBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579237 1136444162 /nfs/dbraw/zinc/44/41/62/1136444162.db2.gz KAYKLDLKDFZHPI-DNVCBOLYSA-N 1 1 328.412 3.929 20 5 EHBDMO CCC[N@H+](Cc1ccc(OC)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580010 1136444625 /nfs/dbraw/zinc/44/46/25/1136444625.db2.gz QLDZYKZRYACGCZ-LJQANCHMSA-N 1 1 344.411 3.549 20 5 EHBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000776579578 1136444909 /nfs/dbraw/zinc/44/49/09/1136444909.db2.gz NRNUGIQQOYBPDW-AUUYWEPGSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1ccc(C(C)(C)C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776586920 1136449667 /nfs/dbraw/zinc/44/96/67/1136449667.db2.gz AJAXYPYTNQVEMC-LJQANCHMSA-N 1 1 342.439 3.846 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000852724737 1136480316 /nfs/dbraw/zinc/48/03/16/1136480316.db2.gz KZFRYYPUVZLYCS-CQSZACIVSA-N 1 1 341.367 3.665 20 5 EHBDMO C[C@H](OC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448825 1136596906 /nfs/dbraw/zinc/59/69/06/1136596906.db2.gz VGJNTCBBHHMVRF-KSSFIOAISA-N 1 1 346.427 3.996 20 5 EHBDMO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815596613 1136616898 /nfs/dbraw/zinc/61/68/98/1136616898.db2.gz YUIWBCYXVYXNOZ-YMTOWFKASA-N 1 1 333.775 3.615 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339025013 1137099071 /nfs/dbraw/zinc/09/90/71/1137099071.db2.gz YZSJCXOPLOYQKO-GFCCVEGCSA-N 1 1 334.363 3.941 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC000862467378 1137145584 /nfs/dbraw/zinc/14/55/84/1137145584.db2.gz SQNTWVRTPNKXBE-UHFFFAOYSA-N 1 1 349.175 3.979 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCCC(F)(F)CC1 ZINC000862467378 1137145585 /nfs/dbraw/zinc/14/55/85/1137145585.db2.gz SQNTWVRTPNKXBE-UHFFFAOYSA-N 1 1 349.175 3.979 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1Cl ZINC000824696255 1137148673 /nfs/dbraw/zinc/14/86/73/1137148673.db2.gz JHCMHNHIVMOSIB-UNEWFSDZSA-N 1 1 338.835 3.764 20 5 EHBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000844255978 1137208276 /nfs/dbraw/zinc/20/82/76/1137208276.db2.gz UTSJGJGGZPBURE-AWEZNQCLSA-N 1 1 339.395 3.543 20 5 EHBDMO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc4[nH]cnc4c3[N+](=O)[O-])c2c1 ZINC001171167539 1137278292 /nfs/dbraw/zinc/27/82/92/1137278292.db2.gz HNVZERKCNDKZDX-GFCCVEGCSA-N 1 1 349.394 3.613 20 5 EHBDMO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000866290661 1137342977 /nfs/dbraw/zinc/34/29/77/1137342977.db2.gz WGGWFXZWRRGMRS-ZDUSSCGKSA-N 1 1 337.439 3.517 20 5 EHBDMO C[N@H+](Cc1ccco1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122992717 1137480272 /nfs/dbraw/zinc/48/02/72/1137480272.db2.gz XZJWYSGQIPGUHZ-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO C[N@@H+](Cc1ccco1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122992717 1137480273 /nfs/dbraw/zinc/48/02/73/1137480273.db2.gz XZJWYSGQIPGUHZ-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000872024722 1137565627 /nfs/dbraw/zinc/56/56/27/1137565627.db2.gz DMSVBAHCYGUJDE-IHRRRGAJSA-N 1 1 335.473 3.594 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnc2n1CCCC2 ZINC000872067872 1137569439 /nfs/dbraw/zinc/56/94/39/1137569439.db2.gz BELHIWUEDQAFNC-GFCCVEGCSA-N 1 1 346.456 3.700 20 5 EHBDMO CC(C)CCc1ccc(NC2CC(n3cc([N+](=O)[O-])cn3)C2)[nH+]c1 ZINC000877575430 1137681791 /nfs/dbraw/zinc/68/17/91/1137681791.db2.gz TXJJTQFDSKJQFD-UHFFFAOYSA-N 1 1 329.404 3.591 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111750 1137703021 /nfs/dbraw/zinc/70/30/21/1137703021.db2.gz CYPDGDZSYOCBNN-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H](NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708407 1137917886 /nfs/dbraw/zinc/91/78/86/1137917886.db2.gz BWGDENVWHVUCBW-KDOFPFPSSA-N 1 1 345.443 3.569 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1ccccc1Cl)C1CC1 ZINC000135226378 1137964783 /nfs/dbraw/zinc/96/47/83/1137964783.db2.gz BIGDOTBFKCLAQQ-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO CC1CCC(OC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)CC1 ZINC000886003946 1138031580 /nfs/dbraw/zinc/03/15/80/1138031580.db2.gz OHXHBBWAFLSHNM-UHFFFAOYSA-N 1 1 333.432 3.550 20 5 EHBDMO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1OC ZINC000886057664 1138036295 /nfs/dbraw/zinc/03/62/95/1138036295.db2.gz UHVXROKIHOHEJT-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO Cc1c(NC(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000045960118 1138041335 /nfs/dbraw/zinc/04/13/35/1138041335.db2.gz ZMNHFHTVCHRTPU-AWEZNQCLSA-N 1 1 348.447 3.679 20 5 EHBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122749 1138049261 /nfs/dbraw/zinc/04/92/61/1138049261.db2.gz JOANPULIIDJUGO-DYVFJYSZSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122749 1138049263 /nfs/dbraw/zinc/04/92/63/1138049263.db2.gz JOANPULIIDJUGO-DYVFJYSZSA-N 1 1 327.384 3.582 20 5 EHBDMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000068449324 1138084741 /nfs/dbraw/zinc/08/47/41/1138084741.db2.gz KINOLPWFJGJEPZ-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c1 ZINC000886818104 1138148706 /nfs/dbraw/zinc/14/87/06/1138148706.db2.gz ALHNLERLMDNSSR-NHYWBVRUSA-N 1 1 344.333 3.615 20 5 EHBDMO COc1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1[N+](=O)[O-] ZINC000084138623 1138177689 /nfs/dbraw/zinc/17/76/89/1138177689.db2.gz WIJCCIACDUVTKX-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO C[C@H]1SCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000089902799 1138207408 /nfs/dbraw/zinc/20/74/08/1138207408.db2.gz LWRAYLOORGJUGR-NWDGAFQWSA-N 1 1 333.413 3.576 20 5 EHBDMO C[C@H]1SCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000089902799 1138207410 /nfs/dbraw/zinc/20/74/10/1138207410.db2.gz LWRAYLOORGJUGR-NWDGAFQWSA-N 1 1 333.413 3.576 20 5 EHBDMO C[C@H]1c2ccccc2C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337262709 1138512837 /nfs/dbraw/zinc/51/28/37/1138512837.db2.gz ZCHMTBFKESWUPH-ZDUSSCGKSA-N 1 1 325.368 3.500 20 5 EHBDMO C[C@@H]1c2ccccc2C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337262704 1138513070 /nfs/dbraw/zinc/51/30/70/1138513070.db2.gz ZCHMTBFKESWUPH-CYBMUJFWSA-N 1 1 325.368 3.500 20 5 EHBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384752 1139486951 /nfs/dbraw/zinc/48/69/51/1139486951.db2.gz KDLXXJFYCIOTSV-JBEBIEQOSA-N 1 1 346.452 3.568 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000175851006 1139523688 /nfs/dbraw/zinc/52/36/88/1139523688.db2.gz MMMWFNBRIUKGCB-IAGOWNOFSA-N 1 1 346.452 3.787 20 5 EHBDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000179587971 1139766843 /nfs/dbraw/zinc/76/68/43/1139766843.db2.gz QPZHCBSNCBAPIF-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000179587971 1139766847 /nfs/dbraw/zinc/76/68/47/1139766847.db2.gz QPZHCBSNCBAPIF-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO COc1cc(C[NH2+]C(C)(C)c2ccccc2OC)c([N+](=O)[O-])cc1F ZINC000184254676 1140090752 /nfs/dbraw/zinc/09/07/52/1140090752.db2.gz HDLXHQRXXNHPNR-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000186731236 1140218943 /nfs/dbraw/zinc/21/89/43/1140218943.db2.gz OKTWPIUCCJOMDE-UHFFFAOYSA-N 1 1 333.435 3.554 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cnn(C(C)C)c1C ZINC000191266445 1140449901 /nfs/dbraw/zinc/44/99/01/1140449901.db2.gz QEGYUEGPDWSVJX-LBPRGKRZSA-N 1 1 332.404 3.540 20 5 EHBDMO Cc1cccc2nc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)cn21 ZINC000192849903 1140553833 /nfs/dbraw/zinc/55/38/33/1140553833.db2.gz SESRNVCJVDLQSW-GOSISDBHSA-N 1 1 336.395 3.718 20 5 EHBDMO COC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000192924859 1140555881 /nfs/dbraw/zinc/55/58/81/1140555881.db2.gz KRBLYZDJWUOPQL-SJORKVTESA-N 1 1 330.384 3.851 20 5 EHBDMO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000268209550 1140902689 /nfs/dbraw/zinc/90/26/89/1140902689.db2.gz HNUONQVVMQBEOT-LBPRGKRZSA-N 1 1 330.413 3.805 20 5 EHBDMO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000268209550 1140902694 /nfs/dbraw/zinc/90/26/94/1140902694.db2.gz HNUONQVVMQBEOT-LBPRGKRZSA-N 1 1 330.413 3.805 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cs1 ZINC000271410729 1141360416 /nfs/dbraw/zinc/36/04/16/1141360416.db2.gz PHGACGZJPLIXPC-CQSZACIVSA-N 1 1 342.424 3.671 20 5 EHBDMO Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271618269 1141406655 /nfs/dbraw/zinc/40/66/55/1141406655.db2.gz MFNVDPWKBQQDDL-QWHCGFSZSA-N 1 1 345.374 3.720 20 5 EHBDMO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271656891 1141413984 /nfs/dbraw/zinc/41/39/84/1141413984.db2.gz WLIGCKAWIKSKGE-CABCVRRESA-N 1 1 341.411 3.889 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000339166175 1141516250 /nfs/dbraw/zinc/51/62/50/1141516250.db2.gz CVKREIBEBXZTMJ-LSDHHAIUSA-N 1 1 344.333 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000339166175 1141516253 /nfs/dbraw/zinc/51/62/53/1141516253.db2.gz CVKREIBEBXZTMJ-LSDHHAIUSA-N 1 1 344.333 3.757 20 5 EHBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643635 719205238 /nfs/dbraw/zinc/20/52/38/719205238.db2.gz ZVADVIGMJFPKTK-CHWSQXEVSA-N 1 1 340.858 3.965 20 5 EHBDMO CC(C)[N@H+](Cc1cn(C)nc1C(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000274502206 1014143759 /nfs/dbraw/zinc/14/37/59/1014143759.db2.gz SAEHOXNARQEHHL-UHFFFAOYSA-N 1 1 338.358 3.677 20 5 EHBDMO CC(C)[N@@H+](Cc1cn(C)nc1C(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000274502206 1014143763 /nfs/dbraw/zinc/14/37/63/1014143763.db2.gz SAEHOXNARQEHHL-UHFFFAOYSA-N 1 1 338.358 3.677 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3cn[nH]c3C2)c2ccccc2)c1 ZINC000359895404 1015910403 /nfs/dbraw/zinc/91/04/03/1015910403.db2.gz GWIYINRSQQWNND-PXNSSMCTSA-N 1 1 348.406 3.554 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283534 1016858256 /nfs/dbraw/zinc/85/82/56/1016858256.db2.gz YTWMDWGSDRCURK-HKUYNNGSSA-N 1 1 325.412 3.520 20 5 EHBDMO CN1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283534 1016858272 /nfs/dbraw/zinc/85/82/72/1016858272.db2.gz YTWMDWGSDRCURK-HKUYNNGSSA-N 1 1 325.412 3.520 20 5 EHBDMO COC(=O)c1cccc2c1CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540347 1032258359 /nfs/dbraw/zinc/25/83/59/1032258359.db2.gz DKUMPJNODICKMM-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1cccc2c1CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540347 1032258369 /nfs/dbraw/zinc/25/83/69/1032258369.db2.gz DKUMPJNODICKMM-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COCCCCc1ccc[nH+]c1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000461206926 1032318843 /nfs/dbraw/zinc/31/88/43/1032318843.db2.gz JQAMWFPMJHYHAN-UHFFFAOYSA-N 1 1 329.400 3.879 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459753421 1032447565 /nfs/dbraw/zinc/44/75/65/1032447565.db2.gz MBAJSWIJUAMVNB-RUQNTENUSA-N 1 1 344.455 3.871 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(c4ccccc4)CC3)nc2c1 ZINC000547853144 1017088592 /nfs/dbraw/zinc/08/85/92/1017088592.db2.gz YVOAKSRTKWEGAP-UHFFFAOYSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459798478 1032480896 /nfs/dbraw/zinc/48/08/96/1032480896.db2.gz VBLUDXZMHWSGJO-SUMWQHHRSA-N 1 1 338.835 3.621 20 5 EHBDMO CC[C@@H]1C[C@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503966 1032687296 /nfs/dbraw/zinc/68/72/96/1032687296.db2.gz VGLPYUHZRPUFTF-SZVBFZGTSA-N 1 1 332.444 3.979 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351923 1017970340 /nfs/dbraw/zinc/97/03/40/1017970340.db2.gz ADDQDXSPZZGJQF-TZMCWYRMSA-N 1 1 326.824 3.764 20 5 EHBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000025396290 1018955961 /nfs/dbraw/zinc/95/59/61/1018955961.db2.gz NVOTZLDTNMJKLX-LLVKDONJSA-N 1 1 333.775 3.538 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000255495200 1019246942 /nfs/dbraw/zinc/24/69/42/1019246942.db2.gz BIQNSRBUGIDAHR-DASIIQCKSA-N 1 1 338.407 3.590 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1cccc(C)c1C ZINC001167463747 1020923789 /nfs/dbraw/zinc/92/37/89/1020923789.db2.gz AUGRXSRGPTXHQZ-KRWDZBQOSA-N 1 1 328.416 3.554 20 5 EHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837235 1021261794 /nfs/dbraw/zinc/26/17/94/1021261794.db2.gz DXSXNWJGDRJLCH-HZPDHXFCSA-N 1 1 345.399 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCF)o2)c(Br)c1 ZINC000437253526 1021676718 /nfs/dbraw/zinc/67/67/18/1021676718.db2.gz AFIAYBNQMPMZDY-UHFFFAOYSA-N 1 1 343.152 3.676 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@](O)(C4CC4)C3)s2)cc1 ZINC000426499376 1021743059 /nfs/dbraw/zinc/74/30/59/1021743059.db2.gz QOEQLCUXRBWYOL-SFHVURJKSA-N 1 1 344.436 3.670 20 5 EHBDMO Cc1ccc(C[NH+]2CCC(C)(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000592524503 1033020087 /nfs/dbraw/zinc/02/00/87/1033020087.db2.gz XWUBXHZSVOBJFN-UHFFFAOYSA-N 1 1 348.443 3.847 20 5 EHBDMO COc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000302157004 1022103175 /nfs/dbraw/zinc/10/31/75/1022103175.db2.gz FJQLFBDRRHYVJO-YOEHRIQHSA-N 1 1 341.411 3.536 20 5 EHBDMO CC(C)[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498574 1022107045 /nfs/dbraw/zinc/10/70/45/1022107045.db2.gz YFWBLTLOKRLXGT-TZMCWYRMSA-N 1 1 330.388 3.684 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000546267077 1022187851 /nfs/dbraw/zinc/18/78/51/1022187851.db2.gz CCCQOCYYNKHGES-AWEZNQCLSA-N 1 1 342.443 3.863 20 5 EHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187580006 1022357270 /nfs/dbraw/zinc/35/72/70/1022357270.db2.gz NTHYTJTUZOGIFI-SUMWQHHRSA-N 1 1 328.416 3.616 20 5 EHBDMO CC[N@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000517551704 1022439542 /nfs/dbraw/zinc/43/95/42/1022439542.db2.gz QBKDAPLWZBNKSH-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO CC[N@@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000517551704 1022439548 /nfs/dbraw/zinc/43/95/48/1022439548.db2.gz QBKDAPLWZBNKSH-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccn1 ZINC000602672038 1033051747 /nfs/dbraw/zinc/05/17/47/1033051747.db2.gz CLPQTQFRJMBJRL-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000602682751 1033083088 /nfs/dbraw/zinc/08/30/88/1033083088.db2.gz RNNKQQLUYIBZMA-OAHLLOKOSA-N 1 1 344.333 3.616 20 5 EHBDMO Cc1ccc([C@H](C)NC(=O)CC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000548389664 1022774327 /nfs/dbraw/zinc/77/43/27/1022774327.db2.gz PRGQDBVPHZLDTL-HNNXBMFYSA-N 1 1 347.459 3.735 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000602685392 1033084927 /nfs/dbraw/zinc/08/49/27/1033084927.db2.gz NWZHCOYIIBFXBL-NHYWBVRUSA-N 1 1 346.349 3.861 20 5 EHBDMO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1c(F)cccc1F ZINC000507216940 1023194191 /nfs/dbraw/zinc/19/41/91/1023194191.db2.gz HOEFPVLHLLMJLL-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1c(F)cccc1F ZINC000507216940 1023194199 /nfs/dbraw/zinc/19/41/99/1023194199.db2.gz HOEFPVLHLLMJLL-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729736 1033117955 /nfs/dbraw/zinc/11/79/55/1033117955.db2.gz CAHQMEWWSUYBLG-IEBWSBKVSA-N 1 1 326.396 3.601 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000276932843 1023409383 /nfs/dbraw/zinc/40/93/83/1023409383.db2.gz RBCFXGYZWIXJMQ-MRXNPFEDSA-N 1 1 347.440 3.999 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2cccc(F)c2[N+](=O)[O-])cc1F ZINC000063254823 1033143226 /nfs/dbraw/zinc/14/32/26/1033143226.db2.gz CZMNJEMPFLMRQM-UHFFFAOYSA-N 1 1 344.321 3.979 20 5 EHBDMO Cc1c([C@H](C)[NH2+]Cc2cccnc2OC(C)C)cccc1[N+](=O)[O-] ZINC000610800045 1023692334 /nfs/dbraw/zinc/69/23/34/1023692334.db2.gz MTXMOOJYRDCUSV-AWEZNQCLSA-N 1 1 329.400 3.936 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000514116749 1024138831 /nfs/dbraw/zinc/13/88/31/1024138831.db2.gz LQEFOQIIXXZGGM-UHFFFAOYSA-N 1 1 332.404 3.903 20 5 EHBDMO CCn1nccc1C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000434794100 1024429373 /nfs/dbraw/zinc/42/93/73/1024429373.db2.gz NBQPRMVOGIHZLG-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383927374 1024634533 /nfs/dbraw/zinc/63/45/33/1024634533.db2.gz RZLKOBUNVLYCMS-NVXWUHKLSA-N 1 1 325.412 3.917 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792088 1024654367 /nfs/dbraw/zinc/65/43/67/1024654367.db2.gz XTQLEUGSPOEJPM-NXHRZFHOSA-N 1 1 336.407 3.640 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065533235 1024662929 /nfs/dbraw/zinc/66/29/29/1024662929.db2.gz DVWJZUWKYALKGN-CQSZACIVSA-N 1 1 330.384 3.675 20 5 EHBDMO CC[C@@H]([NH2+]Cc1nc2cccnc2s1)c1cccc([N+](=O)[O-])c1 ZINC000342280306 1024704966 /nfs/dbraw/zinc/70/49/66/1024704966.db2.gz HIMJLCWDCJVAHC-CYBMUJFWSA-N 1 1 328.397 3.840 20 5 EHBDMO O=c1[nH]c2c(cc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])CCCC2 ZINC000895880701 1024928442 /nfs/dbraw/zinc/92/84/42/1024928442.db2.gz YFWMQMUPUQOROG-UHFFFAOYSA-N 1 1 347.802 3.517 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000185464416 1025148317 /nfs/dbraw/zinc/14/83/17/1025148317.db2.gz CPERTRVBBXUJEG-GFCCVEGCSA-N 1 1 337.470 3.597 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000051454298 1025353744 /nfs/dbraw/zinc/35/37/44/1025353744.db2.gz FZWIWSFYROWLLM-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000438996706 1025380534 /nfs/dbraw/zinc/38/05/34/1025380534.db2.gz PPOLSGIVJKGAMM-MZMPZRCHSA-N 1 1 336.407 3.640 20 5 EHBDMO Cc1cc(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433143 1025461102 /nfs/dbraw/zinc/46/11/02/1025461102.db2.gz IARGFXJEXFMPGI-WBVHZDCISA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000442998382 1025640171 /nfs/dbraw/zinc/64/01/71/1025640171.db2.gz IZQFPNYHRGZZBV-LIRRHRJNSA-N 1 1 345.418 3.823 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H]2CCSC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000530524378 1025981106 /nfs/dbraw/zinc/98/11/06/1025981106.db2.gz FKTNPMLQNMRWRB-CXAGYDPISA-N 1 1 332.425 3.935 20 5 EHBDMO CC(C)[N@@H+](CCCO[C@@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000338234135 1025982471 /nfs/dbraw/zinc/98/24/71/1025982471.db2.gz WECKRRXDQZXXCZ-GOSISDBHSA-N 1 1 336.432 3.739 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ccc(N)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000287739469 1026012251 /nfs/dbraw/zinc/01/22/51/1026012251.db2.gz GEJCOJJTCJLSRE-YOEHRIQHSA-N 1 1 340.427 3.642 20 5 EHBDMO CCO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1C ZINC000451544967 1026090536 /nfs/dbraw/zinc/09/05/36/1026090536.db2.gz QMCOVEKPGLMZDI-XHDPSFHLSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1C ZINC000451544967 1026090550 /nfs/dbraw/zinc/09/05/50/1026090550.db2.gz QMCOVEKPGLMZDI-XHDPSFHLSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000451549069 1026099487 /nfs/dbraw/zinc/09/94/87/1026099487.db2.gz VTWDQYHDNCRGML-YOEHRIQHSA-N 1 1 336.432 3.629 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCOCC(F)(F)F)C2)cc1 ZINC000451547194 1026100586 /nfs/dbraw/zinc/10/05/86/1026100586.db2.gz KNDWHDBWXIXJFZ-AWEZNQCLSA-N 1 1 346.349 3.743 20 5 EHBDMO Cc1ncsc1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451554467 1026106997 /nfs/dbraw/zinc/10/69/97/1026106997.db2.gz ZVDUIFPVVULFRA-OAHLLOKOSA-N 1 1 331.441 3.782 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141483 1026234292 /nfs/dbraw/zinc/23/42/92/1026234292.db2.gz WCQGTNDXSBZOFG-KEEQEYLASA-N 1 1 340.423 3.798 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000277656799 1026463450 /nfs/dbraw/zinc/46/34/50/1026463450.db2.gz GGBCWXXKXBVPBJ-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000452100933 1026477155 /nfs/dbraw/zinc/47/71/55/1026477155.db2.gz IXZDMZSZVQPOPV-LBPRGKRZSA-N 1 1 346.349 3.862 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCO)[C@H]1CCCc2ccccc21 ZINC000531164058 1026637043 /nfs/dbraw/zinc/63/70/43/1026637043.db2.gz NHOVJQJFRLQHAR-FQEVSTJZSA-N 1 1 340.423 3.857 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041893 1026680299 /nfs/dbraw/zinc/68/02/99/1026680299.db2.gz SPEZHJMTPANVMC-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000531202479 1026684509 /nfs/dbraw/zinc/68/45/09/1026684509.db2.gz ZPWOFXDEQVNEJP-YOEHRIQHSA-N 1 1 326.396 3.981 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cnn(CC2CCC2)c1 ZINC000934558212 1026782802 /nfs/dbraw/zinc/78/28/02/1026782802.db2.gz AUZGJGTVNCQSEN-LBPRGKRZSA-N 1 1 332.379 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000186439103 1026907250 /nfs/dbraw/zinc/90/72/50/1026907250.db2.gz GTMIEXUZIQNRGJ-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000186439103 1026907257 /nfs/dbraw/zinc/90/72/57/1026907257.db2.gz GTMIEXUZIQNRGJ-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000204663865 1027286391 /nfs/dbraw/zinc/28/63/91/1027286391.db2.gz GTDWPWYXXXSXQC-SFHVURJKSA-N 1 1 328.412 3.929 20 5 EHBDMO Cc1c(CNC2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000237801591 1027705791 /nfs/dbraw/zinc/70/57/91/1027705791.db2.gz KQRINANKLQOLIS-UHFFFAOYSA-N 1 1 339.439 3.657 20 5 EHBDMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000366725330 1027849344 /nfs/dbraw/zinc/84/93/44/1027849344.db2.gz WMYDHSMIEBZJGX-IFXJQAMLSA-N 1 1 336.395 3.769 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](CC(F)(F)F)C3)nc2c1 ZINC000420938266 1027889398 /nfs/dbraw/zinc/88/93/98/1027889398.db2.gz APGLWMSTLQKYPD-JTQLQIEISA-N 1 1 343.305 3.900 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](CC(F)(F)F)C3)nc2c1 ZINC000420938266 1027889422 /nfs/dbraw/zinc/88/94/22/1027889422.db2.gz APGLWMSTLQKYPD-JTQLQIEISA-N 1 1 343.305 3.900 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420955709 1027926159 /nfs/dbraw/zinc/92/61/59/1027926159.db2.gz WZCMMJLKOBGGRV-GFCCVEGCSA-N 1 1 332.322 3.638 20 5 EHBDMO CCOc1cccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444680629 1028150901 /nfs/dbraw/zinc/15/09/01/1028150901.db2.gz QKMOBBIFQMUWGK-GFCCVEGCSA-N 1 1 340.383 3.721 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000063482860 1028586497 /nfs/dbraw/zinc/58/64/97/1028586497.db2.gz JMNOHFLUJXLWSN-OAHLLOKOSA-N 1 1 341.411 3.925 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(-n2cccn2)c1 ZINC000183593757 1028586763 /nfs/dbraw/zinc/58/67/63/1028586763.db2.gz UXGFSIJLJLJLRH-ZDUSSCGKSA-N 1 1 340.358 3.770 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342372 1028968390 /nfs/dbraw/zinc/96/83/90/1028968390.db2.gz HCKXIIXTHMNGIN-CYBMUJFWSA-N 1 1 347.440 3.732 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342372 1028968411 /nfs/dbraw/zinc/96/84/11/1028968411.db2.gz HCKXIIXTHMNGIN-CYBMUJFWSA-N 1 1 347.440 3.732 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899739 1029042811 /nfs/dbraw/zinc/04/28/11/1029042811.db2.gz LISZDSVWIXGMLD-GDBMZVCRSA-N 1 1 337.464 3.620 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504906416 1029050293 /nfs/dbraw/zinc/05/02/93/1029050293.db2.gz XSFHVCQTHSZNNN-OAGGEKHMSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504906416 1029050305 /nfs/dbraw/zinc/05/03/05/1029050305.db2.gz XSFHVCQTHSZNNN-OAGGEKHMSA-N 1 1 349.475 3.765 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923542 1029108994 /nfs/dbraw/zinc/10/89/94/1029108994.db2.gz BKHPYAMWTHGORM-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923542 1029108998 /nfs/dbraw/zinc/10/89/98/1029108998.db2.gz BKHPYAMWTHGORM-FZMZJTMJSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCCC2)C1 ZINC000445864898 1029196007 /nfs/dbraw/zinc/19/60/07/1029196007.db2.gz ZVIDRGSUZDLUSB-CQSZACIVSA-N 1 1 331.416 3.578 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000505290478 1029444311 /nfs/dbraw/zinc/44/43/11/1029444311.db2.gz QMSMXHPALFVKNO-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042865 1029660101 /nfs/dbraw/zinc/66/01/01/1029660101.db2.gz GECBPPXFLXQJQY-AUUYWEPGSA-N 1 1 326.396 3.727 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Cl)c1 ZINC000447304300 1030102267 /nfs/dbraw/zinc/10/22/67/1030102267.db2.gz IJMARUCNNRCIBM-AWEZNQCLSA-N 1 1 346.818 3.638 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525781750 1030116061 /nfs/dbraw/zinc/11/60/61/1030116061.db2.gz VRBSGJMLFPIAOL-GOSISDBHSA-N 1 1 334.416 3.864 20 5 EHBDMO CCn1ccnc1[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453349654 1030138447 /nfs/dbraw/zinc/13/84/47/1030138447.db2.gz LTFLPXGZUFUELY-LRDDRELGSA-N 1 1 328.416 3.884 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159432602 1030188518 /nfs/dbraw/zinc/18/85/18/1030188518.db2.gz SQJGNNQAJJMTIN-CYBMUJFWSA-N 1 1 327.222 3.978 20 5 EHBDMO CC(C)[C@H](CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+]1CCCC1 ZINC000583604379 1030266041 /nfs/dbraw/zinc/26/60/41/1030266041.db2.gz MWXQUWDIQZVKFA-OALUTQOASA-N 1 1 331.460 3.682 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000159854200 1030388532 /nfs/dbraw/zinc/38/85/32/1030388532.db2.gz WUGBNKBHCASEEA-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000159854200 1030388547 /nfs/dbraw/zinc/38/85/47/1030388547.db2.gz WUGBNKBHCASEEA-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483254984 1031068646 /nfs/dbraw/zinc/06/86/46/1031068646.db2.gz IWTQSZFLWAFKHE-ZIAGYGMSSA-N 1 1 333.432 3.680 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000537698512 1031138113 /nfs/dbraw/zinc/13/81/13/1031138113.db2.gz VUCLSPDYJCHPQR-MLGOLLRUSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728743 1031659969 /nfs/dbraw/zinc/65/99/69/1031659969.db2.gz CPDQPXJSTPIIGJ-UPJWGTAASA-N 1 1 330.388 3.511 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCN4CCC3CC4)s2)cc1 ZINC000584119763 1031755813 /nfs/dbraw/zinc/75/58/13/1031755813.db2.gz FIRWMSASMXNIMP-UHFFFAOYSA-N 1 1 343.452 3.603 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCN4CCC3CC4)s2)cc1 ZINC000584119763 1031755825 /nfs/dbraw/zinc/75/58/25/1031755825.db2.gz FIRWMSASMXNIMP-UHFFFAOYSA-N 1 1 343.452 3.603 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](C3CC3)C3CCCCC3)o2)cc1 ZINC000078534149 1033390758 /nfs/dbraw/zinc/39/07/58/1033390758.db2.gz ZKWJLOXVAMSPJM-UHFFFAOYSA-N 1 1 342.399 3.942 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000059374626 1033592224 /nfs/dbraw/zinc/59/22/24/1033592224.db2.gz AGPUQCSGGSKIPK-MRXNPFEDSA-N 1 1 330.359 3.950 20 5 EHBDMO COCc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)ccc1F ZINC000595008008 1033630833 /nfs/dbraw/zinc/63/08/33/1033630833.db2.gz MRGNJPLPZREXFN-LBPRGKRZSA-N 1 1 348.374 3.740 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000063739759 1033642146 /nfs/dbraw/zinc/64/21/46/1033642146.db2.gz VKYMRLMVIKTQKF-UHFFFAOYSA-N 1 1 345.365 3.924 20 5 EHBDMO C[N@H+]1CCCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994762 1033647598 /nfs/dbraw/zinc/64/75/98/1033647598.db2.gz RGFDQAPAFNDOIE-OAHLLOKOSA-N 1 1 343.427 3.676 20 5 EHBDMO COCC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(C)o1 ZINC000595034163 1033655406 /nfs/dbraw/zinc/65/54/06/1033655406.db2.gz QCMBLXZADKBEAE-BBRMVZONSA-N 1 1 348.399 3.933 20 5 EHBDMO CC(C)(C)C(F)(F)C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000595108545 1033694278 /nfs/dbraw/zinc/69/42/78/1033694278.db2.gz SAZBNFFLLAVNBY-VXGBXAGGSA-N 1 1 330.379 3.546 20 5 EHBDMO CC(C)(C)C(F)(F)C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000595108544 1033694541 /nfs/dbraw/zinc/69/45/41/1033694541.db2.gz SAZBNFFLLAVNBY-RYUDHWBXSA-N 1 1 330.379 3.546 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000599074510 1033717319 /nfs/dbraw/zinc/71/73/19/1033717319.db2.gz SWWDEZRYOIBCJQ-YJBOKZPZSA-N 1 1 340.427 3.754 20 5 EHBDMO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000595295168 1033721286 /nfs/dbraw/zinc/72/12/86/1033721286.db2.gz HJPDJXFRESIAMN-MRXNPFEDSA-N 1 1 329.400 3.661 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000595393148 1033779174 /nfs/dbraw/zinc/77/91/74/1033779174.db2.gz NIROJQDRIUZHIJ-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000595393148 1033779188 /nfs/dbraw/zinc/77/91/88/1033779188.db2.gz NIROJQDRIUZHIJ-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363641 1033782305 /nfs/dbraw/zinc/78/23/05/1033782305.db2.gz FWYGDDRWLMOICJ-JKIFEVAISA-N 1 1 335.423 3.571 20 5 EHBDMO COC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000595480084 1033823490 /nfs/dbraw/zinc/82/34/90/1033823490.db2.gz IHKZQFNIQAJWEG-HNNXBMFYSA-N 1 1 338.766 3.865 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4ccco4)CC3)nc2c1 ZINC000595618576 1033903656 /nfs/dbraw/zinc/90/36/56/1033903656.db2.gz QRKIVSMTGSYJLO-UHFFFAOYSA-N 1 1 327.340 3.709 20 5 EHBDMO CC(C)C[C@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)N(C)C ZINC000608835674 1033908637 /nfs/dbraw/zinc/90/86/37/1033908637.db2.gz IJGRDQFGSHKPHB-QGZVFWFLSA-N 1 1 345.443 3.921 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000138494626 1033939176 /nfs/dbraw/zinc/93/91/76/1033939176.db2.gz JNMRZYGEXSSSOZ-KUHUBIRLSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000138494626 1033939191 /nfs/dbraw/zinc/93/91/91/1033939191.db2.gz JNMRZYGEXSSSOZ-KUHUBIRLSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 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AMUIRKKIOYNKEW-UHFFFAOYSA-N 1 1 337.326 3.871 20 5 EHBDMO Cc1cc(Cl)ccc1C1=CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000599618847 1034039598 /nfs/dbraw/zinc/03/95/98/1034039598.db2.gz FJKZFRHQTUBNJY-UHFFFAOYSA-N 1 1 346.818 3.542 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610449 1034070434 /nfs/dbraw/zinc/07/04/34/1034070434.db2.gz MAWXHWOMPSNDJR-OXQOHEQNSA-N 1 1 339.439 3.616 20 5 EHBDMO C[C@@H]1CCN(CC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610449 1034070453 /nfs/dbraw/zinc/07/04/53/1034070453.db2.gz MAWXHWOMPSNDJR-OXQOHEQNSA-N 1 1 339.439 3.616 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCOc1ccc(F)cc1 ZINC000604012590 1034136354 /nfs/dbraw/zinc/13/63/54/1034136354.db2.gz STTQWZUMNGTSMS-UHFFFAOYSA-N 1 1 348.374 3.514 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000596307371 1034163696 /nfs/dbraw/zinc/16/36/96/1034163696.db2.gz LHXKNXWFJWTTEU-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO CCn1cc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000537623276 1034244404 /nfs/dbraw/zinc/24/44/04/1034244404.db2.gz BDUQKYLILBHVDX-UHFFFAOYSA-N 1 1 340.383 3.703 20 5 EHBDMO CCn1cc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000537623276 1034244417 /nfs/dbraw/zinc/24/44/17/1034244417.db2.gz BDUQKYLILBHVDX-UHFFFAOYSA-N 1 1 340.383 3.703 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])nc2)[C@H]1c1ccc(Cl)cc1 ZINC000450413161 1034300410 /nfs/dbraw/zinc/30/04/10/1034300410.db2.gz SNTUGSTUYGHHCY-GOEBONIOSA-N 1 1 332.791 3.501 20 5 EHBDMO CC[C@H](C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000060471645 1034571488 /nfs/dbraw/zinc/57/14/88/1034571488.db2.gz DKYSVARXSWAXGG-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H](CCF)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597210348 1034593053 /nfs/dbraw/zinc/59/30/53/1034593053.db2.gz GGNKARWBVHLXPE-CQSZACIVSA-N 1 1 346.406 3.567 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H](CCF)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597210345 1034594275 /nfs/dbraw/zinc/59/42/75/1034594275.db2.gz GGNKARWBVHLXPE-AWEZNQCLSA-N 1 1 346.406 3.567 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4COC[C@H]4C3)s2)cc1 ZINC000597229667 1034611484 /nfs/dbraw/zinc/61/14/84/1034611484.db2.gz ICPRMVOVVVCWCA-LSDHHAIUSA-N 1 1 344.436 3.792 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4COC[C@@H]4C3)o2)c(Cl)c1 ZINC000601975557 1034856185 /nfs/dbraw/zinc/85/61/85/1034856185.db2.gz LCTJBJAGVLZYFT-TXEJJXNPSA-N 1 1 348.786 3.586 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+](C[C@@H]3CCOC3)C3CC3)o2)c1 ZINC000129993370 1034992754 /nfs/dbraw/zinc/99/27/54/1034992754.db2.gz WBIMACZECRSUEB-AWEZNQCLSA-N 1 1 342.395 3.856 20 5 EHBDMO Cc1ncc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000278798392 1035021042 /nfs/dbraw/zinc/02/10/42/1035021042.db2.gz REBSKHFPMSRWEK-UHFFFAOYSA-N 1 1 331.319 3.668 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000548941478 1035066577 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3.674 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000376366673 1036325282 /nfs/dbraw/zinc/32/52/82/1036325282.db2.gz HYDYLHPFIFUKSZ-AWEZNQCLSA-N 1 1 331.803 3.708 20 5 EHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC(C)(C)C1 ZINC000589274675 1036336778 /nfs/dbraw/zinc/33/67/78/1036336778.db2.gz NHYJQYKGXPSECN-MRXNPFEDSA-N 1 1 336.432 3.643 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000026224062 1036393914 /nfs/dbraw/zinc/39/39/14/1036393914.db2.gz MKJMKIYMLPRKRU-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000535375233 1036414299 /nfs/dbraw/zinc/41/42/99/1036414299.db2.gz VLTBPOPIJJKNSM-UHFFFAOYSA-N 1 1 331.416 3.602 20 5 EHBDMO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495152 1036437595 /nfs/dbraw/zinc/43/75/95/1036437595.db2.gz XFQMVKUPDKJJBD-UHFFFAOYSA-N 1 1 342.395 3.712 20 5 EHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495152 1036437602 /nfs/dbraw/zinc/43/76/02/1036437602.db2.gz XFQMVKUPDKJJBD-UHFFFAOYSA-N 1 1 342.395 3.712 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000589494671 1036438015 /nfs/dbraw/zinc/43/80/15/1036438015.db2.gz LCSBPGCLEIJBTL-QGZVFWFLSA-N 1 1 340.379 3.719 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000589518865 1036489105 /nfs/dbraw/zinc/48/91/05/1036489105.db2.gz XERZGQCLGKBYTM-FQEVSTJZSA-N 1 1 338.407 3.873 20 5 EHBDMO C[C@@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000310852780 1036638499 /nfs/dbraw/zinc/63/84/99/1036638499.db2.gz AVXQRNAGHFYDER-FQEVSTJZSA-N 1 1 339.439 3.597 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271702919 1036959675 /nfs/dbraw/zinc/95/96/75/1036959675.db2.gz HQGKYQDRLUBGHB-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO CC[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000180639603 1037047855 /nfs/dbraw/zinc/04/78/55/1037047855.db2.gz MMHXDLAJZKZIKN-HNNXBMFYSA-N 1 1 346.358 3.746 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H](c2ccccc2)C1 ZINC000761511269 1037082992 /nfs/dbraw/zinc/08/29/92/1037082992.db2.gz PSDKBQLULNONRT-GOSISDBHSA-N 1 1 345.830 3.737 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542464468 1037117150 /nfs/dbraw/zinc/11/71/50/1037117150.db2.gz JIUSBDKFJXUIAB-UHFFFAOYSA-N 1 1 325.840 3.554 20 5 EHBDMO Cc1c(Cc2noc([C@@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211335 1037129473 /nfs/dbraw/zinc/12/94/73/1037129473.db2.gz DNHIBTPKYBEHNG-MBNYWOFBSA-N 1 1 344.415 3.811 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000542185220 1037145601 /nfs/dbraw/zinc/14/56/01/1037145601.db2.gz OCGKOWQRNATKOL-AEGPPILISA-N 1 1 334.416 3.623 20 5 EHBDMO C[N@@H+](CCOCC1CC1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539862841 1037294213 /nfs/dbraw/zinc/29/42/13/1037294213.db2.gz LHOIYNKLOUTCHH-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO CCOc1cc(N2CCC(C[N@@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000539969350 1037426275 /nfs/dbraw/zinc/42/62/75/1037426275.db2.gz UJXSFHGBEYDVHD-UHFFFAOYSA-N 1 1 335.448 3.550 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000463034344 1037691785 /nfs/dbraw/zinc/69/17/85/1037691785.db2.gz FDAWHMYEHAFEON-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2cccnc21 ZINC000382056743 1038519440 /nfs/dbraw/zinc/51/94/40/1038519440.db2.gz XNUDLGWSLKSSBJ-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461962778 1038698268 /nfs/dbraw/zinc/69/82/68/1038698268.db2.gz XNBQVPIGJGCHMY-LBPRGKRZSA-N 1 1 345.365 3.700 20 5 EHBDMO Cc1c(C[NH2+]Cc2nc3ccc(Cl)cc3n2C)cccc1[N+](=O)[O-] ZINC000480447091 1039564961 /nfs/dbraw/zinc/56/49/61/1039564961.db2.gz USQGIUDTCJMEAO-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000554854394 1039837934 /nfs/dbraw/zinc/83/79/34/1039837934.db2.gz VRXXXPZNFNCPQT-UHFFFAOYSA-N 1 1 334.416 3.539 20 5 EHBDMO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428735228 1040113416 /nfs/dbraw/zinc/11/34/16/1040113416.db2.gz PLLPJWNGCBNYON-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428735228 1040113421 /nfs/dbraw/zinc/11/34/21/1040113421.db2.gz PLLPJWNGCBNYON-OAHLLOKOSA-N 1 1 341.411 3.671 20 5 EHBDMO CCOc1ccc(NC(=O)C[N@@H+](CC)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000027284698 1040159545 /nfs/dbraw/zinc/15/95/45/1040159545.db2.gz ZCJXGSVTEYWXTJ-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000432924946 1040189343 /nfs/dbraw/zinc/18/93/43/1040189343.db2.gz PHJCTGGANCYCQS-UHFFFAOYSA-N 1 1 326.400 3.512 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000490038757 1040304469 /nfs/dbraw/zinc/30/44/69/1040304469.db2.gz AEFIMTHKCRHYSB-KRWDZBQOSA-N 1 1 341.411 3.550 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769534 1040426012 /nfs/dbraw/zinc/42/60/12/1040426012.db2.gz FFQDXJPJAMMJGN-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782288 1040441192 /nfs/dbraw/zinc/44/11/92/1040441192.db2.gz UJBUFUDKSBNXCH-MRXNPFEDSA-N 1 1 333.432 3.602 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000486797686 1040458050 /nfs/dbraw/zinc/45/80/50/1040458050.db2.gz WWUIPFPYCIROOC-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cccc4n[nH]cc43)C2)cc1 ZINC000600167738 1040753109 /nfs/dbraw/zinc/75/31/09/1040753109.db2.gz CEMXOFUBOHXIDC-HNNXBMFYSA-N 1 1 336.395 3.851 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000600213369 1040850151 /nfs/dbraw/zinc/85/01/51/1040850151.db2.gz CSVDCTNAEJCRGZ-HNNXBMFYSA-N 1 1 342.395 3.689 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000027906059 1041020454 /nfs/dbraw/zinc/02/04/54/1041020454.db2.gz AXGHYNYUSQEZOY-KRWDZBQOSA-N 1 1 339.395 3.543 20 5 EHBDMO COCCc1cc[nH+]c(NC/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000512865638 1041115372 /nfs/dbraw/zinc/11/53/72/1041115372.db2.gz VCYWLRXWUZGRQD-GXDHUFHOSA-N 1 1 327.384 3.694 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854508 1041243668 /nfs/dbraw/zinc/24/36/68/1041243668.db2.gz HVAQPCMSVJZZHV-GJZGRUSLSA-N 1 1 341.411 3.657 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000111312520 1042261237 /nfs/dbraw/zinc/26/12/37/1042261237.db2.gz VHDOHOVGWMFTLJ-OAHLLOKOSA-N 1 1 347.440 3.878 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000111312520 1042261243 /nfs/dbraw/zinc/26/12/43/1042261243.db2.gz VHDOHOVGWMFTLJ-OAHLLOKOSA-N 1 1 347.440 3.878 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000342051340 1042794705 /nfs/dbraw/zinc/79/47/05/1042794705.db2.gz SIZFQDAPMZQEKY-WMZOPIPTSA-N 1 1 334.416 3.525 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979136 1042830164 /nfs/dbraw/zinc/83/01/64/1042830164.db2.gz RTSDFQUPLIEAJK-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979136 1042830170 /nfs/dbraw/zinc/83/01/70/1042830170.db2.gz RTSDFQUPLIEAJK-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278974178 1043113391 /nfs/dbraw/zinc/11/33/91/1043113391.db2.gz ZPRRXRKZVSOUMT-UHFFFAOYSA-N 1 1 344.390 3.651 20 5 EHBDMO COC(=O)c1ccc(Cl)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000182110580 1043722573 /nfs/dbraw/zinc/72/25/73/1043722573.db2.gz DUWRSYUJQFWZLK-NSHDSACASA-N 1 1 348.786 3.886 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000170914138 1126923003 /nfs/dbraw/zinc/92/30/03/1126923003.db2.gz IOZADILFLUJVGL-CQSZACIVSA-N 1 1 329.400 3.914 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H](O)C34CCCC4)o2)c1 ZINC000552316938 1127749284 /nfs/dbraw/zinc/74/92/84/1127749284.db2.gz UQFHBRARUIUHOQ-SFHVURJKSA-N 1 1 342.395 3.734 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571445 1128105205 /nfs/dbraw/zinc/10/52/05/1128105205.db2.gz REQQJRMIDGTPNJ-MNOVXSKESA-N 1 1 344.358 3.683 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000301455309 1128374439 /nfs/dbraw/zinc/37/44/39/1128374439.db2.gz YOQVSVIAXRKXSG-CZUORRHYSA-N 1 1 346.456 3.855 20 5 EHBDMO CC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1C ZINC001307703132 1128455782 /nfs/dbraw/zinc/45/57/82/1128455782.db2.gz OMQOOHXQGCZZCN-MNOVXSKESA-N 1 1 327.222 3.978 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564044 1128498240 /nfs/dbraw/zinc/49/82/40/1128498240.db2.gz VRNPDEUWRPYHDB-DOTOQJQBSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000301599731 1128509114 /nfs/dbraw/zinc/50/91/14/1128509114.db2.gz UOTNMZGRCSCEEB-RDJZCZTQSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138278 1121125896 /nfs/dbraw/zinc/12/58/96/1121125896.db2.gz LJVDFIHJARUPST-NSHDSACASA-N 1 1 334.807 3.820 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138278 1121125897 /nfs/dbraw/zinc/12/58/97/1121125897.db2.gz LJVDFIHJARUPST-NSHDSACASA-N 1 1 334.807 3.820 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000303542977 1121159625 /nfs/dbraw/zinc/15/96/25/1121159625.db2.gz YVSGSYCDTFLVIQ-QGZVFWFLSA-N 1 1 347.462 3.992 20 5 EHBDMO CCCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272472861 1121659027 /nfs/dbraw/zinc/65/90/27/1121659027.db2.gz APPNRRKTLDUIOW-MRXNPFEDSA-N 1 1 328.416 3.588 20 5 EHBDMO CC[N@@H+](CC(C)C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153752574 1121690411 /nfs/dbraw/zinc/69/04/11/1121690411.db2.gz YFIYZZNISMOZAH-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO COc1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609233216 1121789698 /nfs/dbraw/zinc/78/96/98/1121789698.db2.gz BRPLVNLRKDIJNZ-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)C1 ZINC000301129847 1122041320 /nfs/dbraw/zinc/04/13/20/1122041320.db2.gz ZSUADSXMPRSQKP-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)ccc1Cl ZINC000153913747 1122106691 /nfs/dbraw/zinc/10/66/91/1122106691.db2.gz XBJZYSKZGRRNQX-QGZVFWFLSA-N 1 1 346.814 3.730 20 5 EHBDMO CC(=O)c1ccc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000919722096 1123133563 /nfs/dbraw/zinc/13/35/63/1123133563.db2.gz WSPKVKMDFILQAF-VBQJREDUSA-N 1 1 345.443 3.639 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccccc2)nc1 ZINC000556830901 1123141432 /nfs/dbraw/zinc/14/14/32/1123141432.db2.gz KIQDPDSWHZCECJ-UHFFFAOYSA-N 1 1 348.406 3.726 20 5 EHBDMO CCc1ccc(C[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000007790900 1123419081 /nfs/dbraw/zinc/41/90/81/1123419081.db2.gz VLZZGLJBDXRSKO-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000007790900 1123419084 /nfs/dbraw/zinc/41/90/84/1123419084.db2.gz VLZZGLJBDXRSKO-UHFFFAOYSA-N 1 1 341.411 3.536 20 5 EHBDMO Cc1cccc(N2CCC(Nc3c(F)cc([N+](=O)[O-])cc3F)CC2)[nH+]1 ZINC000301811870 1129126861 /nfs/dbraw/zinc/12/68/61/1129126861.db2.gz YHGZNSXXIZQYIG-UHFFFAOYSA-N 1 1 348.353 3.657 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000609916191 1123691881 /nfs/dbraw/zinc/69/18/81/1123691881.db2.gz DQYYQERBFMYTON-INIZCTEOSA-N 1 1 344.386 3.677 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916573 1123692125 /nfs/dbraw/zinc/69/21/25/1123692125.db2.gz YCTABOITTRVVHU-GDBMZVCRSA-N 1 1 344.386 3.991 20 5 EHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615806901 1123878806 /nfs/dbraw/zinc/87/88/06/1123878806.db2.gz APGHHRGIWBHKOX-GFCCVEGCSA-N 1 1 343.305 3.899 20 5 EHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615806901 1123878810 /nfs/dbraw/zinc/87/88/10/1123878810.db2.gz APGHHRGIWBHKOX-GFCCVEGCSA-N 1 1 343.305 3.899 20 5 EHBDMO O=[N+]([O-])c1c(NCC[NH+]2Cc3ccccc3C2)ccc2ncccc21 ZINC000068321490 1123918417 /nfs/dbraw/zinc/91/84/17/1123918417.db2.gz VRDICCVISWSMAK-UHFFFAOYSA-N 1 1 334.379 3.571 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000618980860 1125255962 /nfs/dbraw/zinc/25/59/62/1125255962.db2.gz GPTBNKGXGCHWPM-UHFFFAOYSA-N 1 1 332.429 3.573 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)c2C1 ZINC000066514073 1129179213 /nfs/dbraw/zinc/17/92/13/1129179213.db2.gz BOOZPYOSZYANAK-UHFFFAOYSA-N 1 1 343.358 3.712 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)c2C1 ZINC000066514073 1129179216 /nfs/dbraw/zinc/17/92/16/1129179216.db2.gz BOOZPYOSZYANAK-UHFFFAOYSA-N 1 1 343.358 3.712 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000078705073 1129185142 /nfs/dbraw/zinc/18/51/42/1129185142.db2.gz MVCXGGIFWCVUQI-UHFFFAOYSA-N 1 1 344.386 3.950 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@@H]21 ZINC000301901923 1129308587 /nfs/dbraw/zinc/30/85/87/1129308587.db2.gz NUTKGGYHIPRQAZ-HOCLYGCPSA-N 1 1 347.459 3.693 20 5 EHBDMO Cc1ccc(C[NH2+][C@@H](CO)c2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000466385315 1129411262 /nfs/dbraw/zinc/41/12/62/1129411262.db2.gz CUOUWYWXSJMQFZ-AWEZNQCLSA-N 1 1 338.766 3.519 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000117343324 1129434877 /nfs/dbraw/zinc/43/48/77/1129434877.db2.gz MXDCOVBUOBUQGU-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO COc1cc(F)c([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c1 ZINC000301972795 1129465405 /nfs/dbraw/zinc/46/54/05/1129465405.db2.gz IQIMZINESXNHAG-CYBMUJFWSA-N 1 1 339.411 3.522 20 5 EHBDMO CCC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494521 1129492542 /nfs/dbraw/zinc/49/25/42/1129492542.db2.gz DFTCOBWYXOJIAK-LSDHHAIUSA-N 1 1 333.432 3.742 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC(C)(C)O ZINC000093414375 1129587193 /nfs/dbraw/zinc/58/71/93/1129587193.db2.gz MZMPJOSKBSSSQE-UHFFFAOYSA-N 1 1 338.791 3.711 20 5 EHBDMO C[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000499960014 1129592185 /nfs/dbraw/zinc/59/21/85/1129592185.db2.gz ZMYDHGWXDFWYEY-ZUZCIYMTSA-N 1 1 338.766 3.772 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOC3(CCC3)C2)o1 ZINC000093640208 1129597606 /nfs/dbraw/zinc/59/76/06/1129597606.db2.gz PQRGEJJDMKHGSU-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC3(CCC3)C2)o1 ZINC000093640208 1129597608 /nfs/dbraw/zinc/59/76/08/1129597608.db2.gz PQRGEJJDMKHGSU-UHFFFAOYSA-N 1 1 328.368 3.610 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc2c(c1)CCC2 ZINC001168741908 1129840547 /nfs/dbraw/zinc/84/05/47/1129840547.db2.gz SVZUVJYSAAKYBU-GFCCVEGCSA-N 1 1 341.367 3.843 20 5 EHBDMO Cc1c(C[NH2+]Cc2ccc(Br)o2)cccc1[N+](=O)[O-] ZINC000227094757 1129889934 /nfs/dbraw/zinc/88/99/34/1129889934.db2.gz WZDRIXVFGWABRF-UHFFFAOYSA-N 1 1 325.162 3.549 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000245739235 1130314892 /nfs/dbraw/zinc/31/48/92/1130314892.db2.gz XAIZTKFCACXELK-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000245739235 1130314898 /nfs/dbraw/zinc/31/48/98/1130314898.db2.gz XAIZTKFCACXELK-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO C[N@@H+](CCNc1nc2ccc([N+](=O)[O-])cc2s1)C1CCCCC1 ZINC000731209085 1130779449 /nfs/dbraw/zinc/77/94/49/1130779449.db2.gz JJSUBEGANQGPFG-UHFFFAOYSA-N 1 1 334.445 3.881 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892953 1130857972 /nfs/dbraw/zinc/85/79/72/1130857972.db2.gz LDMRXZVQNJNGRD-JXXFODFXSA-N 1 1 340.423 3.988 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172914158 1131903115 /nfs/dbraw/zinc/90/31/15/1131903115.db2.gz DIKQPJCRTVKKOQ-SFHVURJKSA-N 1 1 338.407 3.867 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](c3ccccn3)C1)CC2 ZINC001172914249 1131903319 /nfs/dbraw/zinc/90/33/19/1131903319.db2.gz FSYUFEQUSQZVQT-QZTJIDSGSA-N 1 1 337.423 3.727 20 5 EHBDMO CC[N@@H+](Cc1ccccn1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912538 1131918278 /nfs/dbraw/zinc/91/82/78/1131918278.db2.gz BKWVBLVMJIHTSB-GOSISDBHSA-N 1 1 325.412 3.759 20 5 EHBDMO C[C@@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014068 1131936120 /nfs/dbraw/zinc/93/61/20/1131936120.db2.gz JJJVZGPDWFDUDB-GFCCVEGCSA-N 1 1 339.386 3.574 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001173181980 1131993310 /nfs/dbraw/zinc/99/33/10/1131993310.db2.gz RCLLQPDCPFFCGW-QWRGUYRKSA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)c1F ZINC001173181980 1131993317 /nfs/dbraw/zinc/99/33/17/1131993317.db2.gz RCLLQPDCPFFCGW-QWRGUYRKSA-N 1 1 346.349 3.651 20 5 EHBDMO Cc1ccccc1O[C@@H]1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226692 1132007007 /nfs/dbraw/zinc/00/70/07/1132007007.db2.gz KWGPDJQXFPUFSZ-QFBILLFUSA-N 1 1 340.423 3.988 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC001173230941 1132008762 /nfs/dbraw/zinc/00/87/62/1132008762.db2.gz GXZQIZWNHXLRFP-HOCLYGCPSA-N 1 1 348.443 3.580 20 5 EHBDMO COc1ccc(C[N@@H+](CCc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000746118849 1132378468 /nfs/dbraw/zinc/37/84/68/1132378468.db2.gz GWDUORSBJNYFSP-UHFFFAOYSA-N 1 1 326.396 3.811 20 5 EHBDMO Cc1ccc(NC(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000065436735 1132384072 /nfs/dbraw/zinc/38/40/72/1132384072.db2.gz WEAPKKCNNFQZAX-CYBMUJFWSA-N 1 1 348.447 3.535 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@@H+]1CCC[C@H](C)C1 ZINC001177474813 1133066186 /nfs/dbraw/zinc/06/61/86/1133066186.db2.gz HCKJYVKLBDDKOT-QJJARZAOSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC001177474813 1133066191 /nfs/dbraw/zinc/06/61/91/1133066191.db2.gz HCKJYVKLBDDKOT-QJJARZAOSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@@H+]1CCC[C@H](C)C1 ZINC001177474811 1133066327 /nfs/dbraw/zinc/06/63/27/1133066327.db2.gz HCKJYVKLBDDKOT-MFPZVIQNSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC001177474811 1133066332 /nfs/dbraw/zinc/06/63/32/1133066332.db2.gz HCKJYVKLBDDKOT-MFPZVIQNSA-N 1 1 331.460 3.708 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1CNc1ccc2[nH]c[nH+]c2c1 ZINC001178689538 1133191099 /nfs/dbraw/zinc/19/10/99/1133191099.db2.gz ZEBORXLZWZONPK-UHFFFAOYSA-N 1 1 347.172 3.846 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314804 1133243986 /nfs/dbraw/zinc/24/39/86/1133243986.db2.gz FCUVWNXOXZATPU-KRWDZBQOSA-N 1 1 331.460 3.825 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314804 1133243991 /nfs/dbraw/zinc/24/39/91/1133243991.db2.gz FCUVWNXOXZATPU-KRWDZBQOSA-N 1 1 331.460 3.825 20 5 EHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483388 1133289429 /nfs/dbraw/zinc/28/94/29/1133289429.db2.gz MNSYVIMCBYMZKI-LZVBJTEYSA-N 1 1 340.423 3.972 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC001179950538 1133304479 /nfs/dbraw/zinc/30/44/79/1133304479.db2.gz DXJNCYMNZRBBBL-LJQANCHMSA-N 1 1 328.412 3.767 20 5 EHBDMO C[N@@H+](Cc1c2ccccc2c(Cl)c2ccccc21)[C@H]1CCNC1=O ZINC000770378157 1133415908 /nfs/dbraw/zinc/41/59/08/1133415908.db2.gz DPPZPTDFHGZLGY-SFHVURJKSA-N 1 1 338.838 3.967 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc3ccc(Cl)cc3n2C)cc1[N+](=O)[O-] ZINC001183345115 1133797424 /nfs/dbraw/zinc/79/74/24/1133797424.db2.gz FRDKCYQJGOOJDB-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126341 1133810395 /nfs/dbraw/zinc/81/03/95/1133810395.db2.gz PLEBESVGBBUXCQ-XFQXTVEOSA-N 1 1 340.423 3.815 20 5 EHBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746672723 1133990706 /nfs/dbraw/zinc/99/07/06/1133990706.db2.gz HSXDKTQVCXWUDS-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746672723 1133990710 /nfs/dbraw/zinc/99/07/10/1133990710.db2.gz HSXDKTQVCXWUDS-ZDUSSCGKSA-N 1 1 334.803 3.631 20 5 EHBDMO Cc1cc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c([N+](=O)[O-])s1 ZINC001186773546 1134256593 /nfs/dbraw/zinc/25/65/93/1134256593.db2.gz VXAICZMHCCTJSH-WBVHZDCISA-N 1 1 343.452 3.675 20 5 EHBDMO O=C1C[C@]2(CC[N@@H+](Cc3c4ccccc4cc4ccccc43)C2)CN1 ZINC000789770451 1134328889 /nfs/dbraw/zinc/32/88/89/1134328889.db2.gz XTFYLNVWOJBEJT-JOCHJYFZSA-N 1 1 330.431 3.705 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329063 1134749152 /nfs/dbraw/zinc/74/91/52/1134749152.db2.gz NVNNDWBXFAZDSU-RDTXWAMCSA-N 1 1 341.411 3.767 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170335114 1134751178 /nfs/dbraw/zinc/75/11/78/1134751178.db2.gz KVWXKVKYILGQGQ-BNOWGMLFSA-N 1 1 340.370 3.512 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170343563 1134758615 /nfs/dbraw/zinc/75/86/15/1134758615.db2.gz QPPZNACNPCTFHY-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC001191021192 1134780281 /nfs/dbraw/zinc/78/02/81/1134780281.db2.gz DAZBLCHIECJCOV-HNNXBMFYSA-N 1 1 347.459 3.990 20 5 EHBDMO Cc1noc(C[NH+]2CCC(Cc3ccccc3Cl)CC2)c1[N+](=O)[O-] ZINC001197020157 1135642734 /nfs/dbraw/zinc/64/27/34/1135642734.db2.gz AAPMRKRINHBYOB-UHFFFAOYSA-N 1 1 349.818 3.999 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H](C)C(C)(C)C ZINC001197601740 1135713698 /nfs/dbraw/zinc/71/36/98/1135713698.db2.gz KHLSFVDDEDBNST-AWEZNQCLSA-N 1 1 335.448 3.846 20 5 EHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761674 1135729479 /nfs/dbraw/zinc/72/94/79/1135729479.db2.gz QHDLGQJFXNWVHT-RBUKOAKNSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)cc1 ZINC001197720230 1135730032 /nfs/dbraw/zinc/73/00/32/1135730032.db2.gz QUZLEYIOOQHJTB-FXAWDEMLSA-N 1 1 338.407 3.637 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCc3nc[nH]c3C23CCCCC3)c1 ZINC001197751701 1135734454 /nfs/dbraw/zinc/73/44/54/1135734454.db2.gz RXSQPFXBIXDGOG-UHFFFAOYSA-N 1 1 326.400 3.536 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCc3nc[nH]c3C23CCCCC3)c1 ZINC001197751701 1135734456 /nfs/dbraw/zinc/73/44/56/1135734456.db2.gz RXSQPFXBIXDGOG-UHFFFAOYSA-N 1 1 326.400 3.536 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000810048001 1135915949 /nfs/dbraw/zinc/91/59/49/1135915949.db2.gz RWFDLOPNIOYURZ-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000810048001 1135915952 /nfs/dbraw/zinc/91/59/52/1135915952.db2.gz RWFDLOPNIOYURZ-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO COc1cc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])ccn1 ZINC000811479068 1136096859 /nfs/dbraw/zinc/09/68/59/1136096859.db2.gz WFESCUCCOWZCES-UHFFFAOYSA-N 1 1 342.182 3.595 20 5 EHBDMO CCCC[N@@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480080 1136096903 /nfs/dbraw/zinc/09/69/03/1136096903.db2.gz OSHXNNAMAIJEDX-UHFFFAOYSA-N 1 1 334.247 3.723 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]1COc1ccccc1 ZINC001170650174 1136158236 /nfs/dbraw/zinc/15/82/36/1136158236.db2.gz GBTYQVHLELJIMK-INIZCTEOSA-N 1 1 330.359 3.777 20 5 EHBDMO CC(C)C[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579185 1136444020 /nfs/dbraw/zinc/44/40/20/1136444020.db2.gz LKWMDGMXOMIGBJ-LJQANCHMSA-N 1 1 328.412 3.786 20 5 EHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585579 1136448351 /nfs/dbraw/zinc/44/83/51/1136448351.db2.gz XDJNZWMDQFOBOV-VQTJNVASSA-N 1 1 340.423 3.644 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591250 1136451089 /nfs/dbraw/zinc/45/10/89/1136451089.db2.gz IETFKUXXOIPIBY-OALUTQOASA-N 1 1 344.386 3.995 20 5 EHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591982 1136452878 /nfs/dbraw/zinc/45/28/78/1136452878.db2.gz NPISFMFRSPXBHL-MDASCCDHSA-N 1 1 326.396 3.506 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597658 1136459333 /nfs/dbraw/zinc/45/93/33/1136459333.db2.gz JRQSRFKYPXMKRF-NQCMUKECSA-N 1 1 344.386 3.775 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852779701 1136485631 /nfs/dbraw/zinc/48/56/31/1136485631.db2.gz CADPINKTIDTYIC-GFCCVEGCSA-N 1 1 330.359 3.910 20 5 EHBDMO CCc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640860 1136487741 /nfs/dbraw/zinc/48/77/41/1136487741.db2.gz VCSRRZJLDAJTLW-UYAOXDASSA-N 1 1 340.423 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000814641823 1136488586 /nfs/dbraw/zinc/48/85/86/1136488586.db2.gz LLGDTLVAUICKSI-HKUYNNGSSA-N 1 1 326.396 3.508 20 5 EHBDMO C[C@@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC001170959462 1137019072 /nfs/dbraw/zinc/01/90/72/1137019072.db2.gz QBXMVNUVQFLSLJ-NSHDSACASA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)OC(C)(C)C ZINC001170959462 1137019074 /nfs/dbraw/zinc/01/90/74/1137019074.db2.gz QBXMVNUVQFLSLJ-NSHDSACASA-N 1 1 342.823 3.658 20 5 EHBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093523 1137044068 /nfs/dbraw/zinc/04/40/68/1137044068.db2.gz CSSSCTKJTPVJBS-OLZOCXBDSA-N 1 1 337.420 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl ZINC000824696978 1137147075 /nfs/dbraw/zinc/14/70/75/1137147075.db2.gz WUUHAZPOHMBJTC-LXZKKBNFSA-N 1 1 338.835 3.764 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3cccc(Cl)c3)CC2)c(C)c1[N+](=O)[O-] ZINC000794681791 1137226218 /nfs/dbraw/zinc/22/62/18/1137226218.db2.gz FDRIYUCCLKVTKZ-UHFFFAOYSA-N 1 1 348.834 3.899 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@]4(CC4(F)F)C3)c2c1 ZINC000844755770 1137250316 /nfs/dbraw/zinc/25/03/16/1137250316.db2.gz GMHHHJJUOKRGBA-CYBMUJFWSA-N 1 1 341.339 3.561 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@]4(CC4(F)F)C3)c2c1 ZINC000844755770 1137250317 /nfs/dbraw/zinc/25/03/17/1137250317.db2.gz GMHHHJJUOKRGBA-CYBMUJFWSA-N 1 1 341.339 3.561 20 5 EHBDMO CC(C)Oc1cccc(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000120567906 1137286514 /nfs/dbraw/zinc/28/65/14/1137286514.db2.gz XSBASRNQSNHPMO-LJQANCHMSA-N 1 1 344.411 3.547 20 5 EHBDMO C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308942 1137408575 /nfs/dbraw/zinc/40/85/75/1137408575.db2.gz VDKSTEAYKZWVOI-ZFWWWQNUSA-N 1 1 334.416 3.537 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(C2CC2)cnn1C ZINC000872086048 1137570458 /nfs/dbraw/zinc/57/04/58/1137570458.db2.gz RGPXKLDFDNOFEZ-LLVKDONJSA-N 1 1 346.456 3.778 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC[C@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000872108086 1137571437 /nfs/dbraw/zinc/57/14/37/1137571437.db2.gz WEDFCUAVOLSBKP-YJBOKZPZSA-N 1 1 340.427 3.754 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135257 1137703991 /nfs/dbraw/zinc/70/39/91/1137703991.db2.gz VXWHCXYCNFINFV-VNHYZAJKSA-N 1 1 342.399 3.798 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878427999 1137715503 /nfs/dbraw/zinc/71/55/03/1137715503.db2.gz PLTZDNDLXKBKFI-CYBMUJFWSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878693648 1137725387 /nfs/dbraw/zinc/72/53/87/1137725387.db2.gz XKTYZLHFFWPAHT-CYBMUJFWSA-N 1 1 344.415 3.903 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cc3nccs3)CC2)cc1F ZINC000879208831 1137741293 /nfs/dbraw/zinc/74/12/93/1137741293.db2.gz WJQGEXGWYMPLSN-UHFFFAOYSA-N 1 1 335.404 3.645 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879528880 1137750025 /nfs/dbraw/zinc/75/00/25/1137750025.db2.gz DZNLDTQDOFLOIG-YUELXQCFSA-N 1 1 340.383 3.604 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000880053265 1137766758 /nfs/dbraw/zinc/76/67/58/1137766758.db2.gz LAANDGBXACQOOK-FZMZJTMJSA-N 1 1 332.322 3.617 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000880053265 1137766759 /nfs/dbraw/zinc/76/67/59/1137766759.db2.gz LAANDGBXACQOOK-FZMZJTMJSA-N 1 1 332.322 3.617 20 5 EHBDMO C[C@H]1C[C@@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)CC[N@H+]1C ZINC000888867798 1137800276 /nfs/dbraw/zinc/80/02/76/1137800276.db2.gz YUMXDJOMNQJSGE-GJZGRUSLSA-N 1 1 345.443 3.601 20 5 EHBDMO CCC[C@@H](C)CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000883257404 1137850873 /nfs/dbraw/zinc/85/08/73/1137850873.db2.gz AMGAIDKIWUEMKW-PBHICJAKSA-N 1 1 330.432 3.834 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000331687773 1137917228 /nfs/dbraw/zinc/91/72/28/1137917228.db2.gz XNBDLGJLYAQZSF-INIZCTEOSA-N 1 1 342.443 3.963 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000331687773 1137917229 /nfs/dbraw/zinc/91/72/29/1137917229.db2.gz XNBDLGJLYAQZSF-INIZCTEOSA-N 1 1 342.443 3.963 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128110 1137932592 /nfs/dbraw/zinc/93/25/92/1137932592.db2.gz MYNZGYISBVNNQF-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136957082 1138044707 /nfs/dbraw/zinc/04/47/07/1138044707.db2.gz VZOCPIFLSMIVGF-LJQANCHMSA-N 1 1 328.412 3.583 20 5 EHBDMO Cc1ccc(C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000136999156 1138045083 /nfs/dbraw/zinc/04/50/83/1138045083.db2.gz DAVAQHMVOUJIIL-QGZVFWFLSA-N 1 1 334.441 3.909 20 5 EHBDMO COc1cc(C)cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1OC ZINC000886122500 1138049201 /nfs/dbraw/zinc/04/92/01/1138049201.db2.gz CFTWHQFXWCKACJ-UHFFFAOYSA-N 1 1 344.411 3.945 20 5 EHBDMO Cc1cc([C@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n[nH]1 ZINC000282961662 1138089250 /nfs/dbraw/zinc/08/92/50/1138089250.db2.gz HXHIAQCPNJMODN-ZDUSSCGKSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n[nH]1 ZINC000282961662 1138089253 /nfs/dbraw/zinc/08/92/53/1138089253.db2.gz HXHIAQCPNJMODN-ZDUSSCGKSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)[nH]n1 ZINC000282961662 1138089256 /nfs/dbraw/zinc/08/92/56/1138089256.db2.gz HXHIAQCPNJMODN-ZDUSSCGKSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)[nH]n1 ZINC000282961662 1138089259 /nfs/dbraw/zinc/08/92/59/1138089259.db2.gz HXHIAQCPNJMODN-ZDUSSCGKSA-N 1 1 334.807 3.659 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907112 1138207490 /nfs/dbraw/zinc/20/74/90/1138207490.db2.gz SNDGWYGRTXGGRT-HNNXBMFYSA-N 1 1 333.413 3.577 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000089907112 1138207491 /nfs/dbraw/zinc/20/74/91/1138207491.db2.gz SNDGWYGRTXGGRT-HNNXBMFYSA-N 1 1 333.413 3.577 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000122435887 1138258454 /nfs/dbraw/zinc/25/84/54/1138258454.db2.gz SQGIVXWCKXMHBU-INIZCTEOSA-N 1 1 345.355 3.753 20 5 EHBDMO Cc1cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000337353593 1138542093 /nfs/dbraw/zinc/54/20/93/1138542093.db2.gz AEEXMXRVJQNLSL-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc3c2OCO3)cc1[N+](=O)[O-] ZINC000153116624 1139123723 /nfs/dbraw/zinc/12/37/23/1139123723.db2.gz VEMFXJXBKCJESX-GFCCVEGCSA-N 1 1 344.367 3.573 20 5 EHBDMO COc1c(C)cnc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000181822935 1139934582 /nfs/dbraw/zinc/93/45/82/1139934582.db2.gz BOBVHTHSBKOXSI-CQSZACIVSA-N 1 1 329.400 3.774 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@H]12 ZINC000182489644 1139975904 /nfs/dbraw/zinc/97/59/04/1139975904.db2.gz NZSRKSJTHQZOJM-MAZHCROVSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc(C2CCCCC2)no1 ZINC000185235314 1140141229 /nfs/dbraw/zinc/14/12/29/1140141229.db2.gz LQFILSKARJMFIY-CYBMUJFWSA-N 1 1 344.415 3.919 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCS[C@H](C)CC1 ZINC000192175632 1140508164 /nfs/dbraw/zinc/50/81/64/1140508164.db2.gz ZPILTHLLYYXTRN-NEPJUHHUSA-N 1 1 348.428 3.533 20 5 EHBDMO Nc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000193399560 1140575119 /nfs/dbraw/zinc/57/51/19/1140575119.db2.gz YRWBDWZASPMTBK-CYBMUJFWSA-N 1 1 346.456 3.563 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(F)c1 ZINC000268839516 1141005128 /nfs/dbraw/zinc/00/51/28/1141005128.db2.gz QJGOZCOZLLSRRK-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684243 1141135473 /nfs/dbraw/zinc/13/54/73/1141135473.db2.gz SHZCKIMIUIZJOO-ZWKOTPCHSA-N 1 1 330.359 3.604 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000271525781 1141387922 /nfs/dbraw/zinc/38/79/22/1141387922.db2.gz QELNQHPSGUEEQR-XKQJLSEDSA-N 1 1 340.427 3.696 20 5 EHBDMO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271624259 1141407483 /nfs/dbraw/zinc/40/74/83/1141407483.db2.gz NHWYGWRNWVUHHK-HUUCEWRRSA-N 1 1 341.411 3.889 20 5 EHBDMO Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271628926 1141408329 /nfs/dbraw/zinc/40/83/29/1141408329.db2.gz OOUPHUPCUYDZFZ-LSDHHAIUSA-N 1 1 341.411 3.889 20 5 EHBDMO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000271665261 1141415622 /nfs/dbraw/zinc/41/56/22/1141415622.db2.gz ZCLBRJODALWYSM-GJZGRUSLSA-N 1 1 341.411 3.889 20 5 EHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CCO2 ZINC000274226704 1141487669 /nfs/dbraw/zinc/48/76/69/1141487669.db2.gz CZPDOSAPACTVJG-INIZCTEOSA-N 1 1 348.786 3.870 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2OC)c([N+](=O)[O-])cc1F ZINC000274360931 1141504127 /nfs/dbraw/zinc/50/41/27/1141504127.db2.gz ZQBOSLYGJAZPEI-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000210011075 241075410 /nfs/dbraw/zinc/07/54/10/241075410.db2.gz YBUAUBRFYVHSDA-DAXSKMNVSA-N 1 1 341.386 3.569 20 5 EHBDMO CCc1ncc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000278702144 1032061486 /nfs/dbraw/zinc/06/14/86/1032061486.db2.gz JUCZMFLNVUUFFA-UHFFFAOYSA-N 1 1 345.346 3.922 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000183163796 1125463745 /nfs/dbraw/zinc/46/37/45/1125463745.db2.gz FGMSOXGTQVYRCN-ZDUSSCGKSA-N 1 1 340.358 3.770 20 5 EHBDMO CCN(CCC[NH+]1CCCC1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000579776480 1014454859 /nfs/dbraw/zinc/45/48/59/1014454859.db2.gz OVYWTANSNSQQPX-SAPNQHFASA-N 1 1 331.460 3.806 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000430192185 1014744801 /nfs/dbraw/zinc/74/48/01/1014744801.db2.gz AUSXAVDGSYMRNS-LBPRGKRZSA-N 1 1 346.431 3.714 20 5 EHBDMO COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000187128707 1014861792 /nfs/dbraw/zinc/86/17/92/1014861792.db2.gz MVEPZKNBVFPDRM-UHFFFAOYSA-N 1 1 349.390 3.955 20 5 EHBDMO CC[C@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680283 1032122434 /nfs/dbraw/zinc/12/24/34/1032122434.db2.gz LMBDJUNXJWBDFN-NVXWUHKLSA-N 1 1 340.427 3.670 20 5 EHBDMO Cc1ccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683109 1032146103 /nfs/dbraw/zinc/14/61/03/1032146103.db2.gz JZBNCHCRKCRQKA-LJQANCHMSA-N 1 1 340.423 3.775 20 5 EHBDMO Cc1cccc(N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)[nH+]1 ZINC000804702842 1016318206 /nfs/dbraw/zinc/31/82/06/1016318206.db2.gz IBQVOQPMCKKJIN-UHFFFAOYSA-N 1 1 348.200 3.623 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)cc1 ZINC000340184284 1016635987 /nfs/dbraw/zinc/63/59/87/1016635987.db2.gz SRTFLQKGOJYZSD-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO C[NH2+]Cc1noc(-c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)n1 ZINC000414498294 1016935131 /nfs/dbraw/zinc/93/51/31/1016935131.db2.gz IAWCQGNVVFPMTB-UHFFFAOYSA-N 1 1 336.417 3.502 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnc(C2CC2)s1 ZINC000414551370 1016972245 /nfs/dbraw/zinc/97/22/45/1016972245.db2.gz FMVNZURFBWQBOM-YRNVUSSQSA-N 1 1 330.413 3.517 20 5 EHBDMO C[C@@H](NCCC[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901139 1032652880 /nfs/dbraw/zinc/65/28/80/1032652880.db2.gz AUKFHQQVZZOJLD-CYBMUJFWSA-N 1 1 333.457 3.926 20 5 EHBDMO C[C@@H]([NH2+]CCCN(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901139 1032652886 /nfs/dbraw/zinc/65/28/86/1032652886.db2.gz AUKFHQQVZZOJLD-CYBMUJFWSA-N 1 1 333.457 3.926 20 5 EHBDMO CC(C)Oc1ccnc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000593031182 1032668461 /nfs/dbraw/zinc/66/84/61/1032668461.db2.gz VQWOJDBKSRTWLX-UHFFFAOYSA-N 1 1 329.400 3.802 20 5 EHBDMO COc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)nc1 ZINC000593040982 1032678445 /nfs/dbraw/zinc/67/84/45/1032678445.db2.gz LLLDSFAGKDVYDE-UHFFFAOYSA-N 1 1 345.374 3.517 20 5 EHBDMO CCN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414715203 1017150779 /nfs/dbraw/zinc/15/07/79/1017150779.db2.gz MSUINIBHQAUMCE-INIZCTEOSA-N 1 1 343.427 3.819 20 5 EHBDMO C[NH2+]CCCNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414857887 1017246563 /nfs/dbraw/zinc/24/65/63/1017246563.db2.gz GLPARWBNPARREP-UHFFFAOYSA-N 1 1 349.818 3.740 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506991 1032691262 /nfs/dbraw/zinc/69/12/62/1032691262.db2.gz ZZYMDYKZVKYOMK-INIZCTEOSA-N 1 1 342.395 3.689 20 5 EHBDMO CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000544894707 1017335024 /nfs/dbraw/zinc/33/50/24/1017335024.db2.gz VZDCTGVJRXFRBE-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544894707 1017335037 /nfs/dbraw/zinc/33/50/37/1017335037.db2.gz VZDCTGVJRXFRBE-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000544894707 1017335056 /nfs/dbraw/zinc/33/50/56/1017335056.db2.gz VZDCTGVJRXFRBE-HXUWFJFHSA-N 1 1 339.439 3.691 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)C(C)C ZINC000118833159 1017586988 /nfs/dbraw/zinc/58/69/88/1017586988.db2.gz PODNLXLQYKZLNB-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000289948203 1032732861 /nfs/dbraw/zinc/73/28/61/1032732861.db2.gz PYZDJURGYOPZNX-SWLSCSKDSA-N 1 1 334.807 3.761 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000289948203 1032732877 /nfs/dbraw/zinc/73/28/77/1032732877.db2.gz PYZDJURGYOPZNX-SWLSCSKDSA-N 1 1 334.807 3.761 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCCCC2)C1 ZINC001167341528 1018315241 /nfs/dbraw/zinc/31/52/41/1018315241.db2.gz KHIJRYIDPYTKLL-OAHLLOKOSA-N 1 1 345.443 3.968 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371727 1018549142 /nfs/dbraw/zinc/54/91/42/1018549142.db2.gz KNYDTKVMPGRTCO-RDJZCZTQSA-N 1 1 338.473 3.970 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H]3C3CCC3)c2)cc1 ZINC000728900958 1032786878 /nfs/dbraw/zinc/78/68/78/1032786878.db2.gz YREVQRCTAYXKDK-SFHVURJKSA-N 1 1 326.400 3.680 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@H](CCO)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000592402867 1032798349 /nfs/dbraw/zinc/79/83/49/1032798349.db2.gz LCOIQLXINFNTDA-SUMWQHHRSA-N 1 1 332.375 3.817 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000182916190 1019782347 /nfs/dbraw/zinc/78/23/47/1019782347.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 1 1 343.471 3.913 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000182916190 1019782360 /nfs/dbraw/zinc/78/23/60/1019782360.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 1 1 343.471 3.913 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000182916190 1019782373 /nfs/dbraw/zinc/78/23/73/1019782373.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 1 1 343.471 3.913 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1ccccc1[N+](=O)[O-] ZINC000610451913 1019864993 /nfs/dbraw/zinc/86/49/93/1019864993.db2.gz NWAJOBKVUCKRBY-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](c1nccn1C)C1CC1 ZINC000602440688 1032890728 /nfs/dbraw/zinc/89/07/28/1032890728.db2.gz RQZBDWORYOOVGT-KRWDZBQOSA-N 1 1 328.416 3.690 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](c1nccn1C)C1CC1 ZINC000602440688 1032890745 /nfs/dbraw/zinc/89/07/45/1032890745.db2.gz RQZBDWORYOOVGT-KRWDZBQOSA-N 1 1 328.416 3.690 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651995 1020566993 /nfs/dbraw/zinc/56/69/93/1020566993.db2.gz ZGZXJYCHAWXCHH-SFHVURJKSA-N 1 1 345.399 3.641 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488556 1032919681 /nfs/dbraw/zinc/91/96/81/1032919681.db2.gz ZHKFHFQPDXPOKO-RYUDHWBXSA-N 1 1 336.823 3.606 20 5 EHBDMO Cc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602515534 1032929701 /nfs/dbraw/zinc/92/97/01/1032929701.db2.gz XSEQSCSDXGWGBJ-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417368 1020818914 /nfs/dbraw/zinc/81/89/14/1020818914.db2.gz PSRKECAYOSWZQN-QGZVFWFLSA-N 1 1 336.395 3.700 20 5 EHBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000516383816 1021373483 /nfs/dbraw/zinc/37/34/83/1021373483.db2.gz SEFRYFLMRJXKCT-UHFFFAOYSA-N 1 1 335.451 3.848 20 5 EHBDMO Cc1c(C[N@@H+](C)CCCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000439465123 1021458494 /nfs/dbraw/zinc/45/84/94/1021458494.db2.gz DZSUAWWCGNMPEN-UHFFFAOYSA-N 1 1 328.412 3.942 20 5 EHBDMO C[N@@H+](CCCOCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000439482805 1021489944 /nfs/dbraw/zinc/48/99/44/1021489944.db2.gz YJNTVPZSYCCMLJ-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453582 1021624102 /nfs/dbraw/zinc/62/41/02/1021624102.db2.gz HQKURWMNINJHKO-JQWIXIFHSA-N 1 1 342.342 3.579 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453583 1021624185 /nfs/dbraw/zinc/62/41/85/1021624185.db2.gz HQKURWMNINJHKO-PWSUYJOCSA-N 1 1 342.342 3.579 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000441173630 1022032475 /nfs/dbraw/zinc/03/24/75/1022032475.db2.gz CNLLEDBNAKUUBN-DOJUMQAQSA-N 1 1 340.427 3.749 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1[N+](=O)[O-] ZINC000891619003 1022114891 /nfs/dbraw/zinc/11/48/91/1022114891.db2.gz YNVBPSXEXMGUMC-ZDUSSCGKSA-N 1 1 334.397 3.708 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H]2c2ccsc2)c1[N+](=O)[O-] ZINC000891619003 1022114901 /nfs/dbraw/zinc/11/49/01/1022114901.db2.gz YNVBPSXEXMGUMC-ZDUSSCGKSA-N 1 1 334.397 3.708 20 5 EHBDMO O=c1[nH]c2cccc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)c2o1 ZINC000891624181 1022140334 /nfs/dbraw/zinc/14/03/34/1022140334.db2.gz URZMHUDNMXBKHU-UHFFFAOYSA-N 1 1 339.351 3.606 20 5 EHBDMO O=c1[nH]c2cccc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)c2o1 ZINC000891624181 1022140342 /nfs/dbraw/zinc/14/03/42/1022140342.db2.gz URZMHUDNMXBKHU-UHFFFAOYSA-N 1 1 339.351 3.606 20 5 EHBDMO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC000053017059 1022449098 /nfs/dbraw/zinc/44/90/98/1022449098.db2.gz LEVDFJSMJQNLOC-UHFFFAOYSA-N 1 1 349.390 3.819 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC000053017059 1022449107 /nfs/dbraw/zinc/44/91/07/1022449107.db2.gz LEVDFJSMJQNLOC-UHFFFAOYSA-N 1 1 349.390 3.819 20 5 EHBDMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968575 1022521868 /nfs/dbraw/zinc/52/18/68/1022521868.db2.gz SNCIJFJQJCVWMF-OLZOCXBDSA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H](CCO)c3ccco3)o2)c1 ZINC000184517781 1022573110 /nfs/dbraw/zinc/57/31/10/1022573110.db2.gz PUOIXLXSHPYYSS-MRXNPFEDSA-N 1 1 342.351 3.661 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719612 1022791410 /nfs/dbraw/zinc/79/14/10/1022791410.db2.gz PEHRBYNKUVQWSP-QGZVFWFLSA-N 1 1 340.427 3.896 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C2CC2)n1 ZINC000894723772 1022821273 /nfs/dbraw/zinc/82/12/73/1022821273.db2.gz PLIIYLSILZFIIR-INIZCTEOSA-N 1 1 340.427 3.585 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1ccccc1)[C@H]1CCCC1(C)C ZINC000426809713 1023059424 /nfs/dbraw/zinc/05/94/24/1023059424.db2.gz FRBKJEPUGVGQFY-KRWDZBQOSA-N 1 1 342.443 3.909 20 5 EHBDMO CN1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427928 1023120609 /nfs/dbraw/zinc/12/06/09/1023120609.db2.gz YTVVKTTXXKFSGH-AWEZNQCLSA-N 1 1 345.468 3.755 20 5 EHBDMO C[C@@H](CNc1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000341743223 1023237908 /nfs/dbraw/zinc/23/79/08/1023237908.db2.gz OOZPTKLROAZQMZ-NSHDSACASA-N 1 1 335.404 3.654 20 5 EHBDMO C[C@@H](CNc1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000341743223 1023237913 /nfs/dbraw/zinc/23/79/13/1023237913.db2.gz OOZPTKLROAZQMZ-NSHDSACASA-N 1 1 335.404 3.654 20 5 EHBDMO CCOc1cc(C[NH+]2CCC(C(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000276884769 1023292452 /nfs/dbraw/zinc/29/24/52/1023292452.db2.gz JEQKYPSPRZBKGE-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000610782632 1023508555 /nfs/dbraw/zinc/50/85/55/1023508555.db2.gz ZVPQCGUZXOVDIO-UHFFFAOYSA-N 1 1 343.214 3.539 20 5 EHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000535799469 1023646583 /nfs/dbraw/zinc/64/65/83/1023646583.db2.gz QDNHRWUFFNRLCY-HUUCEWRRSA-N 1 1 342.443 3.863 20 5 EHBDMO CC(C)[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(Cl)cc1F ZINC000602805801 1033178452 /nfs/dbraw/zinc/17/84/52/1033178452.db2.gz QFOOVUVGPVQZAK-CQSZACIVSA-N 1 1 340.786 3.608 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000602838730 1033199923 /nfs/dbraw/zinc/19/99/23/1033199923.db2.gz BPCPRJVHMYXZSY-GOSISDBHSA-N 1 1 340.427 3.717 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@H](Oc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001226586692 1024434519 /nfs/dbraw/zinc/43/45/19/1024434519.db2.gz YJMBFAQDZKCWMO-LBPRGKRZSA-N 1 1 343.221 3.609 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](Oc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001226586692 1024434524 /nfs/dbraw/zinc/43/45/24/1024434524.db2.gz YJMBFAQDZKCWMO-LBPRGKRZSA-N 1 1 343.221 3.609 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000071809504 1024441879 /nfs/dbraw/zinc/44/18/79/1024441879.db2.gz WBZKUHYBJCNKNS-KRWDZBQOSA-N 1 1 342.395 3.647 20 5 EHBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895406240 1024479054 /nfs/dbraw/zinc/47/90/54/1024479054.db2.gz WVMLPUNLPSYGLE-UHFFFAOYSA-N 1 1 334.807 3.539 20 5 EHBDMO C[N@@H+](CCCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435048715 1024577187 /nfs/dbraw/zinc/57/71/87/1024577187.db2.gz BSAZZNIREVZQNF-UHFFFAOYSA-N 1 1 334.441 3.918 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)CO1 ZINC000508017255 1024845058 /nfs/dbraw/zinc/84/50/58/1024845058.db2.gz SYVNJKOIOGYZML-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)CO1 ZINC000508017255 1024845082 /nfs/dbraw/zinc/84/50/82/1024845082.db2.gz SYVNJKOIOGYZML-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2OC)c([N+](=O)[O-])cc1F ZINC000274360930 1024895705 /nfs/dbraw/zinc/89/57/05/1024895705.db2.gz ZQBOSLYGJAZPEI-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cn1 ZINC000119672306 1025162348 /nfs/dbraw/zinc/16/23/48/1025162348.db2.gz PIJLNMUIZGDNAD-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO C[C@@H]1C[NH+](C(C)(C)CNc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000515341087 1025179386 /nfs/dbraw/zinc/17/93/86/1025179386.db2.gz XDQDJCKGJGUGAF-VXGBXAGGSA-N 1 1 341.839 3.548 20 5 EHBDMO Cc1ccccc1[C@H]([C@@H](C)NCc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000442997118 1025640326 /nfs/dbraw/zinc/64/03/26/1025640326.db2.gz YZNSVQYINLHLBN-BEFAXECRSA-N 1 1 327.428 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](COc3ccccc3)C2)cc1 ZINC000505818685 1025719678 /nfs/dbraw/zinc/71/96/78/1025719678.db2.gz KDSWHZGGDOHJEX-KRWDZBQOSA-N 1 1 326.396 3.538 20 5 EHBDMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1ccccc1 ZINC000521859624 1025734998 /nfs/dbraw/zinc/73/49/98/1025734998.db2.gz KSDVQNJSEAQGRN-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1ccccc1 ZINC000521859624 1025735011 /nfs/dbraw/zinc/73/50/11/1025735011.db2.gz KSDVQNJSEAQGRN-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000522106657 1025976201 /nfs/dbraw/zinc/97/62/01/1025976201.db2.gz BKGBXNFHEBZTHM-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO Cc1cc(N2CC[NH+](C/C=C\c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000522167858 1026049398 /nfs/dbraw/zinc/04/93/98/1026049398.db2.gz WSWLDJQKWHCQJJ-YVMONPNESA-N 1 1 337.423 3.739 20 5 EHBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718832 1026365205 /nfs/dbraw/zinc/36/52/05/1026365205.db2.gz PXQYOAHJBFLIAI-DZGCQCFKSA-N 1 1 330.384 3.590 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000451961647 1026399183 /nfs/dbraw/zinc/39/91/83/1026399183.db2.gz DUUZEKKEGVTDSL-QGZVFWFLSA-N 1 1 336.457 3.713 20 5 EHBDMO CC(C)(CN1CCCC1)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452100428 1026476372 /nfs/dbraw/zinc/47/63/72/1026476372.db2.gz ZWZQZCNKDBBRLT-UHFFFAOYSA-N 1 1 345.365 3.578 20 5 EHBDMO CC(=O)c1ccc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318094 1026580892 /nfs/dbraw/zinc/58/08/92/1026580892.db2.gz RKXZWMLXMKUJCN-AWEZNQCLSA-N 1 1 341.411 3.730 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000531202478 1026684110 /nfs/dbraw/zinc/68/41/10/1026684110.db2.gz ZPWOFXDEQVNEJP-WMLDXEAASA-N 1 1 326.396 3.981 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c(F)c1 ZINC000384257721 1026794906 /nfs/dbraw/zinc/79/49/06/1026794906.db2.gz BYZMHUIVZYGEIL-MRXNPFEDSA-N 1 1 344.386 3.773 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000501576381 1027377375 /nfs/dbraw/zinc/37/73/75/1027377375.db2.gz FSOFORQSDLXMLP-UHFFFAOYSA-N 1 1 348.447 3.679 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(CCC[NH+](C)C)CC1 ZINC000501776710 1027531989 /nfs/dbraw/zinc/53/19/89/1027531989.db2.gz RDKTXYVXRCGSNI-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO Cc1c(CN[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663383 1027579611 /nfs/dbraw/zinc/57/96/11/1027579611.db2.gz FKFXORYIULODQB-DNVCBOLYSA-N 1 1 339.439 3.656 20 5 EHBDMO Cc1c(CN[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663383 1027579626 /nfs/dbraw/zinc/57/96/26/1027579626.db2.gz FKFXORYIULODQB-DNVCBOLYSA-N 1 1 339.439 3.656 20 5 EHBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000532665310 1027586721 /nfs/dbraw/zinc/58/67/21/1027586721.db2.gz GXHAVDWONLJWFR-UHFFFAOYSA-N 1 1 329.400 3.913 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000475556002 1027597929 /nfs/dbraw/zinc/59/79/29/1027597929.db2.gz ZRJJDNKSXBPNMV-CABCVRRESA-N 1 1 348.447 3.596 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420951916 1027916780 /nfs/dbraw/zinc/91/67/80/1027916780.db2.gz RIZWGNORHYERGG-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO CC(C)CC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000053361043 1027962787 /nfs/dbraw/zinc/96/27/87/1027962787.db2.gz NNITTZVHQGQIRV-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533529467 1028022200 /nfs/dbraw/zinc/02/22/00/1028022200.db2.gz IQUPKARJKUZEFK-ZDUSSCGKSA-N 1 1 326.462 3.955 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000444698571 1028172420 /nfs/dbraw/zinc/17/24/20/1028172420.db2.gz MFTJUKRWGFZRFA-LBPRGKRZSA-N 1 1 332.322 3.638 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000444764380 1028251876 /nfs/dbraw/zinc/25/18/76/1028251876.db2.gz BCZFQVPXPINLHX-AWEZNQCLSA-N 1 1 330.388 3.513 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CN)C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263495 1028301402 /nfs/dbraw/zinc/30/14/02/1028301402.db2.gz ONIYCTQSCNLKDS-CJNGLKHVSA-N 1 1 335.448 3.552 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]34CCOC4)s2)cc1 ZINC000421400055 1028347806 /nfs/dbraw/zinc/34/78/06/1028347806.db2.gz QZJQAQUODNXOMI-QGZVFWFLSA-N 1 1 330.409 3.688 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](CCO)CC3)o2)cc1 ZINC000421401229 1028349342 /nfs/dbraw/zinc/34/93/42/1028349342.db2.gz TYVYPLRRDKZHGC-OAHLLOKOSA-N 1 1 344.411 3.839 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2ccc(C)cc21 ZINC000178729570 1028376560 /nfs/dbraw/zinc/37/65/60/1028376560.db2.gz LANCBNIQHXYBQA-KRWDZBQOSA-N 1 1 342.395 3.915 20 5 EHBDMO COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000519917881 1028380004 /nfs/dbraw/zinc/38/00/04/1028380004.db2.gz OREATMPERFCALH-INIZCTEOSA-N 1 1 344.411 3.683 20 5 EHBDMO CCc1ccc([C@H](N[C@H]2CC[C@@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513802 1028489956 /nfs/dbraw/zinc/48/99/56/1028489956.db2.gz RNQSIBIAACHOPK-FRIZHTMISA-N 1 1 343.427 3.557 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC000523790736 1028606151 /nfs/dbraw/zinc/60/61/51/1028606151.db2.gz XHMRWTWFJFHRRD-GOSISDBHSA-N 1 1 344.436 3.764 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523856121 1028684030 /nfs/dbraw/zinc/68/40/30/1028684030.db2.gz DCJWUEZWCYOGJS-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000324831818 1028693294 /nfs/dbraw/zinc/69/32/94/1028693294.db2.gz CGGCNELQSNNSOE-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925022 1029109765 /nfs/dbraw/zinc/10/97/65/1029109765.db2.gz RSHIXXWFPALGIU-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925022 1029109775 /nfs/dbraw/zinc/10/97/75/1029109775.db2.gz RSHIXXWFPALGIU-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000532969602 1029116491 /nfs/dbraw/zinc/11/64/91/1029116491.db2.gz JZHTZHYUPDNGPH-MRXNPFEDSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000324882771 1029358754 /nfs/dbraw/zinc/35/87/54/1029358754.db2.gz QRRLXVIMQJPTJJ-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO CC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533299915 1029602648 /nfs/dbraw/zinc/60/26/48/1029602648.db2.gz QZJWCCHTONFXCT-HNNXBMFYSA-N 1 1 333.432 3.744 20 5 EHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271930 1029768068 /nfs/dbraw/zinc/76/80/68/1029768068.db2.gz VNGKAPBOZWYRSO-LJQANCHMSA-N 1 1 325.412 3.998 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc(F)cc1[N+](=O)[O-] ZINC000525357040 1029808910 /nfs/dbraw/zinc/80/89/10/1029808910.db2.gz CVDDRSUYKHGXJL-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCC[C@H]1O ZINC000428458060 1029861313 /nfs/dbraw/zinc/86/13/13/1029861313.db2.gz BQWYIFKVJIUPOX-IAGOWNOFSA-N 1 1 330.384 3.590 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000441190318 1029900435 /nfs/dbraw/zinc/90/04/35/1029900435.db2.gz RKPGYEMODUMNJM-OAHLLOKOSA-N 1 1 348.424 3.881 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509651889 1029948424 /nfs/dbraw/zinc/94/84/24/1029948424.db2.gz LUZAJRHOLHHWPW-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509651889 1029948439 /nfs/dbraw/zinc/94/84/39/1029948439.db2.gz LUZAJRHOLHHWPW-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509651891 1029948494 /nfs/dbraw/zinc/94/84/94/1029948494.db2.gz LUZAJRHOLHHWPW-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509651891 1029948509 /nfs/dbraw/zinc/94/85/09/1029948509.db2.gz LUZAJRHOLHHWPW-LBPRGKRZSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1C ZINC000525709361 1030049531 /nfs/dbraw/zinc/04/95/31/1030049531.db2.gz VNFCZCWSPMQWII-DZGCQCFKSA-N 1 1 345.468 3.896 20 5 EHBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1C ZINC000525709361 1030049549 /nfs/dbraw/zinc/04/95/49/1030049549.db2.gz VNFCZCWSPMQWII-DZGCQCFKSA-N 1 1 345.468 3.896 20 5 EHBDMO CCOc1ccc([C@@H](C)[N@H+]2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365347 1030181198 /nfs/dbraw/zinc/18/11/98/1030181198.db2.gz LVARIAAIFKWXAN-RDTXWAMCSA-N 1 1 334.416 3.557 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594501 1030330125 /nfs/dbraw/zinc/33/01/25/1030330125.db2.gz ZHZQKXUOYBHFRW-PBHICJAKSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000447594501 1030330144 /nfs/dbraw/zinc/33/01/44/1030330144.db2.gz ZHZQKXUOYBHFRW-PBHICJAKSA-N 1 1 347.459 3.661 20 5 EHBDMO CC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1F ZINC000593064281 1030348040 /nfs/dbraw/zinc/34/80/40/1030348040.db2.gz MMWKJTGDBMBTPT-HNNXBMFYSA-N 1 1 345.374 3.722 20 5 EHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@H+]1C1CC1 ZINC000583666503 1030392922 /nfs/dbraw/zinc/39/29/22/1030392922.db2.gz BXUPSIHINWMCBK-JSGCOSHPSA-N 1 1 333.432 3.809 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000532351998 1030576743 /nfs/dbraw/zinc/57/67/43/1030576743.db2.gz PPNTUSQOZHUDSB-HNAYVOBHSA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000532351998 1030576752 /nfs/dbraw/zinc/57/67/52/1030576752.db2.gz PPNTUSQOZHUDSB-HNAYVOBHSA-N 1 1 326.396 3.903 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001168147752 1030926699 /nfs/dbraw/zinc/92/66/99/1030926699.db2.gz XGVHKKZJMOUKEW-MRXNPFEDSA-N 1 1 347.459 3.990 20 5 EHBDMO Cc1nn(C[N@@H+](C)CCc2ccccc2F)c2cc([N+](=O)[O-])ccc12 ZINC000761289710 1033471986 /nfs/dbraw/zinc/47/19/86/1033471986.db2.gz ARGHDNBWCOHIDY-UHFFFAOYSA-N 1 1 342.374 3.524 20 5 EHBDMO O=C(CC[N@H+]1CC[C@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000594716278 1033500972 /nfs/dbraw/zinc/50/09/72/1033500972.db2.gz NYDMNLVVRNHBDY-INIZCTEOSA-N 1 1 343.358 3.510 20 5 EHBDMO CC(C)[C@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000594990430 1033620931 /nfs/dbraw/zinc/62/09/31/1033620931.db2.gz QMAGQUQLOMQTSO-ROUUACIJSA-N 1 1 332.375 3.582 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000595330987 1033729505 /nfs/dbraw/zinc/72/95/05/1033729505.db2.gz GXUWIPXFDQODRF-GDBMZVCRSA-N 1 1 329.400 3.907 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841253 1033964605 /nfs/dbraw/zinc/96/46/05/1033964605.db2.gz ZRQVWDSMAGYQGP-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO CC1(C)C[C@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000595908044 1034027223 /nfs/dbraw/zinc/02/72/23/1034027223.db2.gz FACBMWPHJDFUGV-IBGZPJMESA-N 1 1 336.395 3.886 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])c(OC)c1 ZINC000599596238 1034034217 /nfs/dbraw/zinc/03/42/17/1034034217.db2.gz NPVZYHSPJNWRMX-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092472 1034079796 /nfs/dbraw/zinc/07/97/96/1034079796.db2.gz ANXVASDKIBDLBR-JXFKEZNVSA-N 1 1 343.471 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092472 1034079810 /nfs/dbraw/zinc/07/98/10/1034079810.db2.gz ANXVASDKIBDLBR-JXFKEZNVSA-N 1 1 343.471 3.684 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CC2)CC1 ZINC000599672175 1034081180 /nfs/dbraw/zinc/08/11/80/1034081180.db2.gz BXCKGCQLPWALNM-CYBMUJFWSA-N 1 1 342.399 3.972 20 5 EHBDMO CCOc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000179315639 1034108438 /nfs/dbraw/zinc/10/84/38/1034108438.db2.gz NZWIOHKGXBJDTI-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000179315639 1034108446 /nfs/dbraw/zinc/10/84/46/1034108446.db2.gz NZWIOHKGXBJDTI-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1cccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596570813 1034292923 /nfs/dbraw/zinc/29/29/23/1034292923.db2.gz OHDDICJRCOIQQN-HNNXBMFYSA-N 1 1 333.432 3.527 20 5 EHBDMO CC(C)[N@H+](Cc1c(C2CC2)cnn1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980179 1034479295 /nfs/dbraw/zinc/47/92/95/1034479295.db2.gz UYERWEVPCYYACL-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO CC(C)[N@@H+](Cc1c(C2CC2)cnn1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980179 1034479303 /nfs/dbraw/zinc/47/93/03/1034479303.db2.gz UYERWEVPCYYACL-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(CO)CCC1 ZINC000597254363 1034627625 /nfs/dbraw/zinc/62/76/25/1034627625.db2.gz KEERIOLQSATZCT-UHFFFAOYSA-N 1 1 332.425 3.670 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000597257603 1034629733 /nfs/dbraw/zinc/62/97/33/1034629733.db2.gz HDWQWBINSMRLQQ-AUWJEWJLSA-N 1 1 340.427 3.806 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000511460751 1035472332 /nfs/dbraw/zinc/47/23/32/1035472332.db2.gz MUDQTTOAUDYIRC-TWGQIWQCSA-N 1 1 337.423 3.820 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204722 1035822581 /nfs/dbraw/zinc/82/25/81/1035822581.db2.gz ASUXXYDDVNSMKR-BEFAXECRSA-N 1 1 341.411 3.842 20 5 EHBDMO C[C@@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414191497 1035976366 /nfs/dbraw/zinc/97/63/66/1035976366.db2.gz UDHGDWJATBFGTH-FUEDEBDSSA-N 1 1 348.424 3.580 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000463951742 1035994527 /nfs/dbraw/zinc/99/45/27/1035994527.db2.gz BVQRSDNXQODSDR-CABCVRRESA-N 1 1 348.447 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000535077671 1036000446 /nfs/dbraw/zinc/00/04/46/1036000446.db2.gz XWGVQEOXAIVLJE-JHAQOBCDSA-N 1 1 344.333 3.651 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000535077671 1036000469 /nfs/dbraw/zinc/00/04/69/1036000469.db2.gz XWGVQEOXAIVLJE-JHAQOBCDSA-N 1 1 344.333 3.651 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2c(F)cccc2OC)ccc1[N+](=O)[O-] ZINC000492579588 1036025573 /nfs/dbraw/zinc/02/55/73/1036025573.db2.gz BBRKLTAALYJSCU-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630728 1036061341 /nfs/dbraw/zinc/06/13/41/1036061341.db2.gz DNYIMVCWWHBMAJ-OCCSQVGLSA-N 1 1 346.818 3.891 20 5 EHBDMO CCOc1cc(C[N@@H+](C)Cc2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC000492751135 1036247652 /nfs/dbraw/zinc/24/76/52/1036247652.db2.gz RTDWTFQLJCREKM-UHFFFAOYSA-N 1 1 343.427 3.692 20 5 EHBDMO CC(C)Oc1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000892600698 1036494926 /nfs/dbraw/zinc/49/49/26/1036494926.db2.gz MTCSXXRHIRXBBC-UHFFFAOYSA-N 1 1 335.791 3.720 20 5 EHBDMO COc1cccc([C@@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000464497469 1036510863 /nfs/dbraw/zinc/51/08/63/1036510863.db2.gz YIOYBQCHIGDKOS-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)Cc1ccc(OC)cc1OC ZINC000541773687 1036643577 /nfs/dbraw/zinc/64/35/77/1036643577.db2.gz IEEYIYODOFYWCM-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000464774909 1036764458 /nfs/dbraw/zinc/76/44/58/1036764458.db2.gz LPKBJSMZQDEVLM-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC[C@@H]1CCCC[N@@H+]1C ZINC000760792870 1037072295 /nfs/dbraw/zinc/07/22/95/1037072295.db2.gz LYRFKZYGNIRCQX-ZDUSSCGKSA-N 1 1 340.807 3.588 20 5 EHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829593 1037256223 /nfs/dbraw/zinc/25/62/23/1037256223.db2.gz REKKBSJDDNWHES-BBRMVZONSA-N 1 1 328.416 3.616 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c1 ZINC000462701930 1037302704 /nfs/dbraw/zinc/30/27/04/1037302704.db2.gz PBXMVOLFWPTPRM-AWEZNQCLSA-N 1 1 331.441 3.848 20 5 EHBDMO COC(=O)c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000271796879 1037312917 /nfs/dbraw/zinc/31/29/17/1037312917.db2.gz OOOQZMUSQBEPJS-VXGBXAGGSA-N 1 1 332.356 3.695 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)o1 ZINC000539891717 1037314361 /nfs/dbraw/zinc/31/43/61/1037314361.db2.gz ZJAGFPLPTUJVIX-RHSMWYFYSA-N 1 1 342.395 3.856 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899994 1037341738 /nfs/dbraw/zinc/34/17/38/1037341738.db2.gz MFHWOCCRKNSHRX-DLBZAZTESA-N 1 1 332.444 3.967 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462921743 1037562932 /nfs/dbraw/zinc/56/29/32/1037562932.db2.gz JERSJMKSUIRRMG-LBPRGKRZSA-N 1 1 343.374 3.873 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)C ZINC000463379447 1038100200 /nfs/dbraw/zinc/10/02/00/1038100200.db2.gz STAAJUXTXIEGDP-UHFFFAOYSA-N 1 1 327.812 3.555 20 5 EHBDMO C[C@H]1C[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2C(C)(C)C)CC[N@H+]1C ZINC000893168248 1038129847 /nfs/dbraw/zinc/12/98/47/1038129847.db2.gz BADWDSAZCGGFAP-STQMWFEESA-N 1 1 333.432 3.561 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490973 /nfs/dbraw/zinc/49/09/73/1038490973.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 1 1 333.476 3.882 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491103 /nfs/dbraw/zinc/49/11/03/1038491103.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 1 1 333.476 3.882 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2cccnc21 ZINC000382056748 1038520159 /nfs/dbraw/zinc/52/01/59/1038520159.db2.gz XNUDLGWSLKSSBJ-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959428 1038697310 /nfs/dbraw/zinc/69/73/10/1038697310.db2.gz PLTVMAQXRFUFKC-QAPCUYQASA-N 1 1 329.375 3.900 20 5 EHBDMO Cc1ccc(N2CCC(Nc3cc(C)c([N+](=O)[O-])cc3F)CC2)[nH+]c1 ZINC000461970100 1038704229 /nfs/dbraw/zinc/70/42/29/1038704229.db2.gz JPSLSSNCQFTKCE-UHFFFAOYSA-N 1 1 344.390 3.827 20 5 EHBDMO CC(C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1 ZINC000129043566 1039324671 /nfs/dbraw/zinc/32/46/71/1039324671.db2.gz SLEFWJZCDKIWIM-UHFFFAOYSA-N 1 1 337.395 3.716 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1CO ZINC000249068151 1039381081 /nfs/dbraw/zinc/38/10/81/1039381081.db2.gz JEGGOZVALSRULW-WBMJQRKESA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000478443356 1039455138 /nfs/dbraw/zinc/45/51/38/1039455138.db2.gz JUMRSLOTVWULCT-LLVKDONJSA-N 1 1 344.802 3.986 20 5 EHBDMO CCC1(CC)CC[NH+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000485885577 1039673832 /nfs/dbraw/zinc/67/38/32/1039673832.db2.gz ZOKASNHUCBYJJY-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298580 1039814795 /nfs/dbraw/zinc/81/47/95/1039814795.db2.gz WZEQYKDAVIBUKV-NWDGAFQWSA-N 1 1 341.839 3.943 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000930868623 1039953076 /nfs/dbraw/zinc/95/30/76/1039953076.db2.gz XLUJTGOKRSABMR-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000930868623 1039953087 /nfs/dbraw/zinc/95/30/87/1039953087.db2.gz XLUJTGOKRSABMR-GFCCVEGCSA-N 1 1 347.159 3.588 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000428731540 1040118366 /nfs/dbraw/zinc/11/83/66/1040118366.db2.gz YLQDEJMMVNEEAL-CVEARBPZSA-N 1 1 340.370 3.859 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000555314484 1040412280 /nfs/dbraw/zinc/41/22/80/1040412280.db2.gz AXSMHBWNIZCHQG-IBGZPJMESA-N 1 1 346.402 3.548 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769535 1040425099 /nfs/dbraw/zinc/42/50/99/1040425099.db2.gz FFQDXJPJAMMJGN-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070431 1040435252 /nfs/dbraw/zinc/43/52/52/1040435252.db2.gz BJRNXKRCHVMLRM-OAHLLOKOSA-N 1 1 333.432 3.968 20 5 EHBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355742 1040768650 /nfs/dbraw/zinc/76/86/50/1040768650.db2.gz WCDDTPNNRMXCRJ-VQTJNVASSA-N 1 1 345.446 3.745 20 5 EHBDMO CCC[N@@H+]1CC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173350 1040992060 /nfs/dbraw/zinc/99/20/60/1040992060.db2.gz GHBAZFJDXQENIC-KSSFIOAISA-N 1 1 331.460 3.639 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173350 1040992077 /nfs/dbraw/zinc/99/20/77/1040992077.db2.gz GHBAZFJDXQENIC-KSSFIOAISA-N 1 1 331.460 3.639 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c(F)c1 ZINC000586768622 1041008069 /nfs/dbraw/zinc/00/80/69/1041008069.db2.gz TXWJYHSIXCUWJE-QWHCGFSZSA-N 1 1 340.370 3.512 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c(F)c1 ZINC000586768622 1041008083 /nfs/dbraw/zinc/00/80/83/1041008083.db2.gz TXWJYHSIXCUWJE-QWHCGFSZSA-N 1 1 340.370 3.512 20 5 EHBDMO O=[N+]([O-])c1ccc(S[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000425289232 1041096149 /nfs/dbraw/zinc/09/61/49/1041096149.db2.gz ZCYUOCBMWBBVOP-MRXNPFEDSA-N 1 1 329.425 3.747 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000249363856 1041130833 /nfs/dbraw/zinc/13/08/33/1041130833.db2.gz VIVDZQFUMHBLJW-PXAZEXFGSA-N 1 1 346.456 3.734 20 5 EHBDMO COc1nc(C)cc(C)c1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292212218 1041168469 /nfs/dbraw/zinc/16/84/69/1041168469.db2.gz UEFXFLSWGNXEHX-UHFFFAOYSA-N 1 1 329.400 3.640 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](c1ccccc1F)[C@@H](C)O ZINC000571289423 1041255763 /nfs/dbraw/zinc/25/57/63/1041255763.db2.gz BCLNJESRCNVZAB-JCGVRSQUSA-N 1 1 332.375 3.815 20 5 EHBDMO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593642 1041373154 /nfs/dbraw/zinc/37/31/54/1041373154.db2.gz KIRTVSKWOUTVJY-OLZOCXBDSA-N 1 1 347.390 3.742 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])oc1C ZINC000292452233 1041594410 /nfs/dbraw/zinc/59/44/10/1041594410.db2.gz OATIIUDZRBMLHJ-WDEREUQCSA-N 1 1 332.356 3.695 20 5 EHBDMO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000047406592 1041629602 /nfs/dbraw/zinc/62/96/02/1041629602.db2.gz WDRYGESHZZKCTH-UHFFFAOYSA-N 1 1 338.367 3.667 20 5 EHBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000047406592 1041629604 /nfs/dbraw/zinc/62/96/04/1041629604.db2.gz WDRYGESHZZKCTH-UHFFFAOYSA-N 1 1 338.367 3.667 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000511837982 1041684909 /nfs/dbraw/zinc/68/49/09/1041684909.db2.gz KUCYAYKTDJCAOP-RISCZKNCSA-N 1 1 326.343 3.961 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432177625 1041694865 /nfs/dbraw/zinc/69/48/65/1041694865.db2.gz JTQPALKYSWQTQP-UHFFFAOYSA-N 1 1 336.823 3.924 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000093889140 1042576781 /nfs/dbraw/zinc/57/67/81/1042576781.db2.gz BOLIXRGAGDXEAI-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000093889140 1042576784 /nfs/dbraw/zinc/57/67/84/1042576784.db2.gz BOLIXRGAGDXEAI-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO COc1c(O)ccc(CNc2c(C)cc([NH+](C)C)cc2C)c1[N+](=O)[O-] ZINC000893587929 1042771472 /nfs/dbraw/zinc/77/14/72/1042771472.db2.gz MPSXGRNYHHSTMO-UHFFFAOYSA-N 1 1 345.399 3.604 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1F ZINC000291235459 1042787921 /nfs/dbraw/zinc/78/79/21/1042787921.db2.gz UMBLVXLIQURAOC-KYJSFNMBSA-N 1 1 336.407 3.640 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000182061917 1043258917 /nfs/dbraw/zinc/25/89/17/1043258917.db2.gz RSXJWXFSOCAVIX-INIZCTEOSA-N 1 1 346.358 3.746 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728900055 1043812869 /nfs/dbraw/zinc/81/28/69/1043812869.db2.gz BBYLZYDCFCLLQK-GOSISDBHSA-N 1 1 328.416 3.926 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccc(F)cn2)o1 ZINC000344935134 1044700917 /nfs/dbraw/zinc/70/09/17/1044700917.db2.gz VWBFHORQDAZLFI-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1CC(C)C ZINC000500465832 1044879552 /nfs/dbraw/zinc/87/95/52/1044879552.db2.gz KHZCEINGVSCTNK-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000183295522 1125517285 /nfs/dbraw/zinc/51/72/85/1125517285.db2.gz YQTFYDOLXLXBQX-SFHVURJKSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000183295522 1125517291 /nfs/dbraw/zinc/51/72/91/1125517291.db2.gz YQTFYDOLXLXBQX-SFHVURJKSA-N 1 1 330.384 3.677 20 5 EHBDMO C[C@H]1C[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301398461 1127740850 /nfs/dbraw/zinc/74/08/50/1127740850.db2.gz ARWFIRQVVHLYJM-JQWIXIFHSA-N 1 1 331.338 3.533 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cs1 ZINC000282180656 1128037274 /nfs/dbraw/zinc/03/72/74/1128037274.db2.gz VTYMTMUMFTVEAU-CQSZACIVSA-N 1 1 346.456 3.569 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cs1 ZINC000282180656 1128037278 /nfs/dbraw/zinc/03/72/78/1128037278.db2.gz VTYMTMUMFTVEAU-CQSZACIVSA-N 1 1 346.456 3.569 20 5 EHBDMO C[C@H](C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000554279119 1128633520 /nfs/dbraw/zinc/63/35/20/1128633520.db2.gz FELCITXMSFYHBP-CVEARBPZSA-N 1 1 328.412 3.581 20 5 EHBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000172619116 1128736622 /nfs/dbraw/zinc/73/66/22/1128736622.db2.gz JHKLFYKYDKZEEI-NVXWUHKLSA-N 1 1 347.462 3.943 20 5 EHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccoc3)o2)c([N+](=O)[O-])c1 ZINC000338714858 1128740292 /nfs/dbraw/zinc/74/02/92/1128740292.db2.gz DRHRZJXQCDSDPT-UHFFFAOYSA-N 1 1 328.324 3.746 20 5 EHBDMO C[N@H+]1CC=C(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987436 1120923875 /nfs/dbraw/zinc/92/38/75/1120923875.db2.gz JGRYGNRJCFJAQX-HXUWFJFHSA-N 1 1 337.423 3.536 20 5 EHBDMO C[N@@H+]1CC=C(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987436 1120923877 /nfs/dbraw/zinc/92/38/77/1120923877.db2.gz JGRYGNRJCFJAQX-HXUWFJFHSA-N 1 1 337.423 3.536 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301729235 1128998592 /nfs/dbraw/zinc/99/85/92/1128998592.db2.gz CHCIVCUCPJIDPD-LBPRGKRZSA-N 1 1 326.828 3.567 20 5 EHBDMO Cc1nc2ccccn2c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130409225 1121643350 /nfs/dbraw/zinc/64/33/50/1121643350.db2.gz XUPIVRVUDSJMSV-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1nc2ccccn2c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130409225 1121643354 /nfs/dbraw/zinc/64/33/54/1121643354.db2.gz XUPIVRVUDSJMSV-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO C[N@@H+]1Cc2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2C1 ZINC000193878776 1121723054 /nfs/dbraw/zinc/72/30/54/1121723054.db2.gz YAQJSGFSWQLGMH-UHFFFAOYSA-N 1 1 346.774 3.838 20 5 EHBDMO C[N@H+]1Cc2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2C1 ZINC000193878776 1121723061 /nfs/dbraw/zinc/72/30/61/1121723061.db2.gz YAQJSGFSWQLGMH-UHFFFAOYSA-N 1 1 346.774 3.838 20 5 EHBDMO COc1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609233214 1121789860 /nfs/dbraw/zinc/78/98/60/1121789860.db2.gz BRPLVNLRKDIJNZ-IBGZPJMESA-N 1 1 342.395 3.567 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301106792 1121922384 /nfs/dbraw/zinc/92/23/84/1121922384.db2.gz QOTAYMILIYXEMD-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO C[C@@H]([NH2+]Cc1nc2cc(Cl)ccc2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000488134019 1122208831 /nfs/dbraw/zinc/20/88/31/1122208831.db2.gz ZNPHYJSIKCTRRV-LLVKDONJSA-N 1 1 344.802 3.986 20 5 EHBDMO Cc1ccc(N2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000917405432 1122597570 /nfs/dbraw/zinc/59/75/70/1122597570.db2.gz RTEZIQNPXQASCO-UHFFFAOYSA-N 1 1 331.441 3.677 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000917405432 1122597575 /nfs/dbraw/zinc/59/75/75/1122597575.db2.gz RTEZIQNPXQASCO-UHFFFAOYSA-N 1 1 331.441 3.677 20 5 EHBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000919950524 1123243251 /nfs/dbraw/zinc/24/32/51/1123243251.db2.gz JZVTVMFBAZLQPR-UHFFFAOYSA-N 1 1 342.374 3.952 20 5 EHBDMO C[N@H+]1CCC[C@@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486194 1123374722 /nfs/dbraw/zinc/37/47/22/1123374722.db2.gz SGADYMTWMPUJBV-MRVPVSSYSA-N 1 1 337.729 3.773 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631910 1123635112 /nfs/dbraw/zinc/63/51/12/1123635112.db2.gz MUMZMQFNIXYZOR-CQSZACIVSA-N 1 1 334.416 3.719 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800456 1123664448 /nfs/dbraw/zinc/66/44/48/1123664448.db2.gz IAUKTFPEVYRCJR-GOSISDBHSA-N 1 1 344.436 3.764 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916176 1123691946 /nfs/dbraw/zinc/69/19/46/1123691946.db2.gz DAXPKVNPBPKQIV-MRXNPFEDSA-N 1 1 344.386 3.807 20 5 EHBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000301820951 1129144174 /nfs/dbraw/zinc/14/41/74/1129144174.db2.gz JRTZWJMBDCHHID-ONGXEEELSA-N 1 1 329.322 3.651 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000735490888 1131348006 /nfs/dbraw/zinc/34/80/06/1131348006.db2.gz UEJSFMPFARXPEC-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000735490888 1131348010 /nfs/dbraw/zinc/34/80/10/1131348010.db2.gz UEJSFMPFARXPEC-CYBMUJFWSA-N 1 1 346.818 3.726 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569438 1125363685 /nfs/dbraw/zinc/36/36/85/1125363685.db2.gz CKBYRUPCGACMKL-OAOYMFHYSA-N 1 1 332.444 3.746 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000619698896 1125384017 /nfs/dbraw/zinc/38/40/17/1125384017.db2.gz KCXDEJIGMBFXQO-GFCCVEGCSA-N 1 1 332.429 3.573 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000114729157 1129187395 /nfs/dbraw/zinc/18/73/95/1129187395.db2.gz UOPMUACJAMYWAQ-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255958937 1129237834 /nfs/dbraw/zinc/23/78/34/1129237834.db2.gz JNCDXEFWSBVTQP-CXAGYDPISA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[N@@H+](C)C1CC1 ZINC000301883779 1129259216 /nfs/dbraw/zinc/25/92/16/1129259216.db2.gz YGTOFLGYYAISGN-CYBMUJFWSA-N 1 1 326.400 3.551 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131027492 1129376223 /nfs/dbraw/zinc/37/62/23/1129376223.db2.gz YSYQPZBNUGZPQI-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)c1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531361 /nfs/dbraw/zinc/53/13/61/1129531361.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 1 1 331.460 3.634 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000123715511 1129547020 /nfs/dbraw/zinc/54/70/20/1129547020.db2.gz MFDSOGXBBCIMBD-HIFRSBDPSA-N 1 1 346.349 3.606 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000123715511 1129547022 /nfs/dbraw/zinc/54/70/22/1129547022.db2.gz MFDSOGXBBCIMBD-HIFRSBDPSA-N 1 1 346.349 3.606 20 5 EHBDMO C[C@H](O)CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481053 1129590583 /nfs/dbraw/zinc/59/05/83/1129590583.db2.gz ZDFLICLIUBYECU-NSHDSACASA-N 1 1 338.791 3.711 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000302832183 1129794788 /nfs/dbraw/zinc/79/47/88/1129794788.db2.gz GKVVMCQHJFVJJO-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000302832183 1129794792 /nfs/dbraw/zinc/79/47/92/1129794792.db2.gz GKVVMCQHJFVJJO-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000132368223 1129894905 /nfs/dbraw/zinc/89/49/05/1129894905.db2.gz FYAPEYMHNQGOBL-UHFFFAOYSA-N 1 1 333.413 3.507 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000429157476 1129900531 /nfs/dbraw/zinc/90/05/31/1129900531.db2.gz VHIZCHYLFJJIGK-QLJPJBMISA-N 1 1 336.388 3.588 20 5 EHBDMO COc1ccc([C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000171615196 1130074027 /nfs/dbraw/zinc/07/40/27/1130074027.db2.gz PPEAPCCAYFFLLG-GOSISDBHSA-N 1 1 330.359 3.983 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245467570 1130216959 /nfs/dbraw/zinc/21/69/59/1130216959.db2.gz ZNQXUGZVSLMRKT-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245467570 1130216963 /nfs/dbraw/zinc/21/69/63/1130216963.db2.gz ZNQXUGZVSLMRKT-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518112 1130228253 /nfs/dbraw/zinc/22/82/53/1130228253.db2.gz HJXJVCGQFUZNQS-ZIAGYGMSSA-N 1 1 334.416 3.628 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253927 1131464994 /nfs/dbraw/zinc/46/49/94/1131464994.db2.gz JGKOCTGGKYHMCV-OAHLLOKOSA-N 1 1 328.416 3.928 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738243101 1131466529 /nfs/dbraw/zinc/46/65/29/1131466529.db2.gz OCWRLWXASUIMAR-ZDUSSCGKSA-N 1 1 347.415 3.608 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738243101 1131466530 /nfs/dbraw/zinc/46/65/30/1131466530.db2.gz OCWRLWXASUIMAR-ZDUSSCGKSA-N 1 1 347.415 3.608 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000740881335 1131552723 /nfs/dbraw/zinc/55/27/23/1131552723.db2.gz AJXPUBJYJHEEDN-GXTWGEPZSA-N 1 1 325.840 3.553 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742152848 1131693723 /nfs/dbraw/zinc/69/37/23/1131693723.db2.gz KGKYNIYGTJBVMI-HNNXBMFYSA-N 1 1 343.431 3.569 20 5 EHBDMO C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000742430425 1131729680 /nfs/dbraw/zinc/72/96/80/1131729680.db2.gz QNNYZRNDWAFIOH-INIZCTEOSA-N 1 1 325.412 3.696 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC(F)(F)[C@H](F)C1)CC2 ZINC001172902664 1131884724 /nfs/dbraw/zinc/88/47/24/1131884724.db2.gz BNIHHPWTUTVLRW-DZGCQCFKSA-N 1 1 328.334 3.521 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001173228224 1132008282 /nfs/dbraw/zinc/00/82/82/1132008282.db2.gz UQFRABYZHQUGCF-HOCLYGCPSA-N 1 1 348.443 3.580 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232824 1132010599 /nfs/dbraw/zinc/01/05/99/1132010599.db2.gz IEGDTODFCYJTRE-HNNXBMFYSA-N 1 1 328.412 3.709 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040151 1132638615 /nfs/dbraw/zinc/63/86/15/1132638615.db2.gz YHTQTDVZJKYHRM-KMFMINBZSA-N 1 1 338.835 3.629 20 5 EHBDMO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055410 1132644406 /nfs/dbraw/zinc/64/44/06/1132644406.db2.gz PXDFNMORLFYEOR-YWPYICTPSA-N 1 1 341.249 3.887 20 5 EHBDMO C[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539512 1132780923 /nfs/dbraw/zinc/78/09/23/1132780923.db2.gz OLJXNAQUIOADKG-MAUKXSAKSA-N 1 1 332.444 3.921 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1 ZINC000773665538 1133062252 /nfs/dbraw/zinc/06/22/52/1133062252.db2.gz MAPQQNADQWLJKR-UHFFFAOYSA-N 1 1 329.787 3.933 20 5 EHBDMO OCCC[N@@H+](CCO)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000769387796 1133274177 /nfs/dbraw/zinc/27/41/77/1133274177.db2.gz BJIHZCBNAUOWKI-UHFFFAOYSA-N 1 1 343.854 3.823 20 5 EHBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126345 1133810612 /nfs/dbraw/zinc/81/06/12/1133810612.db2.gz PLEBESVGBBUXCQ-ZTNFWEORSA-N 1 1 340.423 3.815 20 5 EHBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126795 1133810994 /nfs/dbraw/zinc/81/09/94/1133810994.db2.gz UHWRNXWMLPYYCO-QKYXUNIQSA-N 1 1 340.423 3.815 20 5 EHBDMO CC(C)(CO)[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000788004135 1134063636 /nfs/dbraw/zinc/06/36/36/1134063636.db2.gz LLLYZHGELNSGEK-KRWDZBQOSA-N 1 1 332.375 3.583 20 5 EHBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788479328 1134130656 /nfs/dbraw/zinc/13/06/56/1134130656.db2.gz SQKXIZVJXZXPJG-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788479328 1134130658 /nfs/dbraw/zinc/13/06/58/1134130658.db2.gz SQKXIZVJXZXPJG-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO Cc1cc(N2CC[C@H]([N@@H+](C)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001186963688 1134277972 /nfs/dbraw/zinc/27/79/72/1134277972.db2.gz DQYVNQJKYWONNP-IBGZPJMESA-N 1 1 339.439 3.656 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC001187361557 1134327248 /nfs/dbraw/zinc/32/72/48/1134327248.db2.gz NRGZBPMKOPTUIH-HNNXBMFYSA-N 1 1 340.408 3.803 20 5 EHBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC001187361557 1134327256 /nfs/dbraw/zinc/32/72/56/1134327256.db2.gz NRGZBPMKOPTUIH-HNNXBMFYSA-N 1 1 340.408 3.803 20 5 EHBDMO Cc1ccc(NCCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[nH+]c1 ZINC001187694764 1134369397 /nfs/dbraw/zinc/36/93/97/1134369397.db2.gz QLFCPZVWTMVDDZ-UHFFFAOYSA-N 1 1 340.305 3.841 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346411 1134759506 /nfs/dbraw/zinc/75/95/06/1134759506.db2.gz NMMLDMXVCYYKEB-KDOFPFPSSA-N 1 1 341.411 3.767 20 5 EHBDMO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878002 1134810712 /nfs/dbraw/zinc/81/07/12/1134810712.db2.gz QRPZUUYRFBSKTH-MRXNPFEDSA-N 1 1 341.367 3.840 20 5 EHBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878002 1134810716 /nfs/dbraw/zinc/81/07/16/1134810716.db2.gz QRPZUUYRFBSKTH-MRXNPFEDSA-N 1 1 341.367 3.840 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199960 1134979316 /nfs/dbraw/zinc/97/93/16/1134979316.db2.gz PXVCSAZDSWHBLK-JKSUJKDBSA-N 1 1 347.459 3.988 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC001192514934 1135025518 /nfs/dbraw/zinc/02/55/18/1135025518.db2.gz JTOYFZANLUKDTF-OAHLLOKOSA-N 1 1 346.406 3.509 20 5 EHBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000804561335 1135120275 /nfs/dbraw/zinc/12/02/75/1135120275.db2.gz BBCJEMHPAXCUKS-UHFFFAOYSA-N 1 1 348.790 3.532 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000804564497 1135121687 /nfs/dbraw/zinc/12/16/87/1135121687.db2.gz WWXZAOGNVYCPLP-WFASDCNBSA-N 1 1 335.835 3.701 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000804650331 1135153732 /nfs/dbraw/zinc/15/37/32/1135153732.db2.gz GWNUIEBNRBESCN-UHFFFAOYSA-N 1 1 336.823 3.924 20 5 EHBDMO COCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC001193974789 1135208311 /nfs/dbraw/zinc/20/83/11/1135208311.db2.gz CKHAOLVFLRTEFN-IUODEOHRSA-N 1 1 326.824 3.885 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@]2(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])n1 ZINC001195758876 1135461217 /nfs/dbraw/zinc/46/12/17/1135461217.db2.gz WWDQJCRDEOLTOE-QGZVFWFLSA-N 1 1 348.834 3.579 20 5 EHBDMO C[C@@H]1CSCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001198518087 1135829821 /nfs/dbraw/zinc/82/98/21/1135829821.db2.gz WDJPGNNIPIQJMY-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@@H]1CSCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001198518087 1135829826 /nfs/dbraw/zinc/82/98/26/1135829826.db2.gz WDJPGNNIPIQJMY-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC001198563989 1135831104 /nfs/dbraw/zinc/83/11/04/1135831104.db2.gz VBIRAVMITANSFI-DLBZAZTESA-N 1 1 348.443 3.502 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H](CO)c1ccccc1 ZINC000809970636 1135904947 /nfs/dbraw/zinc/90/49/47/1135904947.db2.gz HDMBZYUBHNBVGO-CQSZACIVSA-N 1 1 341.194 3.725 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843917 1135931860 /nfs/dbraw/zinc/93/18/60/1135931860.db2.gz SJBVADALIZUJQA-OAHLLOKOSA-N 1 1 343.427 3.676 20 5 EHBDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000776176125 1136021957 /nfs/dbraw/zinc/02/19/57/1136021957.db2.gz ZKJSAOLLLAUHBA-OAHLLOKOSA-N 1 1 348.786 3.870 20 5 EHBDMO CC(C)[N@H+](Cc1cccc(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277990 1136126055 /nfs/dbraw/zinc/12/60/55/1136126055.db2.gz RZBKEVLKAMIXNQ-SFHVURJKSA-N 1 1 332.375 3.678 20 5 EHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277952 1136131088 /nfs/dbraw/zinc/13/10/88/1136131088.db2.gz RCXCWRVQXBIEEE-RBUKOAKNSA-N 1 1 326.396 3.774 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2CCc2ccccc2)cc1 ZINC000776279054 1136133864 /nfs/dbraw/zinc/13/38/64/1136133864.db2.gz WYKOBLSYIXTKMK-ICSRJNTNSA-N 1 1 340.423 3.725 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216719486 1136378274 /nfs/dbraw/zinc/37/82/74/1136378274.db2.gz XKOPXSPGDSVWOT-ZDUSSCGKSA-N 1 1 328.368 3.907 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000776585584 1136448308 /nfs/dbraw/zinc/44/83/08/1136448308.db2.gz XGDVTUKERJCZNV-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593023 1136453714 /nfs/dbraw/zinc/45/37/14/1136453714.db2.gz TUKXPSXDBHFJJB-IRXDYDNUSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593023 1136453715 /nfs/dbraw/zinc/45/37/15/1136453715.db2.gz TUKXPSXDBHFJJB-IRXDYDNUSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)cc1 ZINC000852427126 1136455274 /nfs/dbraw/zinc/45/52/74/1136455274.db2.gz STCNJWMFCBFGOL-SJLPKXTDSA-N 1 1 342.395 3.839 20 5 EHBDMO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584068 1136614587 /nfs/dbraw/zinc/61/45/87/1136614587.db2.gz UXJDYJQFGMYEJX-GFCCVEGCSA-N 1 1 338.367 3.683 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419316 1137095290 /nfs/dbraw/zinc/09/52/90/1137095290.db2.gz KGHAPCFSIXJUNV-ZDUSSCGKSA-N 1 1 331.391 3.646 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000865787125 1137311879 /nfs/dbraw/zinc/31/18/79/1137311879.db2.gz IKIRSHXVZOAGEA-UHFFFAOYSA-N 1 1 348.374 3.624 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000866541566 1137363073 /nfs/dbraw/zinc/36/30/73/1137363073.db2.gz OQABLBQMXROEAC-KRWDZBQOSA-N 1 1 328.416 3.588 20 5 EHBDMO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cn1 ZINC000872023906 1137565569 /nfs/dbraw/zinc/56/55/69/1137565569.db2.gz LBIJJCSVXCBBFD-ZDUSSCGKSA-N 1 1 346.406 3.826 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279227 1137577646 /nfs/dbraw/zinc/57/76/46/1137577646.db2.gz CXBDOVCVHGONNY-KRWDZBQOSA-N 1 1 348.443 3.917 20 5 EHBDMO CCC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CC1 ZINC000124831768 1137610511 /nfs/dbraw/zinc/61/05/11/1137610511.db2.gz VURWMMAQZPSOAO-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842445 1137624560 /nfs/dbraw/zinc/62/45/60/1137624560.db2.gz HMSGIULCUUKMML-VQTJNVASSA-N 1 1 345.446 3.697 20 5 EHBDMO CCCC[N@H+](C)c1ccc(NC2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876858033 1137663838 /nfs/dbraw/zinc/66/38/38/1137663838.db2.gz NUMXQABIIRGEFT-UHFFFAOYSA-N 1 1 343.431 3.843 20 5 EHBDMO CCCC[N@@H+](C)c1ccc(NC2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876858033 1137663839 /nfs/dbraw/zinc/66/38/39/1137663839.db2.gz NUMXQABIIRGEFT-UHFFFAOYSA-N 1 1 343.431 3.843 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](c1ccccc1F)[C@H](C)O ZINC000877609983 1137682770 /nfs/dbraw/zinc/68/27/70/1137682770.db2.gz GBFOYFXUSGLOTD-SCLBCKFNSA-N 1 1 332.375 3.562 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128344 1137703646 /nfs/dbraw/zinc/70/36/46/1137703646.db2.gz CNZLIJAJKLBCMY-OLZOCXBDSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1C ZINC000878165124 1137705375 /nfs/dbraw/zinc/70/53/75/1137705375.db2.gz RPXACHOXKHZGFK-ZJUUUORDSA-N 1 1 336.779 3.529 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000878416056 1137714911 /nfs/dbraw/zinc/71/49/11/1137714911.db2.gz AIIJSZNQRXCEGF-LLVKDONJSA-N 1 1 344.396 3.866 20 5 EHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476032 1137717352 /nfs/dbraw/zinc/71/73/52/1137717352.db2.gz VJXRXJWQEBZFJR-JSGCOSHPSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499529 1137749356 /nfs/dbraw/zinc/74/93/56/1137749356.db2.gz XVTKUSFISZLCQM-GDBMZVCRSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499529 1137749357 /nfs/dbraw/zinc/74/93/57/1137749357.db2.gz XVTKUSFISZLCQM-GDBMZVCRSA-N 1 1 338.411 3.535 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824705 1137922100 /nfs/dbraw/zinc/92/21/00/1137922100.db2.gz QAKPTFDMNZWLRR-GUYCJALGSA-N 1 1 328.416 3.843 20 5 EHBDMO CC(C)n1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861035 1137936116 /nfs/dbraw/zinc/93/61/16/1137936116.db2.gz UBSOWEIZGBFNTQ-GOEBONIOSA-N 1 1 343.431 3.708 20 5 EHBDMO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1Cl ZINC000134892071 1137961490 /nfs/dbraw/zinc/96/14/90/1137961490.db2.gz JOBLPSPGMZNVMU-PBHICJAKSA-N 1 1 349.862 3.697 20 5 EHBDMO CCOc1ccc(C2=CC[N@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000886100065 1138046635 /nfs/dbraw/zinc/04/66/35/1138046635.db2.gz DTLRTQKBGCTFOH-UHFFFAOYSA-N 1 1 339.395 3.678 20 5 EHBDMO CCOc1ccc(C2=CC[N@@H+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000886100065 1138046638 /nfs/dbraw/zinc/04/66/38/1138046638.db2.gz DTLRTQKBGCTFOH-UHFFFAOYSA-N 1 1 339.395 3.678 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000886105185 1138047154 /nfs/dbraw/zinc/04/71/54/1138047154.db2.gz UFPGWIJABSFBCJ-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122751 1138048978 /nfs/dbraw/zinc/04/89/78/1138048978.db2.gz JOANPULIIDJUGO-SUMWQHHRSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122751 1138048981 /nfs/dbraw/zinc/04/89/81/1138048981.db2.gz JOANPULIIDJUGO-SUMWQHHRSA-N 1 1 327.384 3.582 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000066515074 1138075867 /nfs/dbraw/zinc/07/58/67/1138075867.db2.gz CKPLODRXMFTNAE-UHFFFAOYSA-N 1 1 325.368 3.573 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000066515074 1138075869 /nfs/dbraw/zinc/07/58/69/1138075869.db2.gz CKPLODRXMFTNAE-UHFFFAOYSA-N 1 1 325.368 3.573 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1[N+](=O)[O-] ZINC000886684051 1138114575 /nfs/dbraw/zinc/11/45/75/1138114575.db2.gz DBOBFZPHJQBKSD-LLVKDONJSA-N 1 1 331.372 3.710 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2ncccn2)C1 ZINC000886685948 1138115145 /nfs/dbraw/zinc/11/51/45/1138115145.db2.gz HGJWUBWRTKQUAU-GJZGRUSLSA-N 1 1 326.400 3.634 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000075863914 1138128937 /nfs/dbraw/zinc/12/89/37/1138128937.db2.gz QTXAKXKAMYCKCZ-SFHVURJKSA-N 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CC(C)c1c[nH]c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000894899881 1022016569 /nfs/dbraw/zinc/01/65/69/1022016569.db2.gz CHFFMDJKGMZALC-OAHLLOKOSA-N 1 1 328.416 3.821 20 5 EHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187580022 1022356578 /nfs/dbraw/zinc/35/65/78/1022356578.db2.gz NTHYTJTUZOGIFI-GUYCJALGSA-N 1 1 328.416 3.616 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000602658927 1033059120 /nfs/dbraw/zinc/05/91/20/1033059120.db2.gz ZHVCTQMCDFRJND-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO Cn1ncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720599 1022792216 /nfs/dbraw/zinc/79/22/16/1022792216.db2.gz WKFBELZSPMPLEY-MRXNPFEDSA-N 1 1 340.427 3.585 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C1CCC(C)(C)CC1 ZINC000127578714 1022934827 /nfs/dbraw/zinc/93/48/27/1022934827.db2.gz GZMAAAAOMRJULW-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCCO)CC(C)(C)C ZINC000518058054 1022963458 /nfs/dbraw/zinc/96/34/58/1022963458.db2.gz AXJGCKGYOBXQQJ-UHFFFAOYSA-N 1 1 338.448 3.613 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2OC)ccc1[N+](=O)[O-] ZINC000276880986 1023285800 /nfs/dbraw/zinc/28/58/00/1023285800.db2.gz ISZBMEBRGQHHOZ-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccccc2OC)C1 ZINC000157922556 1033164888 /nfs/dbraw/zinc/16/48/88/1033164888.db2.gz UNBPSGMSOBISAB-CQSZACIVSA-N 1 1 342.395 3.602 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1NCCC[N@@H+](C)C1CCCCC1 ZINC000474144817 1024400943 /nfs/dbraw/zinc/40/09/43/1024400943.db2.gz MLZMVSNUDHLYPE-UHFFFAOYSA-N 1 1 335.448 3.808 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1cccs1)C(C)C ZINC000434828290 1024439409 /nfs/dbraw/zinc/43/94/09/1024439409.db2.gz MUHLZFSWDGMHJW-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1cccs1)C(C)C ZINC000434828290 1024439416 /nfs/dbraw/zinc/43/94/16/1024439416.db2.gz MUHLZFSWDGMHJW-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO CC1(C)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000435039136 1024560436 /nfs/dbraw/zinc/56/04/36/1024560436.db2.gz BDVNLMBYXKEFPU-UHFFFAOYSA-N 1 1 346.399 3.914 20 5 EHBDMO CC1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000435039136 1024560440 /nfs/dbraw/zinc/56/04/40/1024560440.db2.gz BDVNLMBYXKEFPU-UHFFFAOYSA-N 1 1 346.399 3.914 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]([C@H]4CCCO4)C3)o2)c1 ZINC000895842261 1024888387 /nfs/dbraw/zinc/88/83/87/1024888387.db2.gz CXSNEHVLSPXVNY-MAUKXSAKSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1cc(C[NH+]2CCC(OC(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000274360882 1025067680 /nfs/dbraw/zinc/06/76/80/1025067680.db2.gz ZMHUKDIZZRAZJK-UHFFFAOYSA-N 1 1 340.395 3.522 20 5 EHBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000346782355 1025092580 /nfs/dbraw/zinc/09/25/80/1025092580.db2.gz YFRBDNSSSVLVKL-HOTGVXAUSA-N 1 1 347.462 3.943 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCS1 ZINC000425479324 1025421109 /nfs/dbraw/zinc/42/11/09/1025421109.db2.gz OIJLQEUZWSQJOY-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCS1 ZINC000425479324 1025421102 /nfs/dbraw/zinc/42/11/02/1025421102.db2.gz OIJLQEUZWSQJOY-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000436311836 1025575524 /nfs/dbraw/zinc/57/55/24/1025575524.db2.gz XVIUJYGWTNQQBW-MNOVXSKESA-N 1 1 346.353 3.683 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318942 1025582798 /nfs/dbraw/zinc/58/27/98/1025582798.db2.gz PXQAMXQWYDQGOR-QWRGUYRKSA-N 1 1 346.353 3.541 20 5 EHBDMO Cc1cn2cc(Nc3cc(C(F)(F)F)ncc3[N+](=O)[O-])ccc2[nH+]1 ZINC000436400438 1025679207 /nfs/dbraw/zinc/67/92/07/1025679207.db2.gz KBKAUPDSIOJNOE-UHFFFAOYSA-N 1 1 337.261 3.708 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000530503573 1025962829 /nfs/dbraw/zinc/96/28/29/1025962829.db2.gz CBZWBSAUUAJUGA-UHFFFAOYSA-N 1 1 348.447 3.550 20 5 EHBDMO CCO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1C ZINC000451544966 1026092824 /nfs/dbraw/zinc/09/28/24/1026092824.db2.gz QMCOVEKPGLMZDI-NHYWBVRUSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H]1C ZINC000451544966 1026092831 /nfs/dbraw/zinc/09/28/31/1026092831.db2.gz QMCOVEKPGLMZDI-NHYWBVRUSA-N 1 1 346.349 3.861 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000451549066 1026100194 /nfs/dbraw/zinc/10/01/94/1026100194.db2.gz VTWDQYHDNCRGML-PBHICJAKSA-N 1 1 336.432 3.629 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896940305 1026129621 /nfs/dbraw/zinc/12/96/21/1026129621.db2.gz XSYVMIPEDNFQAJ-ZROIWOOFSA-N 1 1 338.411 3.588 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCn2nc(C3CC3)cc2C1 ZINC000896940305 1026129627 /nfs/dbraw/zinc/12/96/27/1026129627.db2.gz XSYVMIPEDNFQAJ-ZROIWOOFSA-N 1 1 338.411 3.588 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C(C)C ZINC000096970080 1026131543 /nfs/dbraw/zinc/13/15/43/1026131543.db2.gz UDUBVDDKRNUCGQ-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704375 1026354847 /nfs/dbraw/zinc/35/48/47/1026354847.db2.gz XSIABJYVBMFKRT-BBRMVZONSA-N 1 1 330.384 3.590 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676541 1027194507 /nfs/dbraw/zinc/19/45/07/1027194507.db2.gz AHCIWVCVONQCCL-JYJNAYRXSA-N 1 1 347.459 3.673 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718607 1027347124 /nfs/dbraw/zinc/34/71/24/1027347124.db2.gz PXQYOAHJBFLIAI-HIFRSBDPSA-N 1 1 330.384 3.590 20 5 EHBDMO Cc1c(C[N@@H+]2CCO[C@@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000531841731 1027504079 /nfs/dbraw/zinc/50/40/79/1027504079.db2.gz DCQXIQSLQCVXDX-LJQANCHMSA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1c(C[N@H+]2CCO[C@@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000531841731 1027504083 /nfs/dbraw/zinc/50/40/83/1027504083.db2.gz DCQXIQSLQCVXDX-LJQANCHMSA-N 1 1 326.396 3.651 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC2(C1)CCCCC2 ZINC000533426699 1027855301 /nfs/dbraw/zinc/85/53/01/1027855301.db2.gz GJQCLZLIMIRAFS-CQSZACIVSA-N 1 1 331.416 3.578 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429058 1027861126 /nfs/dbraw/zinc/86/11/26/1027861126.db2.gz BCMKPZMBCNLTSC-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429058 1027861143 /nfs/dbraw/zinc/86/11/43/1027861143.db2.gz BCMKPZMBCNLTSC-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO CO[C@H](C)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000533432418 1027870561 /nfs/dbraw/zinc/87/05/61/1027870561.db2.gz XOCYSZSDMPEFNO-CQSZACIVSA-N 1 1 347.415 3.538 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609425630 1027942676 /nfs/dbraw/zinc/94/26/76/1027942676.db2.gz NMKIQEZANOCVQH-HNNXBMFYSA-N 1 1 348.447 3.679 20 5 EHBDMO COc1nc2ccccc2cc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001203407611 1028062526 /nfs/dbraw/zinc/06/25/26/1028062526.db2.gz CACHTNYNPOJMHT-UHFFFAOYSA-N 1 1 337.379 3.750 20 5 EHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636459 1028089436 /nfs/dbraw/zinc/08/94/36/1028089436.db2.gz DIKBJSFOCJYLQY-CQSZACIVSA-N 1 1 338.411 3.843 20 5 EHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444656413 1028119864 /nfs/dbraw/zinc/11/98/64/1028119864.db2.gz FLULQCKXDZSYEI-UHFFFAOYSA-N 1 1 340.383 3.505 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)Cc1ccsc1 ZINC000444670187 1028142136 /nfs/dbraw/zinc/14/21/36/1028142136.db2.gz AFHWLRPSWITDCB-GFCCVEGCSA-N 1 1 344.440 3.986 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](O)CC23CCC3)o1 ZINC000421374435 1028335685 /nfs/dbraw/zinc/33/56/85/1028335685.db2.gz OVIMUFAWPGFSMK-CQSZACIVSA-N 1 1 342.395 3.734 20 5 EHBDMO CCc1ccc([C@H](N[C@@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456742 1028448890 /nfs/dbraw/zinc/44/88/90/1028448890.db2.gz OEPGIVILPAXUCI-SCLBCKFNSA-N 1 1 331.416 3.557 20 5 EHBDMO CC(C)n1cncc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000424189408 1028874950 /nfs/dbraw/zinc/87/49/50/1028874950.db2.gz KQBHMJASIJYVMN-UHFFFAOYSA-N 1 1 342.321 3.681 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532918389 1029067833 /nfs/dbraw/zinc/06/78/33/1029067833.db2.gz TVWJNQJALFDRQG-OWQGQXMQSA-N 1 1 345.443 3.742 20 5 EHBDMO Cc1ccc(CNC[C@@H]2CC[N@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409449 1029068896 /nfs/dbraw/zinc/06/88/96/1029068896.db2.gz YLPAHORNASLSPR-SFHVURJKSA-N 1 1 331.460 3.790 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@@H]2CCN2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409449 1029068911 /nfs/dbraw/zinc/06/89/11/1029068911.db2.gz YLPAHORNASLSPR-SFHVURJKSA-N 1 1 331.460 3.790 20 5 EHBDMO CCC(CC)C[N@@H+](CC)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532918343 1029070133 /nfs/dbraw/zinc/07/01/33/1029070133.db2.gz OBIFIKRARVBXJD-UHFFFAOYSA-N 1 1 349.431 3.651 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926339 1029072098 /nfs/dbraw/zinc/07/20/98/1029072098.db2.gz IFXOJFJNEITEKA-OAGGEKHMSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926339 1029072112 /nfs/dbraw/zinc/07/21/12/1029072112.db2.gz IFXOJFJNEITEKA-OAGGEKHMSA-N 1 1 349.475 3.765 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000532935224 1029099911 /nfs/dbraw/zinc/09/99/11/1029099911.db2.gz WYSUJZKEKIQDEX-LLVKDONJSA-N 1 1 327.812 3.553 20 5 EHBDMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000533223866 1029491909 /nfs/dbraw/zinc/49/19/09/1029491909.db2.gz UGJOSCIVWJNCQH-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000343224598 1029810184 /nfs/dbraw/zinc/81/01/84/1029810184.db2.gz YRXOKEUVWOVAEF-CYBMUJFWSA-N 1 1 342.399 3.550 20 5 EHBDMO CCCOc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000446828559 1029812461 /nfs/dbraw/zinc/81/24/61/1029812461.db2.gz WJORUCAGBAUXST-UHFFFAOYSA-N 1 1 340.383 3.550 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(OC)c1OC ZINC000601266354 1029873537 /nfs/dbraw/zinc/87/35/37/1029873537.db2.gz CKZSZEGSMLFVAR-OAHLLOKOSA-N 1 1 330.384 3.853 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441174193 1029876592 /nfs/dbraw/zinc/87/65/92/1029876592.db2.gz DGCYMIVJYLVTLN-HNNXBMFYSA-N 1 1 344.411 3.984 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC000537626335 1029905561 /nfs/dbraw/zinc/90/55/61/1029905561.db2.gz OPSCNWFAEBIZTO-TXEJJXNPSA-N 1 1 326.343 3.818 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000481763710 1029927982 /nfs/dbraw/zinc/92/79/82/1029927982.db2.gz ONNGHFDZOMRNFU-CMPLNLGQSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)cc1[N+](=O)[O-] ZINC000481763710 1029927999 /nfs/dbraw/zinc/92/79/99/1029927999.db2.gz ONNGHFDZOMRNFU-CMPLNLGQSA-N 1 1 332.322 3.766 20 5 EHBDMO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)o1 ZINC000453350548 1030140913 /nfs/dbraw/zinc/14/09/13/1030140913.db2.gz BQAANXOKFFRKOU-LBPRGKRZSA-N 1 1 333.388 3.785 20 5 EHBDMO CC1(C)C[C@H]([N@H+]2CCC[C@@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381846 1030162462 /nfs/dbraw/zinc/16/24/62/1030162462.db2.gz RIGNCQNQXOEKMD-PKOBYXMFSA-N 1 1 330.428 3.820 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327136 1030265691 /nfs/dbraw/zinc/26/56/91/1030265691.db2.gz XWTWASJTLPYNLB-RDTXWAMCSA-N 1 1 342.443 3.823 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000482383411 1030373944 /nfs/dbraw/zinc/37/39/44/1030373944.db2.gz UPZDIKJLUHNUQI-FQEVSTJZSA-N 1 1 338.407 3.925 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857545 1030396141 /nfs/dbraw/zinc/39/61/41/1030396141.db2.gz FTMJYEYWXIIASL-LJQANCHMSA-N 1 1 341.411 3.904 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870278 1030418366 /nfs/dbraw/zinc/41/83/66/1030418366.db2.gz JNXQIBNMAWEEAN-SFHVURJKSA-N 1 1 327.384 3.514 20 5 EHBDMO Cc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922364 1030452797 /nfs/dbraw/zinc/45/27/97/1030452797.db2.gz OXVAKQYLEXKHSV-IBGZPJMESA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1ccc(CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922364 1030452806 /nfs/dbraw/zinc/45/28/06/1030452806.db2.gz OXVAKQYLEXKHSV-IBGZPJMESA-N 1 1 339.439 3.515 20 5 EHBDMO Cc1ccc(CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922364 1030452817 /nfs/dbraw/zinc/45/28/17/1030452817.db2.gz OXVAKQYLEXKHSV-IBGZPJMESA-N 1 1 339.439 3.515 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267980 1030515239 /nfs/dbraw/zinc/51/52/39/1030515239.db2.gz PLWBTDCXRCYIBG-GUYCJALGSA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+]([C@H]2CCc3ccc(F)cc32)CC1 ZINC000482829361 1030740519 /nfs/dbraw/zinc/74/05/19/1030740519.db2.gz RBQSBDJKSROEFF-KRWDZBQOSA-N 1 1 341.386 3.543 20 5 EHBDMO CCc1n[nH]c(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000190680100 1030913347 /nfs/dbraw/zinc/91/33/47/1030913347.db2.gz QNHYSRFMYKFVGO-CYBMUJFWSA-N 1 1 343.431 3.524 20 5 EHBDMO CCc1nc(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000190680100 1030913356 /nfs/dbraw/zinc/91/33/56/1030913356.db2.gz QNHYSRFMYKFVGO-CYBMUJFWSA-N 1 1 343.431 3.524 20 5 EHBDMO CO[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@H]1C ZINC000249269062 1030920664 /nfs/dbraw/zinc/92/06/64/1030920664.db2.gz ZWAAEZHNAAQICB-MLGOLLRUSA-N 1 1 347.440 3.575 20 5 EHBDMO CO[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@H]1C ZINC000249269062 1030920673 /nfs/dbraw/zinc/92/06/73/1030920673.db2.gz ZWAAEZHNAAQICB-MLGOLLRUSA-N 1 1 347.440 3.575 20 5 EHBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC(C)(C)C1 ZINC000483103398 1030960950 /nfs/dbraw/zinc/96/09/50/1030960950.db2.gz GIEDQIGYJQUDSH-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360663 1030983622 /nfs/dbraw/zinc/98/36/22/1030983622.db2.gz CORVCHKFCXLNDS-WMLDXEAASA-N 1 1 344.411 3.980 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000448366172 1031018857 /nfs/dbraw/zinc/01/88/57/1031018857.db2.gz KPCZKMFZAOUKIJ-INIZCTEOSA-N 1 1 332.425 3.526 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000343593267 1031534317 /nfs/dbraw/zinc/53/43/17/1031534317.db2.gz WITMDFTYPJUPDY-UHFFFAOYSA-N 1 1 345.374 3.585 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737965 1031704956 /nfs/dbraw/zinc/70/49/56/1031704956.db2.gz HERGFMCDWSRMQA-UPJWGTAASA-N 1 1 330.388 3.511 20 5 EHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312499 1031771096 /nfs/dbraw/zinc/77/10/96/1031771096.db2.gz DXUSMCVFXVQFBC-GOSISDBHSA-N 1 1 329.400 3.539 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000475744893 1031789795 /nfs/dbraw/zinc/78/97/95/1031789795.db2.gz DFHCTBQZBXBXAU-UMVBOHGHSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CC1CCCCC1)C1CC1 ZINC000063525640 1033435417 /nfs/dbraw/zinc/43/54/17/1033435417.db2.gz QVIRFLSPTBFGIW-UHFFFAOYSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1nn(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c2cc([N+](=O)[O-])ccc12 ZINC000761290279 1033521404 /nfs/dbraw/zinc/52/14/04/1033521404.db2.gz NOXUXMYDLKUPSZ-KWOWKCNFSA-N 1 1 340.427 3.721 20 5 EHBDMO CC(C)c1ncc2c(n1)CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000598935425 1033591533 /nfs/dbraw/zinc/59/15/33/1033591533.db2.gz GNROCAQUEBZDOB-ALCCZGGFSA-N 1 1 338.411 3.580 20 5 EHBDMO COc1ccccc1C1([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595047615 1033664955 /nfs/dbraw/zinc/66/49/55/1033664955.db2.gz VBFUFDJQZQUFLI-ZDUSSCGKSA-N 1 1 342.395 3.952 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081023 1033695849 /nfs/dbraw/zinc/69/58/49/1033695849.db2.gz PIOLWKHWNACIJD-KBXCAEBGSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCN(C2CCCCC2)C1 ZINC000595081023 1033695855 /nfs/dbraw/zinc/69/58/55/1033695855.db2.gz PIOLWKHWNACIJD-KBXCAEBGSA-N 1 1 329.444 3.579 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595081588 1033695947 /nfs/dbraw/zinc/69/59/47/1033695947.db2.gz SMNLMMRBTQRECB-CABCVRRESA-N 1 1 347.459 3.661 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000595081987 1033696764 /nfs/dbraw/zinc/69/67/64/1033696764.db2.gz VFIJTQQJWQMYCU-KRWDZBQOSA-N 1 1 328.416 3.588 20 5 EHBDMO CCCC[N@@H+](CCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000575028055 1033763951 /nfs/dbraw/zinc/76/39/51/1033763951.db2.gz PNVFALLLWVSRSK-UHFFFAOYSA-N 1 1 332.400 3.839 20 5 EHBDMO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000472354640 1033806991 /nfs/dbraw/zinc/80/69/91/1033806991.db2.gz VDHLDGNPSYODML-MRXNPFEDSA-N 1 1 346.402 3.814 20 5 EHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000472354640 1033806997 /nfs/dbraw/zinc/80/69/97/1033806997.db2.gz VDHLDGNPSYODML-MRXNPFEDSA-N 1 1 346.402 3.814 20 5 EHBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595443598 1033808572 /nfs/dbraw/zinc/80/85/72/1033808572.db2.gz WITJBKNBJVTVAA-LLVKDONJSA-N 1 1 334.395 3.845 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccnc1C(F)(F)F ZINC000599405450 1033919941 /nfs/dbraw/zinc/91/99/41/1033919941.db2.gz UNBNHHKJOWUHJO-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cc(CO)ccc3F)C2)cc1 ZINC000599434159 1033935629 /nfs/dbraw/zinc/93/56/29/1033935629.db2.gz SLEATYOPWADEBI-INIZCTEOSA-N 1 1 344.386 3.606 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000138494539 1033937878 /nfs/dbraw/zinc/93/78/78/1033937878.db2.gz JNMRZYGEXSSSOZ-LIRRHRJNSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000138494539 1033937890 /nfs/dbraw/zinc/93/78/90/1033937890.db2.gz JNMRZYGEXSSSOZ-LIRRHRJNSA-N 1 1 326.396 3.865 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1CCO ZINC000595696269 1033948747 /nfs/dbraw/zinc/94/87/47/1033948747.db2.gz KAVRNQYCQWUPBP-ABAIWWIYSA-N 1 1 346.349 3.597 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059043 1034063537 /nfs/dbraw/zinc/06/35/37/1034063537.db2.gz MCWNNXXUFRHRLP-NXIIHZOPSA-N 1 1 343.471 3.710 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059043 1034063554 /nfs/dbraw/zinc/06/35/54/1034063554.db2.gz MCWNNXXUFRHRLP-NXIIHZOPSA-N 1 1 343.471 3.710 20 5 EHBDMO O=[N+]([O-])c1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1C(F)(F)F ZINC000596082049 1034073373 /nfs/dbraw/zinc/07/33/73/1034073373.db2.gz FIWGYAYUNMGDTK-NWDGAFQWSA-N 1 1 329.322 3.652 20 5 EHBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094860 1034079664 /nfs/dbraw/zinc/07/96/64/1034079664.db2.gz NQWOMVHQIHTQEW-DOTOQJQBSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094860 1034079677 /nfs/dbraw/zinc/07/96/77/1034079677.db2.gz NQWOMVHQIHTQEW-DOTOQJQBSA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094863 1034080365 /nfs/dbraw/zinc/08/03/65/1034080365.db2.gz NQWOMVHQIHTQEW-WBVHZDCISA-N 1 1 331.460 3.676 20 5 EHBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094863 1034080382 /nfs/dbraw/zinc/08/03/82/1034080382.db2.gz NQWOMVHQIHTQEW-WBVHZDCISA-N 1 1 331.460 3.676 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H](CCF)C2)c1 ZINC000597212147 1034596717 /nfs/dbraw/zinc/59/67/17/1034596717.db2.gz SBZAHOWFYDDWRS-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H](CCF)C2)c1 ZINC000597212147 1034596725 /nfs/dbraw/zinc/59/67/25/1034596725.db2.gz SBZAHOWFYDDWRS-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000179873067 1034877709 /nfs/dbraw/zinc/87/77/09/1034877709.db2.gz WYQNWTWZCQTWCC-NSHDSACASA-N 1 1 344.358 3.622 20 5 EHBDMO CCc1ccc([C@H](N[C@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407729 1034889732 /nfs/dbraw/zinc/88/97/32/1034889732.db2.gz ZFDRGSCLYMENOR-HNAYVOBHSA-N 1 1 343.427 3.523 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000582273398 1035734868 /nfs/dbraw/zinc/73/48/68/1035734868.db2.gz OFUJZCSOSJZQOE-UHFFFAOYSA-N 1 1 338.407 3.959 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000582273398 1035734892 /nfs/dbraw/zinc/73/48/92/1035734892.db2.gz OFUJZCSOSJZQOE-UHFFFAOYSA-N 1 1 338.407 3.959 20 5 EHBDMO CC[N@H+]1CC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155431 1035920436 /nfs/dbraw/zinc/92/04/36/1035920436.db2.gz FJFVBIMQLOFCHF-JXFKEZNVSA-N 1 1 339.439 3.616 20 5 EHBDMO CC[C@@H](C)[N@@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047255 1035957682 /nfs/dbraw/zinc/95/76/82/1035957682.db2.gz YTZPWSOFVASMBX-BXUZGUMPSA-N 1 1 333.354 3.518 20 5 EHBDMO CC[C@H](Nc1[nH+]c2cccc(F)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000443520639 1036238577 /nfs/dbraw/zinc/23/85/77/1036238577.db2.gz GFHBHUHKMSEPPD-AWEZNQCLSA-N 1 1 328.347 3.606 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000541391392 1036278142 /nfs/dbraw/zinc/27/81/42/1036278142.db2.gz VVQGTKYOYNPXSA-AWEZNQCLSA-N 1 1 333.432 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H](C3CC3)C2)c1 ZINC000589209856 1036312202 /nfs/dbraw/zinc/31/22/02/1036312202.db2.gz UXBLHMJHNNYWDG-LBPRGKRZSA-N 1 1 326.343 3.818 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589207298 1036312920 /nfs/dbraw/zinc/31/29/20/1036312920.db2.gz JZAHVOFTHNCDGG-CTEOGUNLSA-N 1 1 326.400 3.785 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2cccs2)C(C)C)c1 ZINC000589496312 1036440065 /nfs/dbraw/zinc/44/00/65/1036440065.db2.gz JZARYINAHYUWDJ-UHFFFAOYSA-N 1 1 348.424 3.854 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2cccs2)C(C)C)c1 ZINC000589496312 1036440072 /nfs/dbraw/zinc/44/00/72/1036440072.db2.gz JZARYINAHYUWDJ-UHFFFAOYSA-N 1 1 348.424 3.854 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1csnn1 ZINC000414295545 1036509024 /nfs/dbraw/zinc/50/90/24/1036509024.db2.gz FLEAVQOKEQGDGR-MNOVXSKESA-N 1 1 338.458 3.668 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000464781905 1036776299 /nfs/dbraw/zinc/77/62/99/1036776299.db2.gz WTFMTTYNPMRUFN-GOSISDBHSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000180469579 1036872629 /nfs/dbraw/zinc/87/26/29/1036872629.db2.gz MWVWBTBHKHNSBR-FOIQADDNSA-N 1 1 339.439 3.757 20 5 EHBDMO C[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N(C)C1CC1 ZINC000180469579 1036872645 /nfs/dbraw/zinc/87/26/45/1036872645.db2.gz MWVWBTBHKHNSBR-FOIQADDNSA-N 1 1 339.439 3.757 20 5 EHBDMO CCOc1ccc([C@@H](C)N[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000152857341 1037000811 /nfs/dbraw/zinc/00/08/11/1037000811.db2.gz OXMLZPNPKKFNHV-LSDHHAIUSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)Cc1ccccc1 ZINC000007340047 1037041185 /nfs/dbraw/zinc/04/11/85/1037041185.db2.gz YEUSUVBNAMTLDM-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)Cc1ccccc1 ZINC000007340047 1037041196 /nfs/dbraw/zinc/04/11/96/1037041196.db2.gz YEUSUVBNAMTLDM-CYBMUJFWSA-N 1 1 338.367 3.838 20 5 EHBDMO COc1ccccc1CC[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493471959 1037388446 /nfs/dbraw/zinc/38/84/46/1037388446.db2.gz HNELPBPNUSWZNQ-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493471959 1037388467 /nfs/dbraw/zinc/38/84/67/1037388467.db2.gz HNELPBPNUSWZNQ-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](NCC[NH+]2CCCCC2)c2ccccc2)c1 ZINC000491383416 1037437506 /nfs/dbraw/zinc/43/75/06/1037437506.db2.gz RKUXIADBPDDEFC-FQEVSTJZSA-N 1 1 339.439 3.760 20 5 EHBDMO COc1cc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1O ZINC000089974928 1037514604 /nfs/dbraw/zinc/51/46/04/1037514604.db2.gz AAGCTIUSRJXNBK-UHFFFAOYSA-N 1 1 342.395 3.516 20 5 EHBDMO CCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000532490393 1037527792 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20 5 EHBDMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000290515045 1037828560 /nfs/dbraw/zinc/82/85/60/1037828560.db2.gz PUUPRLWNQGZQES-INIZCTEOSA-N 1 1 349.456 3.557 20 5 EHBDMO CN(c1ccccc1)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103471020 1037903387 /nfs/dbraw/zinc/90/33/87/1037903387.db2.gz CDLPYKUFRHVDSY-UHFFFAOYSA-N 1 1 343.402 3.835 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000051232918 1037911368 /nfs/dbraw/zinc/91/13/68/1037911368.db2.gz KWIXVAXIIIZNTD-UHFFFAOYSA-N 1 1 326.805 3.950 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000051232918 1037911383 /nfs/dbraw/zinc/91/13/83/1037911383.db2.gz KWIXVAXIIIZNTD-UHFFFAOYSA-N 1 1 326.805 3.950 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@@H]3C3CCC3)o2)cc1 ZINC000592198766 1037944115 /nfs/dbraw/zinc/94/41/15/1037944115.db2.gz SGJFKDBSDBHXHL-MRXNPFEDSA-N 1 1 342.399 3.799 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000541392882 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JCKAOHHSQNBFOO-KRWDZBQOSA-N 1 1 345.443 3.629 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000842167933 1039520215 /nfs/dbraw/zinc/52/02/15/1039520215.db2.gz YLWFPSLMXZTGCG-NOOOWODRSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000842167933 1039520229 /nfs/dbraw/zinc/52/02/29/1039520229.db2.gz YLWFPSLMXZTGCG-NOOOWODRSA-N 1 1 339.823 3.552 20 5 EHBDMO Cc1c(C[NH2+]Cc2nc3c(s2)C[C@H](C)CC3)cccc1[N+](=O)[O-] ZINC000480488654 1039611920 /nfs/dbraw/zinc/61/19/20/1039611920.db2.gz SNQMSWKRXSGETK-LLVKDONJSA-N 1 1 331.441 3.774 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000480527914 1039666686 /nfs/dbraw/zinc/66/66/86/1039666686.db2.gz PKSSLRCHZYSYQU-GOSISDBHSA-N 1 1 340.427 3.621 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)Cc1ccc(F)cc1 ZINC000555314487 1040411650 /nfs/dbraw/zinc/41/16/50/1040411650.db2.gz AXSMHBWNIZCHQG-LJQANCHMSA-N 1 1 346.402 3.548 20 5 EHBDMO CC(C)CC[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070902 1040425581 /nfs/dbraw/zinc/42/55/81/1040425581.db2.gz SHXDMCSZTJPNKH-OAHLLOKOSA-N 1 1 333.432 3.824 20 5 EHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cnc(C4CC4)o3)CC2)cc1 ZINC000600123032 1040683790 /nfs/dbraw/zinc/68/37/90/1040683790.db2.gz FXMZQMBNNAFFTJ-UHFFFAOYSA-N 1 1 343.383 3.504 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCCC1 ZINC000512749919 1040756844 /nfs/dbraw/zinc/75/68/44/1040756844.db2.gz OTSAFHWWWXHCAP-UHFFFAOYSA-N 1 1 339.439 3.870 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c2ncccc12 ZINC000077994959 1041179439 /nfs/dbraw/zinc/17/94/39/1041179439.db2.gz BCQRUVIADVENHB-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC000511830620 1041672309 /nfs/dbraw/zinc/67/23/09/1041672309.db2.gz RCNZGEBNULTBFM-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 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JGLXFVWAJOYGQC-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917086255 1122490795 /nfs/dbraw/zinc/49/07/95/1122490795.db2.gz JGLXFVWAJOYGQC-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)c1 ZINC000154493542 1122667118 /nfs/dbraw/zinc/66/71/18/1122667118.db2.gz POTZCJZWMPUMGU-UXHICEINSA-N 1 1 338.407 3.780 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000556198610 1122866593 /nfs/dbraw/zinc/86/65/93/1122866593.db2.gz GXYYCAVHNGCFOZ-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3ccsc3[N+](=O)[O-])CC2)s1 ZINC000609965281 1123698937 /nfs/dbraw/zinc/69/89/37/1123698937.db2.gz VMOHFRJEEDZMSB-UHFFFAOYSA-N 1 1 337.470 3.602 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249651 1123752567 /nfs/dbraw/zinc/75/25/67/1123752567.db2.gz CTPDUXWRMYUOHR-HUUCEWRRSA-N 1 1 335.423 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000237828081 1123875725 /nfs/dbraw/zinc/87/57/25/1123875725.db2.gz KPZRSKPZOMWIEY-INIZCTEOSA-N 1 1 349.818 3.768 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccco1 ZINC000069070376 1129420676 /nfs/dbraw/zinc/42/06/76/1129420676.db2.gz HACRBZABMGNPOG-ZDUSSCGKSA-N 1 1 331.372 3.518 20 5 EHBDMO CC[C@H](c1ccncc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000092223841 1129537048 /nfs/dbraw/zinc/53/70/48/1129537048.db2.gz OUJFOOCZLVWJMX-GOSISDBHSA-N 1 1 329.400 3.842 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H]2C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092780763 1129561089 /nfs/dbraw/zinc/56/10/89/1129561089.db2.gz HJCBCZLAMHUJHV-GOSISDBHSA-N 1 1 340.427 3.760 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000389446737 1129574956 /nfs/dbraw/zinc/57/49/56/1129574956.db2.gz VBBZXPNYBONRHB-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ncccc1[N+](=O)[O-] ZINC000390863201 1129638954 /nfs/dbraw/zinc/63/89/54/1129638954.db2.gz NIFQJZBDHCSKTK-QGZVFWFLSA-N 1 1 340.427 3.702 20 5 EHBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(Cl)cc1 ZINC000282390913 1129686957 /nfs/dbraw/zinc/68/69/57/1129686957.db2.gz DOIOXTMZUNFERN-HNNXBMFYSA-N 1 1 338.766 3.865 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433618 1129691818 /nfs/dbraw/zinc/69/18/18/1129691818.db2.gz FOXKSGOKCFWXCY-OLZOCXBDSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1cc(N[C@@H]2CCC[C@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302087605 1129767757 /nfs/dbraw/zinc/76/77/57/1129767757.db2.gz OAHDQMBRHPHEQD-KGLIPLIRSA-N 1 1 328.416 3.736 20 5 EHBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000302785199 1129791774 /nfs/dbraw/zinc/79/17/74/1129791774.db2.gz VBZFNLRJLOVXRC-UHFFFAOYSA-N 1 1 348.790 3.532 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000302811464 1129793490 /nfs/dbraw/zinc/79/34/90/1129793490.db2.gz QQIHIPHWMLWNTJ-OAHLLOKOSA-N 1 1 336.395 3.974 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000302811464 1129793493 /nfs/dbraw/zinc/79/34/93/1129793493.db2.gz QQIHIPHWMLWNTJ-OAHLLOKOSA-N 1 1 336.395 3.974 20 5 EHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000429157474 1129900369 /nfs/dbraw/zinc/90/03/69/1129900369.db2.gz VHIZCHYLFJJIGK-QFYYESIMSA-N 1 1 336.388 3.588 20 5 EHBDMO Cc1cnn([C@@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514987 1130228296 /nfs/dbraw/zinc/22/82/96/1130228296.db2.gz CXSDBPBANURGEM-NVXWUHKLSA-N 1 1 328.416 3.806 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455532 1130233906 /nfs/dbraw/zinc/23/39/06/1130233906.db2.gz JWXDANVZGVWJKS-CQSZACIVSA-N 1 1 348.424 3.881 20 5 EHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059324 1131461888 /nfs/dbraw/zinc/46/18/88/1131461888.db2.gz XKSQBTZGXBOLFE-PBHICJAKSA-N 1 1 343.431 3.711 20 5 EHBDMO C[N@@H+](CCc1cccs1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000743383259 1131907389 /nfs/dbraw/zinc/90/73/89/1131907389.db2.gz AIONUQUJWDUJLB-UHFFFAOYSA-N 1 1 342.424 3.652 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1Cc3cnc(Cl)cc3C1)CC2 ZINC001172912794 1131917712 /nfs/dbraw/zinc/91/77/12/1131917712.db2.gz MHUCWHPRULWBNT-MRXNPFEDSA-N 1 1 343.814 3.906 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@](C)(F)CC2)c1F ZINC001173178943 1131991980 /nfs/dbraw/zinc/99/19/80/1131991980.db2.gz CHZIUHQIWCWBSP-SJCJKPOMSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCn3cccc3[C@@H]2C)c1F ZINC001173195369 1131996342 /nfs/dbraw/zinc/99/63/42/1131996342.db2.gz FDYMJOBBRMAAPL-OLZOCXBDSA-N 1 1 347.390 3.552 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCn3cccc3[C@@H]2C)c1F ZINC001173195369 1131996349 /nfs/dbraw/zinc/99/63/49/1131996349.db2.gz FDYMJOBBRMAAPL-OLZOCXBDSA-N 1 1 347.390 3.552 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001173226387 1132006731 /nfs/dbraw/zinc/00/67/31/1132006731.db2.gz JIWICESRZUYSAP-BEFAXECRSA-N 1 1 326.396 3.679 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCCCC2)[C@@H](C)C1 ZINC001173237122 1132026567 /nfs/dbraw/zinc/02/65/67/1132026567.db2.gz HXYIFULWVDTYFY-SJORKVTESA-N 1 1 345.487 3.865 20 5 EHBDMO CC[C@]1(C)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419587 1132086746 /nfs/dbraw/zinc/08/67/46/1132086746.db2.gz KONSKMUVQJYCFE-MRXNPFEDSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419587 1132086752 /nfs/dbraw/zinc/08/67/52/1132086752.db2.gz KONSKMUVQJYCFE-MRXNPFEDSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@H]1c1ccccc1 ZINC000746382292 1132504059 /nfs/dbraw/zinc/50/40/59/1132504059.db2.gz LLHYMIIRJVZQLA-SJLPKXTDSA-N 1 1 342.443 3.881 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054561 1132551712 /nfs/dbraw/zinc/55/17/12/1132551712.db2.gz SRISFMQUXGQWFE-LRPXVYOUSA-N 1 1 331.416 3.600 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040266 1132637830 /nfs/dbraw/zinc/63/78/30/1132637830.db2.gz ZFYBVASWXCFSPX-NHYWBVRUSA-N 1 1 328.334 3.509 20 5 EHBDMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046719 1132641955 /nfs/dbraw/zinc/64/19/55/1132641955.db2.gz MGIQHAOMOMFCIQ-DZGCQCFKSA-N 1 1 330.350 3.973 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052019 1132643022 /nfs/dbraw/zinc/64/30/22/1132643022.db2.gz FOHUXDDFXMMXCI-OCCSQVGLSA-N 1 1 329.425 3.571 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052019 1132643025 /nfs/dbraw/zinc/64/30/25/1132643025.db2.gz FOHUXDDFXMMXCI-OCCSQVGLSA-N 1 1 329.425 3.571 20 5 EHBDMO Cc1csc(C[C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)n1 ZINC001176218352 1132878731 /nfs/dbraw/zinc/87/87/31/1132878731.db2.gz PLICJFFFZYCHNO-ZDUSSCGKSA-N 1 1 349.431 3.954 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766839 1133050206 /nfs/dbraw/zinc/05/02/06/1133050206.db2.gz XXEMFNDEPUFUHT-RHSMWYFYSA-N 1 1 343.431 3.711 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC001180359934 1133360819 /nfs/dbraw/zinc/36/08/19/1133360819.db2.gz YRNGTNPMYZQQEK-UHFFFAOYSA-N 1 1 342.395 3.615 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000774730144 1133905567 /nfs/dbraw/zinc/90/55/67/1133905567.db2.gz GCKWEDCCEAYSKT-UHFFFAOYSA-N 1 1 349.337 3.624 20 5 EHBDMO Cc1cc(F)ccc1[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000746663143 1133974506 /nfs/dbraw/zinc/97/45/06/1133974506.db2.gz OHWXUJJTGLIRPD-IBGZPJMESA-N 1 1 346.402 3.986 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826207 1134026450 /nfs/dbraw/zinc/02/64/50/1134026450.db2.gz LYFBRKSBJYRBIJ-INIZCTEOSA-N 1 1 341.367 3.710 20 5 EHBDMO O=[N+]([O-])c1ccnn1C[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC000746714587 1134056011 /nfs/dbraw/zinc/05/60/11/1134056011.db2.gz VKTKMNMREQCSIO-UHFFFAOYSA-N 1 1 336.395 3.782 20 5 EHBDMO C[C@@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804147 1134171348 /nfs/dbraw/zinc/17/13/48/1134171348.db2.gz VBTXNANVUQWXDV-RHSMWYFYSA-N 1 1 346.475 3.625 20 5 EHBDMO C[C@@H]([NH2+]C[C@H]1CCCN1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804147 1134171350 /nfs/dbraw/zinc/17/13/50/1134171350.db2.gz VBTXNANVUQWXDV-RHSMWYFYSA-N 1 1 346.475 3.625 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597235 1134725024 /nfs/dbraw/zinc/72/50/24/1134725024.db2.gz KXABDFKOJAHTDH-MRXNPFEDSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC001170334318 1134751191 /nfs/dbraw/zinc/75/11/91/1134751191.db2.gz CAOBFZNSMDAYQN-GFCCVEGCSA-N 1 1 332.425 3.654 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335492 1134752341 /nfs/dbraw/zinc/75/23/41/1134752341.db2.gz OOKZWXWHLAQASX-GFCCVEGCSA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2Cc3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170353122 1134754354 /nfs/dbraw/zinc/75/43/54/1134754354.db2.gz WGZOCBFUQGLFNY-LSDHHAIUSA-N 1 1 340.423 3.981 20 5 EHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000792873449 1134803810 /nfs/dbraw/zinc/80/38/10/1134803810.db2.gz SXECMHFVHSTLQN-UHFFFAOYSA-N 1 1 333.319 3.667 20 5 EHBDMO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878001 1134810830 /nfs/dbraw/zinc/81/08/30/1134810830.db2.gz QRPZUUYRFBSKTH-INIZCTEOSA-N 1 1 341.367 3.840 20 5 EHBDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878001 1134810837 /nfs/dbraw/zinc/81/08/37/1134810837.db2.gz QRPZUUYRFBSKTH-INIZCTEOSA-N 1 1 341.367 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@H]3CCCC[C@@H]32)cc1 ZINC001191368240 1134858384 /nfs/dbraw/zinc/85/83/84/1134858384.db2.gz YYKXFLVXSSLJKS-IRXDYDNUSA-N 1 1 336.457 3.724 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789197 1134923049 /nfs/dbraw/zinc/92/30/49/1134923049.db2.gz GKABKYFLPKOGBC-YOEHRIQHSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H]1C[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502612 1135024416 /nfs/dbraw/zinc/02/44/16/1135024416.db2.gz WQKNSKMJCKAYTC-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502612 1135024425 /nfs/dbraw/zinc/02/44/25/1135024425.db2.gz WQKNSKMJCKAYTC-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC001193421238 1135138378 /nfs/dbraw/zinc/13/83/78/1135138378.db2.gz CIQYIEIQCIOEBV-UHFFFAOYSA-N 1 1 326.396 3.637 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC(C2CC2)CC1 ZINC001194890711 1135342589 /nfs/dbraw/zinc/34/25/89/1135342589.db2.gz LFSQSVMUPFNVJD-UHFFFAOYSA-N 1 1 339.233 3.979 20 5 EHBDMO Cc1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC2CC2)cn1 ZINC001195463131 1135427051 /nfs/dbraw/zinc/42/70/51/1135427051.db2.gz HDLCCGPQSONDBH-UHFFFAOYSA-N 1 1 341.411 3.589 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1C1CCC1 ZINC001195825508 1135477820 /nfs/dbraw/zinc/47/78/20/1135477820.db2.gz KKSXDCRYMKXAHS-SFHVURJKSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@]1(C)Cc1ccc(C)cc1 ZINC001196595338 1135582067 /nfs/dbraw/zinc/58/20/67/1135582067.db2.gz SBTSZDVGSYZOQJ-LJQANCHMSA-N 1 1 342.443 3.505 20 5 EHBDMO Cc1ccccc1[C@@H](CO)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197818704 1135743624 /nfs/dbraw/zinc/74/36/24/1135743624.db2.gz NDEATSTYYLVCSW-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197818704 1135743629 /nfs/dbraw/zinc/74/36/29/1135743629.db2.gz NDEATSTYYLVCSW-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329618 1135898051 /nfs/dbraw/zinc/89/80/51/1135898051.db2.gz XFHLEPUDEJFXGD-GASCZTMLSA-N 1 1 333.476 3.669 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000809973116 1135907300 /nfs/dbraw/zinc/90/73/00/1135907300.db2.gz ITOOKFSZXQFMKL-HZMBPMFUSA-N 1 1 347.242 3.885 20 5 EHBDMO COc1cc(CO[NH+]=C(N)CCCc2ccccc2)ccc1[N+](=O)[O-] ZINC000809994646 1135910122 /nfs/dbraw/zinc/91/01/22/1135910122.db2.gz BSWVCCJMXLUWHI-UHFFFAOYSA-N 1 1 343.383 3.625 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274363 1136129950 /nfs/dbraw/zinc/12/99/50/1136129950.db2.gz HFTLOTDYQPDFFQ-APPDUMDISA-N 1 1 336.338 3.599 20 5 EHBDMO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812848508 1136259326 /nfs/dbraw/zinc/25/93/26/1136259326.db2.gz COILRPFHUGTIRW-ACJLOTCBSA-N 1 1 332.375 3.678 20 5 EHBDMO 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ZINC000266924394 1140738579 /nfs/dbraw/zinc/73/85/79/1140738579.db2.gz MUKRJPMPPQTOKN-HUUCEWRRSA-N 1 1 343.431 3.708 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625586 1141128385 /nfs/dbraw/zinc/12/83/85/1141128385.db2.gz CJVFZWRAJVFQOA-SWLSCSKDSA-N 1 1 349.456 3.649 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(Br)s2)cs1 ZINC000038018326 213189579 /nfs/dbraw/zinc/18/95/79/213189579.db2.gz UYBPTLKNTVGEDD-UHFFFAOYSA-N 1 1 333.232 3.770 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430223168 1015100393 /nfs/dbraw/zinc/10/03/93/1015100393.db2.gz ULPJHBSQJZENBF-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430223168 1015100398 /nfs/dbraw/zinc/10/03/98/1015100398.db2.gz ULPJHBSQJZENBF-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000126979184 1015149301 /nfs/dbraw/zinc/14/93/01/1015149301.db2.gz CFRCYHSVMCMYMJ-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1OC ZINC000126978922 1015149347 /nfs/dbraw/zinc/14/93/47/1015149347.db2.gz VOXLSVSBHKKNRL-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1OC ZINC000126978922 1015149354 /nfs/dbraw/zinc/14/93/54/1015149354.db2.gz VOXLSVSBHKKNRL-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC(=O)Nc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154271132 1015331834 /nfs/dbraw/zinc/33/18/34/1015331834.db2.gz TZTKQTUOLMNHIZ-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CC(=O)Nc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154271132 1015331848 /nfs/dbraw/zinc/33/18/48/1015331848.db2.gz TZTKQTUOLMNHIZ-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000339670819 1015491915 /nfs/dbraw/zinc/49/19/15/1015491915.db2.gz FUFRMWBBMHGYDF-GXTWGEPZSA-N 1 1 342.399 3.828 20 5 EHBDMO CCC[N@@H+](CC(C)C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC001167256269 1016783992 /nfs/dbraw/zinc/78/39/92/1016783992.db2.gz UTBAJTVJUIFGCI-GFCCVEGCSA-N 1 1 341.839 3.943 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000340978232 1017237022 /nfs/dbraw/zinc/23/70/22/1017237022.db2.gz UNRCCNJTKZAQSX-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000340978232 1017237036 /nfs/dbraw/zinc/23/70/36/1017237036.db2.gz UNRCCNJTKZAQSX-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000449446091 1032563456 /nfs/dbraw/zinc/56/34/56/1032563456.db2.gz OEPCUQWCBJLGPA-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000449453419 1032569884 /nfs/dbraw/zinc/56/98/84/1032569884.db2.gz MVZABNRCWVNIBJ-QILJAFDGSA-N 1 1 330.428 3.624 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](CO)c1ccccc1 ZINC000449460830 1032577396 /nfs/dbraw/zinc/57/73/96/1032577396.db2.gz ZYNGXDJNWKVRJB-LSSBLYJVSA-N 1 1 326.396 3.664 20 5 EHBDMO CCc1ncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495978 1032665567 /nfs/dbraw/zinc/66/55/67/1032665567.db2.gz FRTSOAGWFZMLTM-AWEZNQCLSA-N 1 1 331.441 3.993 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000092224599 1017138332 /nfs/dbraw/zinc/13/83/32/1017138332.db2.gz PMJSBTXAZKRHSK-HNNXBMFYSA-N 1 1 326.356 3.714 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000092224599 1017138341 /nfs/dbraw/zinc/13/83/41/1017138341.db2.gz PMJSBTXAZKRHSK-HNNXBMFYSA-N 1 1 326.356 3.714 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947341 1017347934 /nfs/dbraw/zinc/34/79/34/1017347934.db2.gz KSHWCMUUFSKSCW-OLZOCXBDSA-N 1 1 331.441 3.553 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000377237780 1017513602 /nfs/dbraw/zinc/51/36/02/1017513602.db2.gz JJAAWQQJODIPTA-HZPDHXFCSA-N 1 1 342.395 3.713 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2cccnc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281281 1017608273 /nfs/dbraw/zinc/60/82/73/1017608273.db2.gz AHSLAZZDVOFQIO-WFASDCNBSA-N 1 1 332.429 3.546 20 5 EHBDMO CC(=O)N1CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000408046541 1018211194 /nfs/dbraw/zinc/21/11/94/1018211194.db2.gz LSWULIHCQDOTJH-HNNXBMFYSA-N 1 1 345.443 3.523 20 5 EHBDMO CC(=O)N1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000408046541 1018211204 /nfs/dbraw/zinc/21/12/04/1018211204.db2.gz LSWULIHCQDOTJH-HNNXBMFYSA-N 1 1 345.443 3.523 20 5 EHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075195 1018999037 /nfs/dbraw/zinc/99/90/37/1018999037.db2.gz XGALUINHRBIZIA-FZMZJTMJSA-N 1 1 339.823 3.697 20 5 EHBDMO CC1(C)C[C@H](N[C@H]2CC[N@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390418 1019258594 /nfs/dbraw/zinc/25/85/94/1019258594.db2.gz XJCHAXOGYFCURI-BZSNNMDCSA-N 1 1 329.444 3.534 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@H]2CCN3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390418 1019258601 /nfs/dbraw/zinc/25/86/01/1019258601.db2.gz XJCHAXOGYFCURI-BZSNNMDCSA-N 1 1 329.444 3.534 20 5 EHBDMO Cc1ccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000513392639 1019604988 /nfs/dbraw/zinc/60/49/88/1019604988.db2.gz VINXJYGTLPRRQR-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000513392639 1019604993 /nfs/dbraw/zinc/60/49/93/1019604993.db2.gz VINXJYGTLPRRQR-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000182828993 1019757117 /nfs/dbraw/zinc/75/71/17/1019757117.db2.gz PWMXJYPBBDBJTG-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccc([S@](C)=O)cc1 ZINC000182828993 1019757129 /nfs/dbraw/zinc/75/71/29/1019757129.db2.gz PWMXJYPBBDBJTG-BSEYFRJRSA-N 1 1 346.452 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000320050007 1020078205 /nfs/dbraw/zinc/07/82/05/1020078205.db2.gz SHMCJOCBPBAGGL-JTQLQIEISA-N 1 1 329.322 3.510 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000320050014 1020079146 /nfs/dbraw/zinc/07/91/46/1020079146.db2.gz SHMCJOCBPBAGGL-SNVBAGLBSA-N 1 1 329.322 3.510 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602515632 1032929004 /nfs/dbraw/zinc/92/90/04/1032929004.db2.gz AOXNABAMNZFEPY-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000510422310 1020867390 /nfs/dbraw/zinc/86/73/90/1020867390.db2.gz SXVOWXNDAGCSFJ-NSHDSACASA-N 1 1 338.791 3.975 20 5 EHBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000135226077 1020919084 /nfs/dbraw/zinc/91/90/84/1020919084.db2.gz UKIFUCVYJDZCNK-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000135226077 1020919088 /nfs/dbraw/zinc/91/90/88/1020919088.db2.gz UKIFUCVYJDZCNK-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)cc1F ZINC000276270536 1020983892 /nfs/dbraw/zinc/98/38/92/1020983892.db2.gz CSXDPFDLTXTHKC-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](CO)CC3)s2)cc1 ZINC000581599303 1021132245 /nfs/dbraw/zinc/13/22/45/1021132245.db2.gz ZUTQKCNKURPPEE-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519847312 1021722744 /nfs/dbraw/zinc/72/27/44/1021722744.db2.gz KMIYZZZEVSHFLP-MRXNPFEDSA-N 1 1 332.400 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@](O)(C4CC4)C3)s2)cc1 ZINC000426499375 1021743521 /nfs/dbraw/zinc/74/35/21/1021743521.db2.gz QOEQLCUXRBWYOL-GOSISDBHSA-N 1 1 344.436 3.670 20 5 EHBDMO CC(C)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000438489440 1022042940 /nfs/dbraw/zinc/04/29/40/1022042940.db2.gz JIQFGKRFHAJVPN-OAHLLOKOSA-N 1 1 329.400 3.770 20 5 EHBDMO NC(=[NH2+])N(c1ccc(F)cc1)c1ncnc2cc3ccccc3cc21 ZINC001167991108 1022299817 /nfs/dbraw/zinc/29/98/17/1022299817.db2.gz AVCQZTHKZPHBNR-UHFFFAOYSA-N 1 1 331.354 3.954 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCC(F)(F)CC1 ZINC000602663830 1033061072 /nfs/dbraw/zinc/06/10/72/1033061072.db2.gz WHPHDZPMCDWBFE-UHFFFAOYSA-N 1 1 325.315 3.746 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226142 1022587457 /nfs/dbraw/zinc/58/74/57/1022587457.db2.gz WFRQDXZGIGODBT-OLZOCXBDSA-N 1 1 342.436 3.849 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000894636331 1022648829 /nfs/dbraw/zinc/64/88/29/1022648829.db2.gz YOTRZMJJQVRVSH-MRXNPFEDSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000894636331 1022648831 /nfs/dbraw/zinc/64/88/31/1022648831.db2.gz YOTRZMJJQVRVSH-MRXNPFEDSA-N 1 1 336.819 3.639 20 5 EHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)cc1OC ZINC000507123329 1023141156 /nfs/dbraw/zinc/14/11/56/1023141156.db2.gz YUQXZSSXPPXAEX-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)cc1OC ZINC000507123329 1023141160 /nfs/dbraw/zinc/14/11/60/1023141160.db2.gz YUQXZSSXPPXAEX-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](CC)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000276836573 1023152585 /nfs/dbraw/zinc/15/25/85/1023152585.db2.gz BRIYTDKRVHZHEW-CYBMUJFWSA-N 1 1 335.429 3.999 20 5 EHBDMO CCc1ccc([C@H]2CCCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259672 1023945160 /nfs/dbraw/zinc/94/51/60/1023945160.db2.gz WJVMGTDWXNOLEJ-OAHLLOKOSA-N 1 1 332.404 3.564 20 5 EHBDMO CCc1oc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1C(=O)OC ZINC000430117301 1024386582 /nfs/dbraw/zinc/38/65/82/1024386582.db2.gz YZDQYGFHAWPWPL-UHFFFAOYSA-N 1 1 346.383 3.562 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CCOC)Cc1ccccc1 ZINC000505577560 1024510617 /nfs/dbraw/zinc/51/06/17/1024510617.db2.gz YCRDVMOVAKWIPI-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCOC)Cc1ccccc1 ZINC000505577560 1024510618 /nfs/dbraw/zinc/51/06/18/1024510618.db2.gz YCRDVMOVAKWIPI-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842109 1033219542 /nfs/dbraw/zinc/21/95/42/1033219542.db2.gz QCBRTOIAYXFLBG-HNNXBMFYSA-N 1 1 342.399 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842109 1033219559 /nfs/dbraw/zinc/21/95/59/1033219559.db2.gz QCBRTOIAYXFLBG-HNNXBMFYSA-N 1 1 342.399 3.625 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CC(C)C)CC(C)(C)C ZINC000474206887 1024578371 /nfs/dbraw/zinc/57/83/71/1024578371.db2.gz HLGYJVPBUOLCPO-UHFFFAOYSA-N 1 1 335.448 3.846 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1C ZINC000538937426 1024624809 /nfs/dbraw/zinc/62/48/09/1024624809.db2.gz RXEDLIPLELGNDY-YPMHNXCESA-N 1 1 343.374 3.505 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C3CC(F)(F)C3)cs2)c1 ZINC000277399355 1024925233 /nfs/dbraw/zinc/92/52/33/1024925233.db2.gz DXNXGCKRDZTJPS-UHFFFAOYSA-N 1 1 325.340 3.606 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025424215 1024928168 /nfs/dbraw/zinc/92/81/68/1024928168.db2.gz PRELDAMHWFKVFH-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025424215 1024928180 /nfs/dbraw/zinc/92/81/80/1024928180.db2.gz PRELDAMHWFKVFH-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc(F)cn3)CC2)c(F)c1 ZINC000602906702 1033257265 /nfs/dbraw/zinc/25/72/65/1033257265.db2.gz ZLQQMMZBFALOIT-UHFFFAOYSA-N 1 1 333.338 3.648 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000521099628 1025203510 /nfs/dbraw/zinc/20/35/10/1025203510.db2.gz IARIESXULSDYSK-INIZCTEOSA-N 1 1 348.447 3.679 20 5 EHBDMO COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000521221373 1025280177 /nfs/dbraw/zinc/28/01/77/1025280177.db2.gz AQSBFJCMRHZKGP-MRXNPFEDSA-N 1 1 344.411 3.683 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCS1 ZINC000425479326 1025421037 /nfs/dbraw/zinc/42/10/37/1025421037.db2.gz OIJLQEUZWSQJOY-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCS1 ZINC000425479326 1025421049 /nfs/dbraw/zinc/42/10/49/1025421049.db2.gz OIJLQEUZWSQJOY-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493847 1025495862 /nfs/dbraw/zinc/49/58/62/1025495862.db2.gz WOBMZGKROULLQA-HKBKRHGFSA-N 1 1 340.427 3.611 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000281881085 1025633360 /nfs/dbraw/zinc/63/33/60/1025633360.db2.gz AJDVYKRUQGYTBW-INIZCTEOSA-N 1 1 340.427 3.507 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213763 1025679934 /nfs/dbraw/zinc/67/99/34/1025679934.db2.gz WFIMYFNFGPIAOV-KBXCAEBGSA-N 1 1 341.411 3.972 20 5 EHBDMO Cc1ccc(N2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)[C@@H](C)C2)cc1C ZINC001167559216 1025713915 /nfs/dbraw/zinc/71/39/15/1025713915.db2.gz ZLQIZKIDUSFIJO-KRWDZBQOSA-N 1 1 339.439 3.922 20 5 EHBDMO Cc1ccc(N2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)[C@@H](C)C2)cc1C ZINC001167559216 1025713930 /nfs/dbraw/zinc/71/39/30/1025713930.db2.gz ZLQIZKIDUSFIJO-KRWDZBQOSA-N 1 1 339.439 3.922 20 5 EHBDMO Cc1c(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cccc1[N+](=O)[O-] ZINC000425547187 1025722330 /nfs/dbraw/zinc/72/23/30/1025722330.db2.gz FNZVVYYCLFFIPU-GOSISDBHSA-N 1 1 330.428 3.684 20 5 EHBDMO Cc1nnc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542848 1026089488 /nfs/dbraw/zinc/08/94/88/1026089488.db2.gz AJYGJHLIPRTLGI-SMDDNHRTSA-N 1 1 332.429 3.695 20 5 EHBDMO Cc1nnc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542848 1026089505 /nfs/dbraw/zinc/08/95/05/1026089505.db2.gz AJYGJHLIPRTLGI-SMDDNHRTSA-N 1 1 332.429 3.695 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000451842169 1026317443 /nfs/dbraw/zinc/31/74/43/1026317443.db2.gz QODYKRAFMQJQGA-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000451842169 1026317458 /nfs/dbraw/zinc/31/74/58/1026317458.db2.gz QODYKRAFMQJQGA-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000342575283 1026327135 /nfs/dbraw/zinc/32/71/35/1026327135.db2.gz XMGYOPNXBHEGGT-HNNXBMFYSA-N 1 1 346.383 3.680 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000342575283 1026327141 /nfs/dbraw/zinc/32/71/41/1026327141.db2.gz XMGYOPNXBHEGGT-HNNXBMFYSA-N 1 1 346.383 3.680 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000452124254 1026492622 /nfs/dbraw/zinc/49/26/22/1026492622.db2.gz WFOCLNLHSFQEQU-AWEZNQCLSA-N 1 1 345.365 3.528 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000531209317 1026688418 /nfs/dbraw/zinc/68/84/18/1026688418.db2.gz WASWVBNSVJZHDP-LJQANCHMSA-N 1 1 340.423 3.819 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCOc1ccc(F)cc1 ZINC000520041087 1026689064 /nfs/dbraw/zinc/68/90/64/1026689064.db2.gz KIQFULQULLKNFL-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000186439117 1026907366 /nfs/dbraw/zinc/90/73/66/1026907366.db2.gz GTMIEXUZIQNRGJ-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000186439117 1026907372 /nfs/dbraw/zinc/90/73/72/1026907372.db2.gz GTMIEXUZIQNRGJ-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413164921 1027189972 /nfs/dbraw/zinc/18/99/72/1027189972.db2.gz RJUMXSDWWGGJIH-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420945039 1027905899 /nfs/dbraw/zinc/90/58/99/1027905899.db2.gz KEZDZFBYOUDFNJ-GFCCVEGCSA-N 1 1 332.322 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(C(F)(F)F)c1 ZINC000091480191 1028031200 /nfs/dbraw/zinc/03/12/00/1028031200.db2.gz OGZACWQKLZMQQM-JTQLQIEISA-N 1 1 340.305 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](Cc4ccccc4)C3)nc2c1 ZINC000444653931 1028116788 /nfs/dbraw/zinc/11/67/88/1028116788.db2.gz VUAYNUXDIAOCQX-HNNXBMFYSA-N 1 1 336.395 3.536 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCC[C@@H]1C ZINC000444679069 1028148805 /nfs/dbraw/zinc/14/88/05/1028148805.db2.gz SYBJJNCKUPWGIM-GUYCJALGSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444681729 1028150930 /nfs/dbraw/zinc/15/09/30/1028150930.db2.gz WGNQAONDWNHJPB-UHFFFAOYSA-N 1 1 326.396 3.767 20 5 EHBDMO CC[C@H](NC[C@H]1[NH2+]CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437953 1028447030 /nfs/dbraw/zinc/44/70/30/1028447030.db2.gz URCVDPDIFXEXQY-RBUKOAKNSA-N 1 1 325.412 3.523 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000518934491 1028457684 /nfs/dbraw/zinc/45/76/84/1028457684.db2.gz ZFLXEEKDGIIYBQ-HNNXBMFYSA-N 1 1 347.459 3.534 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)o1 ZINC000523701636 1028553719 /nfs/dbraw/zinc/55/37/19/1028553719.db2.gz VLHBLMKOQPJUCS-UHFFFAOYSA-N 1 1 339.189 3.625 20 5 EHBDMO COc1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000075843661 1028798613 /nfs/dbraw/zinc/79/86/13/1028798613.db2.gz GACXHYSQPWCTEE-INIZCTEOSA-N 1 1 334.416 3.527 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCCO)C2CC2)s1 ZINC000611271589 1029036805 /nfs/dbraw/zinc/03/68/05/1029036805.db2.gz GVUMTOFBZJJZPC-UHFFFAOYSA-N 1 1 332.425 3.670 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000179171900 1029063751 /nfs/dbraw/zinc/06/37/51/1029063751.db2.gz AYOKBNABWFIYSE-FZKQIMNGSA-N 1 1 349.862 3.697 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532966849 1029112088 /nfs/dbraw/zinc/11/20/88/1029112088.db2.gz XCABTIZWRCEVMX-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO Cc1cc(-n2ccnc2)ccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000191889347 1029114649 /nfs/dbraw/zinc/11/46/49/1029114649.db2.gz WELMNJHMHDPTSB-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(Cc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000524594650 1029348890 /nfs/dbraw/zinc/34/88/90/1029348890.db2.gz RMFIPWPLOMWQAW-UHFFFAOYSA-N 1 1 345.468 3.537 20 5 EHBDMO Cc1nccn1CCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000130307976 1029359507 /nfs/dbraw/zinc/35/95/07/1029359507.db2.gz OGQWYZAVJRLONJ-UHFFFAOYSA-N 1 1 328.416 3.545 20 5 EHBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988779 1029575152 /nfs/dbraw/zinc/57/51/52/1029575152.db2.gz JSICUHZRMWEXML-NOZJJQNGSA-N 1 1 329.322 3.508 20 5 EHBDMO C[C@@H]1[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1(C)C ZINC000537624761 1029904001 /nfs/dbraw/zinc/90/40/01/1029904001.db2.gz OZZTVFAVVWRAPB-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1(C)C ZINC000537624761 1029904013 /nfs/dbraw/zinc/90/40/13/1029904013.db2.gz OZZTVFAVVWRAPB-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537626538 1029904430 /nfs/dbraw/zinc/90/44/30/1029904430.db2.gz WSZYTMWERBGAOR-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537626538 1029904448 /nfs/dbraw/zinc/90/44/48/1029904448.db2.gz WSZYTMWERBGAOR-OLZOCXBDSA-N 1 1 332.425 3.933 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000441247968 1030142103 /nfs/dbraw/zinc/14/21/03/1030142103.db2.gz UHXJEGJAEXCFNI-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146927 1030916388 /nfs/dbraw/zinc/91/63/88/1030916388.db2.gz YFBZPXXNOAJOIW-GJZGRUSLSA-N 1 1 347.459 3.530 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000190722106 1030925655 /nfs/dbraw/zinc/92/56/55/1030925655.db2.gz OANBQICHRRVJRW-UKRRQHHQSA-N 1 1 349.431 3.645 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000190722106 1030925662 /nfs/dbraw/zinc/92/56/62/1030925662.db2.gz OANBQICHRRVJRW-UKRRQHHQSA-N 1 1 349.431 3.645 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483238333 1031050456 /nfs/dbraw/zinc/05/04/56/1031050456.db2.gz WWNAOQOYGSVOAU-AWEZNQCLSA-N 1 1 333.432 3.600 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000537695045 1031081510 /nfs/dbraw/zinc/08/15/10/1031081510.db2.gz WKPYBIAGIZHFQK-LRDDRELGSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000483340551 1031127677 /nfs/dbraw/zinc/12/76/77/1031127677.db2.gz KVHQGZVPPYLDNM-BEFAXECRSA-N 1 1 348.443 3.624 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000343567910 1031415224 /nfs/dbraw/zinc/41/52/24/1031415224.db2.gz NUEGBVJTQPOUFB-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000248136824 1031423441 /nfs/dbraw/zinc/42/34/41/1031423441.db2.gz PDQXHOAEAXOKNL-QFBILLFUSA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477441001 1031553190 /nfs/dbraw/zinc/55/31/90/1031553190.db2.gz UECRGPUSHLTDGJ-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071954 1033324193 /nfs/dbraw/zinc/32/41/93/1033324193.db2.gz VNRSXUGSAJGJDY-PKXJPQMGSA-N 1 1 329.425 3.629 20 5 EHBDMO Cc1nn(C[N@H+](C)C[C@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291543 1033539661 /nfs/dbraw/zinc/53/96/61/1033539661.db2.gz UTPPTUHRNUMZQV-AWEZNQCLSA-N 1 1 338.411 3.946 20 5 EHBDMO CC(C)[C@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000594990428 1033620990 /nfs/dbraw/zinc/62/09/90/1033620990.db2.gz QMAGQUQLOMQTSO-MSOLQXFVSA-N 1 1 332.375 3.582 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000593660524 1033636829 /nfs/dbraw/zinc/63/68/29/1033636829.db2.gz IRYGYDQSKXQCBN-UAGQMJEPSA-N 1 1 342.443 3.832 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000595330990 1033730309 /nfs/dbraw/zinc/73/03/09/1033730309.db2.gz GXUWIPXFDQODRF-ZBFHGGJFSA-N 1 1 329.400 3.907 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327731 1033730638 /nfs/dbraw/zinc/73/06/38/1033730638.db2.gz RHQZDZMLUCNZRI-HZPDHXFCSA-N 1 1 329.400 3.968 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000595383844 1033784607 /nfs/dbraw/zinc/78/46/07/1033784607.db2.gz PFRMYFXSEIGNHP-QGZVFWFLSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000595383844 1033784622 /nfs/dbraw/zinc/78/46/22/1033784622.db2.gz PFRMYFXSEIGNHP-QGZVFWFLSA-N 1 1 329.375 3.810 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000603629038 1033815218 /nfs/dbraw/zinc/81/52/18/1033815218.db2.gz LMLWAFXUHIJCEF-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO CC[N@@H+](CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C(C)C ZINC000593705194 1033816593 /nfs/dbraw/zinc/81/65/93/1033816593.db2.gz QWBZAWUNNFAVHP-CQSZACIVSA-N 1 1 333.354 3.518 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000603661739 1033833093 /nfs/dbraw/zinc/83/30/93/1033833093.db2.gz UWXKOPZKECUZHN-UHFFFAOYSA-N 1 1 342.370 3.902 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552527 1033859555 /nfs/dbraw/zinc/85/95/55/1033859555.db2.gz MKHKUVMUYIXOSW-QGZVFWFLSA-N 1 1 333.363 3.628 20 5 EHBDMO Cc1noc(C[N@@H+]2CCCC[C@H]2Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595556706 1033861237 /nfs/dbraw/zinc/86/12/37/1033861237.db2.gz BQOWCVMUBUDGPE-AWEZNQCLSA-N 1 1 333.363 3.628 20 5 EHBDMO Cc1noc(C[N@H+]2CCCC[C@H]2Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595556706 1033861248 /nfs/dbraw/zinc/86/12/48/1033861248.db2.gz BQOWCVMUBUDGPE-AWEZNQCLSA-N 1 1 333.363 3.628 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834322 1033960487 /nfs/dbraw/zinc/96/04/87/1033960487.db2.gz QNUWPUOEJHIVET-XJKSGUPXSA-N 1 1 326.400 3.634 20 5 EHBDMO C[N@@H+](CC1=CCSC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595890199 1034020316 /nfs/dbraw/zinc/02/03/16/1034020316.db2.gz ZRRWYPFYCPVAEM-UHFFFAOYSA-N 1 1 332.347 3.719 20 5 EHBDMO Cc1cccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179315787 1034108371 /nfs/dbraw/zinc/10/83/71/1034108371.db2.gz YEBSPSKTDDIXPC-UHFFFAOYSA-N 1 1 336.395 3.925 20 5 EHBDMO Cc1cccc(-c2n[nH]cc2C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000179315787 1034108379 /nfs/dbraw/zinc/10/83/79/1034108379.db2.gz YEBSPSKTDDIXPC-UHFFFAOYSA-N 1 1 336.395 3.925 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])nc2)[C@H]1c1ccc(Cl)cc1 ZINC000450413160 1034300224 /nfs/dbraw/zinc/30/02/24/1034300224.db2.gz SNTUGSTUYGHHCY-GDBMZVCRSA-N 1 1 332.791 3.501 20 5 EHBDMO C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000534270984 1034332926 /nfs/dbraw/zinc/33/29/26/1034332926.db2.gz KHFSMFYMFUGRCN-IBGZPJMESA-N 1 1 348.406 3.636 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](CCSc1ccccc1F)C2 ZINC000534510485 1034630882 /nfs/dbraw/zinc/63/08/82/1034630882.db2.gz ICLKBMGXIVOMRB-UHFFFAOYSA-N 1 1 332.400 3.884 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCSc1ccccc1F)C2 ZINC000534510485 1034630892 /nfs/dbraw/zinc/63/08/92/1034630892.db2.gz ICLKBMGXIVOMRB-UHFFFAOYSA-N 1 1 332.400 3.884 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccn(CC(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000450676361 1034703968 /nfs/dbraw/zinc/70/39/68/1034703968.db2.gz FHHQNMJGIMYSAZ-CQSZACIVSA-N 1 1 342.321 3.595 20 5 EHBDMO CC(C)c1ccc([C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000534665855 1034791151 /nfs/dbraw/zinc/79/11/51/1034791151.db2.gz OBDZWWVZYXQTHK-QGZVFWFLSA-N 1 1 328.416 3.752 20 5 EHBDMO CCc1ccc([C@@H](N[C@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407730 1034890702 /nfs/dbraw/zinc/89/07/02/1034890702.db2.gz ZFDRGSCLYMENOR-KXBFYZLASA-N 1 1 343.427 3.523 20 5 EHBDMO COc1cc(C[N@H+]2CCCC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000180026470 1035219962 /nfs/dbraw/zinc/21/99/62/1035219962.db2.gz SJEIUASUPRAPGI-UHFFFAOYSA-N 1 1 344.358 3.622 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000178053740 1035615038 /nfs/dbraw/zinc/61/50/38/1035615038.db2.gz WRBJVFQARRYNRI-KRWDZBQOSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000178053740 1035615048 /nfs/dbraw/zinc/61/50/48/1035615048.db2.gz WRBJVFQARRYNRI-KRWDZBQOSA-N 1 1 329.375 3.810 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000581840495 1035641112 /nfs/dbraw/zinc/64/11/12/1035641112.db2.gz LLFOHMKKAQVCIM-MRXNPFEDSA-N 1 1 330.432 3.834 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936040 1035673727 /nfs/dbraw/zinc/67/37/27/1035673727.db2.gz VDSZQKCASXEWDV-DOTOQJQBSA-N 1 1 326.396 3.852 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)s1 ZINC000588072480 1035699840 /nfs/dbraw/zinc/69/98/40/1035699840.db2.gz LEJOQPKQIDCAGC-GOSISDBHSA-N 1 1 343.452 3.759 20 5 EHBDMO O=C(CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccc(F)cc1 ZINC000540819795 1035709710 /nfs/dbraw/zinc/70/97/10/1035709710.db2.gz KGWOVTRNOVCCQB-UHFFFAOYSA-N 1 1 342.370 3.971 20 5 EHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204725 1035823685 /nfs/dbraw/zinc/82/36/85/1035823685.db2.gz ASUXXYDDVNSMKR-KXBFYZLASA-N 1 1 341.411 3.842 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000780396959 1035995625 /nfs/dbraw/zinc/99/56/25/1035995625.db2.gz GRGGMFHENBNMTN-YZMSFBEDSA-N 1 1 338.407 3.806 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000535265759 1036260386 /nfs/dbraw/zinc/26/03/86/1036260386.db2.gz MNYRACFVDWVAGF-KRWDZBQOSA-N 1 1 334.379 3.742 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCO1 ZINC000511505770 1036272971 /nfs/dbraw/zinc/27/29/71/1036272971.db2.gz FZRMAPSMYZQSHX-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCOC(C)(C)C1 ZINC000589274674 1036338247 /nfs/dbraw/zinc/33/82/47/1036338247.db2.gz NHYJQYKGXPSECN-INIZCTEOSA-N 1 1 336.432 3.643 20 5 EHBDMO CCOc1ccc(NC(=O)C[N@@H+](C(CC)CC)C2CC2)c([N+](=O)[O-])c1 ZINC000165332616 1036414598 /nfs/dbraw/zinc/41/45/98/1036414598.db2.gz JMWAFORUFSWPJL-UHFFFAOYSA-N 1 1 349.431 3.585 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)Cc2cccc(C)c2C)c1 ZINC000590051021 1036727194 /nfs/dbraw/zinc/72/71/94/1036727194.db2.gz UBSLCURSRUYALE-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)Cc2cccc(C)c2C)c1 ZINC000590051021 1036727211 /nfs/dbraw/zinc/72/72/11/1036727211.db2.gz UBSLCURSRUYALE-UHFFFAOYSA-N 1 1 342.395 3.630 20 5 EHBDMO COc1cccc(OCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000443620243 1036791004 /nfs/dbraw/zinc/79/10/04/1036791004.db2.gz SEELRJCAHADGKH-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c(Cl)c1 ZINC000542003243 1036953700 /nfs/dbraw/zinc/95/37/00/1036953700.db2.gz XCUDHENNOVTNPY-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@H]2CCc3ccccc32)c(Cl)c1 ZINC000542003243 1036953715 /nfs/dbraw/zinc/95/37/15/1036953715.db2.gz XCUDHENNOVTNPY-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000016445410 1037238294 /nfs/dbraw/zinc/23/82/94/1037238294.db2.gz DGMKHVIINGYSLN-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1c(CN2CCC(C[NH+]3CCCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000057888606 1037242668 /nfs/dbraw/zinc/24/26/68/1037242668.db2.gz UROIOXKSIVTZSL-UHFFFAOYSA-N 1 1 345.487 3.991 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000539826869 1037253394 /nfs/dbraw/zinc/25/33/94/1037253394.db2.gz CTVPUZGPAFOGBW-VTSXBNNFSA-N 1 1 326.396 3.664 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000595079524 1037300968 /nfs/dbraw/zinc/30/09/68/1037300968.db2.gz KBLIQCCIIQKNEG-QGZVFWFLSA-N 1 1 328.416 3.588 20 5 EHBDMO C[C@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@H+]1C1CC1 ZINC000177185132 1037409556 /nfs/dbraw/zinc/40/95/56/1037409556.db2.gz CRTWYUFDTRZXTO-HOCLYGCPSA-N 1 1 345.446 3.743 20 5 EHBDMO C[N@H+](Cc1cccc(O)c1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573342509 1037453970 /nfs/dbraw/zinc/45/39/70/1037453970.db2.gz PUPMBDZUHQYRRX-UHFFFAOYSA-N 1 1 340.301 3.951 20 5 EHBDMO C[N@@H+](Cc1cccc(O)c1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573342509 1037453979 /nfs/dbraw/zinc/45/39/79/1037453979.db2.gz PUPMBDZUHQYRRX-UHFFFAOYSA-N 1 1 340.301 3.951 20 5 EHBDMO CC1(C)[C@@H](O)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000462868194 1037493411 /nfs/dbraw/zinc/49/34/11/1037493411.db2.gz AJQJXRJHPOVMNK-INIZCTEOSA-N 1 1 332.425 3.669 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000463051947 1037704109 /nfs/dbraw/zinc/70/41/09/1037704109.db2.gz GEIYGLTWTPCUBT-OAHLLOKOSA-N 1 1 345.468 3.844 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000494045534 1037793202 /nfs/dbraw/zinc/79/32/02/1037793202.db2.gz AWZWVUNHQTYDRZ-UHFFFAOYSA-N 1 1 325.368 3.587 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000494081310 1037828239 /nfs/dbraw/zinc/82/82/39/1037828239.db2.gz YFXZFVAIFPGCAJ-UHFFFAOYSA-N 1 1 325.368 3.587 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001226 1037853523 /nfs/dbraw/zinc/85/35/23/1037853523.db2.gz QDUSPZLMJZAXGZ-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001226 1037853530 /nfs/dbraw/zinc/85/35/30/1037853530.db2.gz QDUSPZLMJZAXGZ-MLGOLLRUSA-N 1 1 334.807 3.528 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](OCCC(C)C)C1 ZINC000538735963 1038501329 /nfs/dbraw/zinc/50/13/29/1038501329.db2.gz QFGZNWNXYBDZSV-QGZVFWFLSA-N 1 1 336.432 3.631 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](OCCC(C)C)C1 ZINC000538735963 1038501341 /nfs/dbraw/zinc/50/13/41/1038501341.db2.gz QFGZNWNXYBDZSV-QGZVFWFLSA-N 1 1 336.432 3.631 20 5 EHBDMO CS[C@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538796206 1038532222 /nfs/dbraw/zinc/53/22/22/1038532222.db2.gz USEJVXAYWWIOKS-ZDUSSCGKSA-N 1 1 346.399 3.914 20 5 EHBDMO CS[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538796206 1038532230 /nfs/dbraw/zinc/53/22/30/1038532230.db2.gz USEJVXAYWWIOKS-ZDUSSCGKSA-N 1 1 346.399 3.914 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000538926491 1038607278 /nfs/dbraw/zinc/60/72/78/1038607278.db2.gz HXNBIBYSMAOUKA-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO CCC[C@@H]([NH2+][C@H](CO)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000539086555 1038666771 /nfs/dbraw/zinc/66/67/71/1038666771.db2.gz BICDDVHJAGEMJL-QZTJIDSGSA-N 1 1 344.411 3.768 20 5 EHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967828 1038769341 /nfs/dbraw/zinc/76/93/41/1038769341.db2.gz FHEJZPQPHJFNCB-STQMWFEESA-N 1 1 334.416 3.860 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500472091 1038783844 /nfs/dbraw/zinc/78/38/44/1038783844.db2.gz WFEDEZURFOXBCL-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cccc([C@@H]2CCCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000478008173 1039112211 /nfs/dbraw/zinc/11/22/11/1039112211.db2.gz CVADXDOSTQAOSJ-KRWDZBQOSA-N 1 1 328.416 3.717 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485763340 1039536336 /nfs/dbraw/zinc/53/63/36/1039536336.db2.gz BRNDNGKXKZWRDI-CYBMUJFWSA-N 1 1 330.384 3.805 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[NH+](Cc2cccs2)CC1 ZINC000485817926 1039596577 /nfs/dbraw/zinc/59/65/77/1039596577.db2.gz QUIKRDBXSFIXCQ-OAHLLOKOSA-N 1 1 345.468 3.844 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3cncn3c1)CCCC2 ZINC000417369436 1039737788 /nfs/dbraw/zinc/73/77/88/1039737788.db2.gz PHFCUGKYGMBAOY-IBGZPJMESA-N 1 1 336.395 3.800 20 5 EHBDMO CCCC[N@@H+](CCOC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845176 1040032061 /nfs/dbraw/zinc/03/20/61/1040032061.db2.gz HAABAWMOYNTDSL-UHFFFAOYSA-N 1 1 334.338 3.862 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccc3c(c2)CCO3)C2CC2)c1 ZINC000490157598 1040375501 /nfs/dbraw/zinc/37/55/01/1040375501.db2.gz ILPBCOAEHXSMRP-UHFFFAOYSA-N 1 1 338.407 3.737 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000490831557 1040768680 /nfs/dbraw/zinc/76/86/80/1040768680.db2.gz YRFISSWZBCEUHO-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1nccc2c1cccc2[N+](=O)[O-] ZINC001167751006 1040795356 /nfs/dbraw/zinc/79/53/56/1040795356.db2.gz GRNGCSPCCQSQSD-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO COC(=O)[C@H](C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509782843 1040816137 /nfs/dbraw/zinc/81/61/37/1040816137.db2.gz OCLPGSSZLRYUAC-GFCCVEGCSA-N 1 1 348.424 3.564 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](c1ccccc1)C1(CO)CCC1 ZINC000433321153 1041279561 /nfs/dbraw/zinc/27/95/61/1041279561.db2.gz NEBHTPCMGRLDPW-GOSISDBHSA-N 1 1 344.386 3.727 20 5 EHBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000047265488 1041600152 /nfs/dbraw/zinc/60/01/52/1041600152.db2.gz HLZIZTAJUDKONK-AWEZNQCLSA-N 1 1 345.424 3.507 20 5 EHBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000047265488 1041600158 /nfs/dbraw/zinc/60/01/58/1041600158.db2.gz HLZIZTAJUDKONK-AWEZNQCLSA-N 1 1 345.424 3.507 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000511830621 1041672380 /nfs/dbraw/zinc/67/23/80/1041672380.db2.gz RCNZGEBNULTBFM-UONOGXRCSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000511830621 1041672382 /nfs/dbraw/zinc/67/23/82/1041672382.db2.gz RCNZGEBNULTBFM-UONOGXRCSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837885 1041684620 /nfs/dbraw/zinc/68/46/20/1041684620.db2.gz JZMPEAWVCHWUJS-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837885 1041684626 /nfs/dbraw/zinc/68/46/26/1041684626.db2.gz JZMPEAWVCHWUJS-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO CC(C)[C@H](CO)[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000112657831 1042416768 /nfs/dbraw/zinc/41/67/68/1042416768.db2.gz KOKVQFXXWPPEQB-IBGZPJMESA-N 1 1 346.402 3.753 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000112657831 1042416772 /nfs/dbraw/zinc/41/67/72/1042416772.db2.gz KOKVQFXXWPPEQB-IBGZPJMESA-N 1 1 346.402 3.753 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000279034759 1043233270 /nfs/dbraw/zinc/23/32/70/1043233270.db2.gz ITIKKVOLRRRGKE-UHFFFAOYSA-N 1 1 344.390 3.651 20 5 EHBDMO Cc1cc(C[C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000279114932 1043373405 /nfs/dbraw/zinc/37/34/05/1043373405.db2.gz PMSDKPHVTNPSSR-DIFFPNOSSA-N 1 1 328.416 3.570 20 5 EHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697752 1126856352 /nfs/dbraw/zinc/85/63/52/1126856352.db2.gz SIPRZQUQFUHMJU-UKRRQHHQSA-N 1 1 329.400 3.913 20 5 EHBDMO C[C@H]1CCN(c2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301467679 1128444130 /nfs/dbraw/zinc/44/41/30/1128444130.db2.gz YLKQJZHBRWPDSK-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000553679284 1128497014 /nfs/dbraw/zinc/49/70/14/1128497014.db2.gz ZFLZVMPLQROSIK-HXUWFJFHSA-N 1 1 337.423 3.697 20 5 EHBDMO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091413798 1128661307 /nfs/dbraw/zinc/66/13/07/1128661307.db2.gz UBSCZOBBSNQOFO-PIGZYNQJSA-N 1 1 336.338 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000153854217 1128776282 /nfs/dbraw/zinc/77/62/82/1128776282.db2.gz PKBPIBWZFMSCIR-SFHVURJKSA-N 1 1 327.384 3.596 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988976 1128917092 /nfs/dbraw/zinc/91/70/92/1128917092.db2.gz WEDXLGORCGBLBB-UONOGXRCSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988976 1128917095 /nfs/dbraw/zinc/91/70/95/1128917095.db2.gz WEDXLGORCGBLBB-UONOGXRCSA-N 1 1 345.374 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000609196219 1120543714 /nfs/dbraw/zinc/54/37/14/1120543714.db2.gz HBVXKTCUJRYNNT-INIZCTEOSA-N 1 1 344.386 3.992 20 5 EHBDMO COc1cc(C[NH2+]C2(c3nc(C)cs3)CCC2)ccc1[N+](=O)[O-] ZINC000494800550 1120834799 /nfs/dbraw/zinc/83/47/99/1120834799.db2.gz ODQHKCJXYJISLP-UHFFFAOYSA-N 1 1 333.413 3.537 20 5 EHBDMO C[C@H](NCc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245303 1121128219 /nfs/dbraw/zinc/12/82/19/1121128219.db2.gz XDIIOAJLVWRAAS-WMLDXEAASA-N 1 1 345.468 3.657 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000487965939 1121390684 /nfs/dbraw/zinc/39/06/84/1121390684.db2.gz VFHMUYARMZEDNH-UHFFFAOYSA-N 1 1 329.331 3.816 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000487965939 1121390693 /nfs/dbraw/zinc/39/06/93/1121390693.db2.gz VFHMUYARMZEDNH-UHFFFAOYSA-N 1 1 329.331 3.816 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(F)cc2)CC1 ZINC000487999497 1121577396 /nfs/dbraw/zinc/57/73/96/1121577396.db2.gz AWIVKNSEKVFGAL-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000282119433 1121798124 /nfs/dbraw/zinc/79/81/24/1121798124.db2.gz ARLBJMHYTCUNRL-BBRMVZONSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722558 1121963607 /nfs/dbraw/zinc/96/36/07/1121963607.db2.gz XSTVDMBNNZSCNK-HRCADAONSA-N 1 1 331.460 3.898 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000130650941 1122145011 /nfs/dbraw/zinc/14/50/11/1122145011.db2.gz PHGHZZWSUFLRDJ-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000154466766 1122653553 /nfs/dbraw/zinc/65/35/53/1122653553.db2.gz GSJDLZVOTHLGTA-DEOSSOPVSA-N 1 1 346.452 3.743 20 5 EHBDMO Cc1cc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301217129 1122715782 /nfs/dbraw/zinc/71/57/82/1122715782.db2.gz ZNWJOWLTXHKQCZ-GOSISDBHSA-N 1 1 339.439 3.880 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000557022406 1123268475 /nfs/dbraw/zinc/26/84/75/1123268475.db2.gz LDFOWTBAUHFVEU-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO CC1CCC([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000921207821 1123483407 /nfs/dbraw/zinc/48/34/07/1123483407.db2.gz FSUPMACQVXAOCP-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)C1 ZINC000195508838 1123494616 /nfs/dbraw/zinc/49/46/16/1123494616.db2.gz AFGQTDSTUBNPGS-ZDUSSCGKSA-N 1 1 346.456 3.895 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800978 1123665318 /nfs/dbraw/zinc/66/53/18/1123665318.db2.gz ZBMLFZUIZSSCDG-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800978 1123665320 /nfs/dbraw/zinc/66/53/20/1123665320.db2.gz ZBMLFZUIZSSCDG-SFHVURJKSA-N 1 1 344.436 3.894 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4ccc(F)cc4)CCC3)nc2c1 ZINC000618286791 1125037169 /nfs/dbraw/zinc/03/71/69/1125037169.db2.gz AGLMDZDDZVOUAC-UHFFFAOYSA-N 1 1 340.358 3.779 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc2c(s1)CCCC2 ZINC000619846241 1125416439 /nfs/dbraw/zinc/41/64/39/1125416439.db2.gz VYQAWHFCXSYEOM-UHFFFAOYSA-N 1 1 331.441 3.605 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc2c(s1)CCCC2 ZINC000619846241 1125416443 /nfs/dbraw/zinc/41/64/43/1125416443.db2.gz VYQAWHFCXSYEOM-UHFFFAOYSA-N 1 1 331.441 3.605 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C(F)(F)F ZINC000369968320 1129224829 /nfs/dbraw/zinc/22/48/29/1129224829.db2.gz YUEBOHNZJPHRLF-NWDGAFQWSA-N 1 1 329.322 3.652 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247691 1129371156 /nfs/dbraw/zinc/37/11/56/1129371156.db2.gz VPOOKZFNUWFWFB-ZDUSSCGKSA-N 1 1 330.388 3.513 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399877 /nfs/dbraw/zinc/39/98/77/1129399877.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 1 1 349.475 3.544 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301975764 1129465450 /nfs/dbraw/zinc/46/54/50/1129465450.db2.gz CZDZOVGKMUDGAQ-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000123655122 1129540972 /nfs/dbraw/zinc/54/09/72/1129540972.db2.gz ZRTHQOKLWVRXEZ-MRXNPFEDSA-N 1 1 342.395 3.949 20 5 EHBDMO CC(C)c1ccc(C[NH+]2CCC(O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000330773770 1129645391 /nfs/dbraw/zinc/64/53/91/1129645391.db2.gz FXZCMDNMBNJYHD-UHFFFAOYSA-N 1 1 346.349 3.607 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-] ZINC000125036578 1129655345 /nfs/dbraw/zinc/65/53/45/1129655345.db2.gz XSZVOSXGWQXCBT-FQEVSTJZSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C)[nH+]c2N2CCCC2)c1 ZINC000302037290 1129764560 /nfs/dbraw/zinc/76/45/60/1129764560.db2.gz GAODACSLDMBDNJ-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO CC(C)CN1CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000131161242 1129772263 /nfs/dbraw/zinc/77/22/63/1129772263.db2.gz PQOMULFKNAERLX-IBGZPJMESA-N 1 1 345.487 3.626 20 5 EHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C1 ZINC000162197704 1129812981 /nfs/dbraw/zinc/81/29/81/1129812981.db2.gz GBSHZPRAILYBMT-UHFFFAOYSA-N 1 1 345.424 3.880 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000303471967 1129848185 /nfs/dbraw/zinc/84/81/85/1129848185.db2.gz QWWWSXWTASTBIP-QGZVFWFLSA-N 1 1 338.473 3.971 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2(CCCC2)C1 ZINC000173825374 1130319946 /nfs/dbraw/zinc/31/99/46/1130319946.db2.gz OMOHTTBJPXFIHG-ZDUSSCGKSA-N 1 1 342.399 3.972 20 5 EHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000175119287 1130408323 /nfs/dbraw/zinc/40/83/23/1130408323.db2.gz WIISSNNKKXXUSZ-MRXNPFEDSA-N 1 1 329.400 3.539 20 5 EHBDMO COCC[C@@H]1CCCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914777 1131903165 /nfs/dbraw/zinc/90/31/65/1131903165.db2.gz ISFWITFZGABKJF-ROUUACIJSA-N 1 1 332.444 3.733 20 5 EHBDMO CCN(CC)CC[N@@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918190 1131904237 /nfs/dbraw/zinc/90/42/37/1131904237.db2.gz YPBTWOIGPFTQJH-SFHVURJKSA-N 1 1 333.476 3.506 20 5 EHBDMO CCN(CC[NH+](CC)CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918190 1131904243 /nfs/dbraw/zinc/90/42/43/1131904243.db2.gz YPBTWOIGPFTQJH-SFHVURJKSA-N 1 1 333.476 3.506 20 5 EHBDMO CCN(CC)CC[N@@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918187 1131904599 /nfs/dbraw/zinc/90/45/99/1131904599.db2.gz YPBTWOIGPFTQJH-GOSISDBHSA-N 1 1 333.476 3.506 20 5 EHBDMO CCN(CC[NH+](CC)CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918187 1131904604 /nfs/dbraw/zinc/90/46/04/1131904604.db2.gz YPBTWOIGPFTQJH-GOSISDBHSA-N 1 1 333.476 3.506 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001173181977 1131994385 /nfs/dbraw/zinc/99/43/85/1131994385.db2.gz RCLLQPDCPFFCGW-GHMZBOCLSA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001173181977 1131994390 /nfs/dbraw/zinc/99/43/90/1131994390.db2.gz RCLLQPDCPFFCGW-GHMZBOCLSA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cnc(Cl)s1 ZINC001173224339 1132005764 /nfs/dbraw/zinc/00/57/64/1132005764.db2.gz DWOVPAMMJBMARF-JTQLQIEISA-N 1 1 325.821 3.768 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227933 1132008243 /nfs/dbraw/zinc/00/82/43/1132008243.db2.gz SPMVACWSVHGVDQ-OXQOHEQNSA-N 1 1 339.439 3.515 20 5 EHBDMO CC(=O)c1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173231867 1132008833 /nfs/dbraw/zinc/00/88/33/1132008833.db2.gz OGESFUWMELSUMT-AWEZNQCLSA-N 1 1 338.407 3.787 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN(C)Cc1ccccc1 ZINC001173232607 1132010005 /nfs/dbraw/zinc/01/00/05/1132010005.db2.gz RWYLIRAVAFJXKM-KRWDZBQOSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CC[N@H+](C)Cc1ccccc1 ZINC001173232607 1132010012 /nfs/dbraw/zinc/01/00/12/1132010012.db2.gz RWYLIRAVAFJXKM-KRWDZBQOSA-N 1 1 341.455 3.590 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CC[N@@H+](C)Cc1ccccc1 ZINC001173232607 1132010015 /nfs/dbraw/zinc/01/00/15/1132010015.db2.gz RWYLIRAVAFJXKM-KRWDZBQOSA-N 1 1 341.455 3.590 20 5 EHBDMO COCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000746150924 1132383958 /nfs/dbraw/zinc/38/39/58/1132383958.db2.gz SKTRWSRYUXKUGY-CQSZACIVSA-N 1 1 332.375 3.944 20 5 EHBDMO COCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000746150924 1132383964 /nfs/dbraw/zinc/38/39/64/1132383964.db2.gz SKTRWSRYUXKUGY-CQSZACIVSA-N 1 1 332.375 3.944 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035322 1132636525 /nfs/dbraw/zinc/63/65/25/1132636525.db2.gz KGZRHNQMIXRWNC-IAQYHMDHSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040268 1132638396 /nfs/dbraw/zinc/63/83/96/1132638396.db2.gz ZFYBVASWXCFSPX-XHDPSFHLSA-N 1 1 328.334 3.509 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H](C2CCOCC2)C1 ZINC001175697581 1132729989 /nfs/dbraw/zinc/72/99/89/1132729989.db2.gz DYGUSEVLEQARDW-MRXNPFEDSA-N 1 1 348.443 3.632 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC001177483321 1133068311 /nfs/dbraw/zinc/06/83/11/1133068311.db2.gz MPGXRJRTTMWBIX-AWEZNQCLSA-N 1 1 333.476 3.812 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC001177483321 1133068318 /nfs/dbraw/zinc/06/83/18/1133068318.db2.gz MPGXRJRTTMWBIX-AWEZNQCLSA-N 1 1 333.476 3.812 20 5 EHBDMO COc1cc(C)c(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)n1 ZINC001178175816 1133138712 /nfs/dbraw/zinc/13/87/12/1133138712.db2.gz ALMKIHHMTZFXFN-UHFFFAOYSA-N 1 1 335.791 3.558 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954226 1133365508 /nfs/dbraw/zinc/36/55/08/1133365508.db2.gz QJRIHCWEQBEFPK-VPZZIHKRSA-N 1 1 344.386 3.775 20 5 EHBDMO C[N@H+](CCOc1ccccc1F)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746652324 1133962321 /nfs/dbraw/zinc/96/23/21/1133962321.db2.gz HCAOVWZEKCMCOI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccccc1F)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746652324 1133962324 /nfs/dbraw/zinc/96/23/24/1133962324.db2.gz HCAOVWZEKCMCOI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774839609 1134046421 /nfs/dbraw/zinc/04/64/21/1134046421.db2.gz NAJXSBYNJOFQCR-UHFFFAOYSA-N 1 1 335.385 3.629 20 5 EHBDMO Cc1cc(NC[C@H](C)[N@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC001185148876 1134047315 /nfs/dbraw/zinc/04/73/15/1134047315.db2.gz IOIYOSFDCHOFQC-AWEZNQCLSA-N 1 1 343.402 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000788022058 1134074294 /nfs/dbraw/zinc/07/42/94/1134074294.db2.gz YABRRTANOLHGIY-UHFFFAOYSA-N 1 1 345.330 3.807 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000788022058 1134074300 /nfs/dbraw/zinc/07/43/00/1134074300.db2.gz YABRRTANOLHGIY-UHFFFAOYSA-N 1 1 345.330 3.807 20 5 EHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1cccc(Br)c1[N+](=O)[O-] ZINC001186610697 1134236162 /nfs/dbraw/zinc/23/61/62/1134236162.db2.gz AGBCHQBPXOWELD-LLVKDONJSA-N 1 1 344.253 3.890 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1CCC=N1 ZINC001187371273 1134327574 /nfs/dbraw/zinc/32/75/74/1134327574.db2.gz YDVNTQADNKSMJL-QGZVFWFLSA-N 1 1 346.434 3.934 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000790081760 1134363265 /nfs/dbraw/zinc/36/32/65/1134363265.db2.gz NQANLHVSRZLALY-CYBMUJFWSA-N 1 1 349.431 3.674 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001190417066 1134696566 /nfs/dbraw/zinc/69/65/66/1134696566.db2.gz GLUJPELFIZOESB-UHFFFAOYSA-N 1 1 344.411 3.683 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335422 1134752165 /nfs/dbraw/zinc/75/21/65/1134752165.db2.gz NJLDVJRMBWOYMQ-BNOWGMLFSA-N 1 1 340.370 3.512 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C2CCC2)C2CCOCC2)c([N+](=O)[O-])c1 ZINC001170355518 1134754333 /nfs/dbraw/zinc/75/43/33/1134754333.db2.gz IBVVXTUZBBSREM-AWEZNQCLSA-N 1 1 348.443 3.568 20 5 EHBDMO CC(C)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792863317 1134801892 /nfs/dbraw/zinc/80/18/92/1134801892.db2.gz UEHNKUUMLKQRSK-UHFFFAOYSA-N 1 1 329.356 3.914 20 5 EHBDMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792863317 1134801901 /nfs/dbraw/zinc/80/19/01/1134801901.db2.gz UEHNKUUMLKQRSK-UHFFFAOYSA-N 1 1 329.356 3.914 20 5 EHBDMO CC[C@]1(C)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001191212911 1134817265 /nfs/dbraw/zinc/81/72/65/1134817265.db2.gz DZHNVJNJQDROJX-MRXNPFEDSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001191212911 1134817278 /nfs/dbraw/zinc/81/72/78/1134817278.db2.gz DZHNVJNJQDROJX-MRXNPFEDSA-N 1 1 339.823 3.699 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC001194965956 1135346942 /nfs/dbraw/zinc/34/69/42/1135346942.db2.gz ZZXBSZJOWJIOQZ-LLVKDONJSA-N 1 1 348.786 3.886 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](Oc3ccccc3)C2)cc1 ZINC001196294464 1135544833 /nfs/dbraw/zinc/54/48/33/1135544833.db2.gz XWQNMVNUBUYDGN-LJQANCHMSA-N 1 1 342.395 3.517 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000809355130 1135823979 /nfs/dbraw/zinc/82/39/79/1135823979.db2.gz MADISZRGULTFSH-LBPRGKRZSA-N 1 1 327.375 3.701 20 5 EHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCOC1 ZINC000809935404 1135902316 /nfs/dbraw/zinc/90/23/16/1135902316.db2.gz HDSFDUCTZHTNTG-JTQLQIEISA-N 1 1 333.215 3.760 20 5 EHBDMO CC[N@@H+](CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000811477035 1136096195 /nfs/dbraw/zinc/09/61/95/1136096195.db2.gz BSONXYILIRBSGZ-UHFFFAOYSA-N 1 1 334.247 3.722 20 5 EHBDMO C[C@H](CN1CCN(C)CC1)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000106485835 1136115026 /nfs/dbraw/zinc/11/50/26/1136115026.db2.gz QFYOOGACGGLSRY-GOSISDBHSA-N 1 1 347.506 3.719 20 5 EHBDMO C[N@H+](Cc1ccc2ccccc2c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271502 1136122525 /nfs/dbraw/zinc/12/25/25/1136122525.db2.gz LQTHGYVYBRJBAR-HXUWFJFHSA-N 1 1 336.391 3.913 20 5 EHBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000776278076 1136130836 /nfs/dbraw/zinc/13/08/36/1136130836.db2.gz RPDXKWXPEPXDDR-XPGWFJOJSA-N 1 1 340.423 3.754 20 5 EHBDMO Cc1ccc([C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278192 1136133195 /nfs/dbraw/zinc/13/31/95/1136133195.db2.gz SNIKGPBPMFXYHI-MOPGFXCFSA-N 1 1 326.396 3.774 20 5 EHBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000850184066 1136218275 /nfs/dbraw/zinc/21/82/75/1136218275.db2.gz LBXFEDNRGPXTEO-UHFFFAOYSA-N 1 1 334.807 3.539 20 5 EHBDMO CCC[N@@H+](CCc1cccc(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585581 1136448204 /nfs/dbraw/zinc/44/82/04/1136448204.db2.gz XDVCVSYQFOTDKI-IBGZPJMESA-N 1 1 346.402 3.722 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585599 1136448540 /nfs/dbraw/zinc/44/85/40/1136448540.db2.gz XLQDYMPCSRELSD-WFASDCNBSA-N 1 1 349.456 3.649 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589717 1136452860 /nfs/dbraw/zinc/45/28/60/1136452860.db2.gz VUPNDISZUILLIL-XYPHTWIQSA-N 1 1 330.384 3.694 20 5 EHBDMO COc1cccc(C2([NH2+]Cc3cc(F)ccc3[N+](=O)[O-])CCC2)c1 ZINC000852694096 1136478794 /nfs/dbraw/zinc/47/87/94/1136478794.db2.gz OCFQKTQUBAXNGY-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640969 1136487816 /nfs/dbraw/zinc/48/78/16/1136487816.db2.gz ZHQBTRJMNPRNFW-AZUAARDMSA-N 1 1 340.423 3.680 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1cccs1 ZINC000338958864 1136588706 /nfs/dbraw/zinc/58/87/06/1136588706.db2.gz UIYGJYPJYZTESO-UHFFFAOYSA-N 1 1 342.424 3.721 20 5 EHBDMO CC[N@H+](C)Cc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387610 1136989685 /nfs/dbraw/zinc/98/96/85/1136989685.db2.gz QLWRXOXFRHMFRA-HNNXBMFYSA-N 1 1 327.428 3.897 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387610 1136989688 /nfs/dbraw/zinc/98/96/88/1136989688.db2.gz QLWRXOXFRHMFRA-HNNXBMFYSA-N 1 1 327.428 3.897 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c([N+](=O)[O-])c1 ZINC000859567943 1137020496 /nfs/dbraw/zinc/02/04/96/1137020496.db2.gz MIOUCHLVUYAYGS-QGZVFWFLSA-N 1 1 342.355 3.529 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1F ZINC000860104071 1137044464 /nfs/dbraw/zinc/04/44/64/1137044464.db2.gz GJEOFTLXMCNVKW-CQSZACIVSA-N 1 1 348.349 3.871 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1(Br)CC1 ZINC000846783517 1137365636 /nfs/dbraw/zinc/36/56/36/1137365636.db2.gz PIYHRIUCBDELAQ-UHFFFAOYSA-N 1 1 327.222 3.733 20 5 EHBDMO CC(C)c1cccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC000867945252 1137390643 /nfs/dbraw/zinc/39/06/43/1137390643.db2.gz BNHFDZVBOMXVBR-GOSISDBHSA-N 1 1 327.384 3.531 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ccccc2[C@H](C)C1 ZINC001171740831 1137511108 /nfs/dbraw/zinc/51/11/08/1137511108.db2.gz IIMQJDBWPTYHSA-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO Cc1nccnc1[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000872133491 1137573450 /nfs/dbraw/zinc/57/34/50/1137573450.db2.gz NDVKYUNUMYPWHM-WBMJQRKESA-N 1 1 326.400 3.766 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@@H]2C2CC2)o1 ZINC000878050629 1137700867 /nfs/dbraw/zinc/70/08/67/1137700867.db2.gz ZLZALHDQRGKBCE-CYBMUJFWSA-N 1 1 348.790 3.673 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497111 1137717974 /nfs/dbraw/zinc/71/79/74/1137717974.db2.gz QTVGNSHLRMFMIN-FRRDWIJNSA-N 1 1 330.388 3.511 20 5 EHBDMO CCC1(CC)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000880096910 1137767999 /nfs/dbraw/zinc/76/79/99/1137767999.db2.gz XGHKSLYIZSCCLF-UHFFFAOYSA-N 1 1 330.388 3.799 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@@H+](CC)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000131487121 1137854438 /nfs/dbraw/zinc/85/44/38/1137854438.db2.gz XCNBFEJZWROOSV-KRWDZBQOSA-N 1 1 339.399 3.770 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000332095518 1137931489 /nfs/dbraw/zinc/93/14/89/1137931489.db2.gz DRABEGRCYVSHEI-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886301159 1138065973 /nfs/dbraw/zinc/06/59/73/1138065973.db2.gz YJHVLDGTKULPLF-GOSISDBHSA-N 1 1 341.411 3.516 20 5 EHBDMO CCOCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886301159 1138065975 /nfs/dbraw/zinc/06/59/75/1138065975.db2.gz YJHVLDGTKULPLF-GOSISDBHSA-N 1 1 341.411 3.516 20 5 EHBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000072824101 1138108255 /nfs/dbraw/zinc/10/82/55/1138108255.db2.gz GFLGZUNMFMZABY-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093337388 1138236231 /nfs/dbraw/zinc/23/62/31/1138236231.db2.gz LNPXNYORBZLKJI-ZDUSSCGKSA-N 1 1 347.440 3.577 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(F)c(F)c(F)c1 ZINC000122419509 1138258051 /nfs/dbraw/zinc/25/80/51/1138258051.db2.gz HENTUDPNXYKWHI-SECBINFHSA-N 1 1 340.301 3.872 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803845 /nfs/dbraw/zinc/80/38/45/1139803845.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 1 1 343.427 3.628 20 5 EHBDMO C[C@@H](O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867739 1139870297 /nfs/dbraw/zinc/87/02/97/1139870297.db2.gz XWODQLCQXLMUMB-OCCSQVGLSA-N 1 1 332.425 3.526 20 5 EHBDMO CCc1oc(C(=O)OC)cc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181828156 1139935425 /nfs/dbraw/zinc/93/54/25/1139935425.db2.gz FEHGUHPPCRLDQO-GFCCVEGCSA-N 1 1 346.383 3.696 20 5 EHBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184212070 1140087594 /nfs/dbraw/zinc/08/75/94/1140087594.db2.gz ISEQKVCMBONILZ-AWEZNQCLSA-N 1 1 340.395 3.524 20 5 EHBDMO Cc1cccc2nc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)cn21 ZINC000192849921 1140553666 /nfs/dbraw/zinc/55/36/66/1140553666.db2.gz SESRNVCJVDLQSW-SFHVURJKSA-N 1 1 336.395 3.718 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000267463484 1140793983 /nfs/dbraw/zinc/79/39/83/1140793983.db2.gz TVBWOBSWKPVSCE-CVEARBPZSA-N 1 1 332.425 3.744 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634855 1141129581 /nfs/dbraw/zinc/12/95/81/1141129581.db2.gz AFDRQEPHEWTHAP-PIGZYNQJSA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634855 1141129586 /nfs/dbraw/zinc/12/95/86/1141129586.db2.gz AFDRQEPHEWTHAP-PIGZYNQJSA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269672664 1141134477 /nfs/dbraw/zinc/13/44/77/1141134477.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@@H](NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271577501 1141401144 /nfs/dbraw/zinc/40/11/44/1141401144.db2.gz BAZBIDPVUNPTMO-KFWWJZLASA-N 1 1 341.411 3.511 20 5 EHBDMO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000271656894 1141413588 /nfs/dbraw/zinc/41/35/88/1141413588.db2.gz WLIGCKAWIKSKGE-GJZGRUSLSA-N 1 1 341.411 3.889 20 5 EHBDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000283176104 1141567639 /nfs/dbraw/zinc/56/76/39/1141567639.db2.gz PVWYQNIXZLZBFX-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO CCC[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000536669013 1032098766 /nfs/dbraw/zinc/09/87/66/1032098766.db2.gz WUJKZRFUUFGGBR-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000536669013 1032098779 /nfs/dbraw/zinc/09/87/79/1032098779.db2.gz WUJKZRFUUFGGBR-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000430214645 1015020876 /nfs/dbraw/zinc/02/08/76/1015020876.db2.gz CCYJERBWFNJKAR-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000430214645 1015020887 /nfs/dbraw/zinc/02/08/87/1015020887.db2.gz CCYJERBWFNJKAR-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228996 1015127494 /nfs/dbraw/zinc/12/74/94/1015127494.db2.gz SOCLOLZJZBCBLB-OAHLLOKOSA-N 1 1 342.395 3.602 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1c1cccn1C ZINC000430235056 1015160428 /nfs/dbraw/zinc/16/04/28/1015160428.db2.gz CPEUJERIVFRWSJ-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1c1cccn1C ZINC000430235056 1015160437 /nfs/dbraw/zinc/16/04/37/1015160437.db2.gz CPEUJERIVFRWSJ-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1OC ZINC000127056608 1015209598 /nfs/dbraw/zinc/20/95/98/1015209598.db2.gz VSZSIPHVQIABER-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1OC ZINC000127056608 1015209602 /nfs/dbraw/zinc/20/96/02/1015209602.db2.gz VSZSIPHVQIABER-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC000339622313 1015397079 /nfs/dbraw/zinc/39/70/79/1015397079.db2.gz GZVIMPTZPJFTTB-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC000339622313 1015397090 /nfs/dbraw/zinc/39/70/90/1015397090.db2.gz GZVIMPTZPJFTTB-UHFFFAOYSA-N 1 1 342.370 3.537 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854381 1015778665 /nfs/dbraw/zinc/77/86/65/1015778665.db2.gz RFQIALBWLPNDKF-OAHLLOKOSA-N 1 1 341.411 3.577 20 5 EHBDMO COCC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001167205911 1016582632 /nfs/dbraw/zinc/58/26/32/1016582632.db2.gz KFIIPQYEEQNHFL-UHFFFAOYSA-N 1 1 348.830 3.939 20 5 EHBDMO C[N@@H+](CCCCCO)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000278808753 1016912228 /nfs/dbraw/zinc/91/22/28/1016912228.db2.gz GKLJXLZYSPEEKX-UHFFFAOYSA-N 1 1 325.408 3.541 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cnccc1C(C)(C)C ZINC000414505033 1016959963 /nfs/dbraw/zinc/95/99/63/1016959963.db2.gz ZFYNTWIVYLNIMF-UHFFFAOYSA-N 1 1 343.427 3.976 20 5 EHBDMO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000538278700 1032266241 /nfs/dbraw/zinc/26/62/41/1032266241.db2.gz AJTQVDQTBRXRIV-KBPBESRZSA-N 1 1 327.384 3.581 20 5 EHBDMO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000538278704 1032267335 /nfs/dbraw/zinc/26/73/35/1032267335.db2.gz AJTQVDQTBRXRIV-UONOGXRCSA-N 1 1 327.384 3.581 20 5 EHBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000449280916 1032401099 /nfs/dbraw/zinc/40/10/99/1032401099.db2.gz YIPLSXVSLUIVJF-RYUDHWBXSA-N 1 1 332.404 3.557 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccnn1C1CCCC1 ZINC000449316897 1032449895 /nfs/dbraw/zinc/44/98/95/1032449895.db2.gz QZSVWCNJJFHQDZ-UHFFFAOYSA-N 1 1 328.416 3.581 20 5 EHBDMO CCc1ncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495979 1032664389 /nfs/dbraw/zinc/66/43/89/1032664389.db2.gz FRTSOAGWFZMLTM-CQSZACIVSA-N 1 1 331.441 3.993 20 5 EHBDMO [NH3+][C@@H]1CCC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930666 1017325688 /nfs/dbraw/zinc/32/56/88/1017325688.db2.gz TXVKHLAYCHGIDX-NEPJUHHUSA-N 1 1 349.818 3.868 20 5 EHBDMO C[N@@H+](CCc1ccc(F)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083169221 1017751403 /nfs/dbraw/zinc/75/14/03/1017751403.db2.gz GWPFDRUQHDQYIY-UHFFFAOYSA-N 1 1 329.331 3.550 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597861018 1032720592 /nfs/dbraw/zinc/72/05/92/1032720592.db2.gz RHLCKHJOSGNXCB-CQSZACIVSA-N 1 1 347.459 3.568 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000091958145 1032745149 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1 339.439 3.739 20 5 EHBDMO C[C@]1(CNCc2ccccc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000397867098 1018913113 /nfs/dbraw/zinc/91/31/13/1018913113.db2.gz GOSPQKBDQRLDBQ-HXUWFJFHSA-N 1 1 339.439 3.739 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000419373611 1018951307 /nfs/dbraw/zinc/95/13/07/1018951307.db2.gz OLWWMVHRXZQMFB-MROQNXINSA-N 1 1 330.388 3.682 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCc1ccccc1OC ZINC000513452107 1019700683 /nfs/dbraw/zinc/70/06/83/1019700683.db2.gz WFVONTMQWMUDRZ-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000513486569 1019745977 /nfs/dbraw/zinc/74/59/77/1019745977.db2.gz ZQRWAQYCXTXZIM-OAHLLOKOSA-N 1 1 328.412 3.975 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280316297 1020283283 /nfs/dbraw/zinc/28/32/83/1020283283.db2.gz PZEQFBGTNMNZFL-INIZCTEOSA-N 1 1 344.358 3.587 20 5 EHBDMO C[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188367 1020545722 /nfs/dbraw/zinc/54/57/22/1020545722.db2.gz DKNFGLYDYGIMST-YQQAZPJKSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188367 1020545727 /nfs/dbraw/zinc/54/57/27/1020545727.db2.gz DKNFGLYDYGIMST-YQQAZPJKSA-N 1 1 331.460 3.898 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1O ZINC000438347717 1021313149 /nfs/dbraw/zinc/31/31/49/1021313149.db2.gz PIYUAIIPERJEMF-QGZVFWFLSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1cccc2c1CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000729479702 1021667802 /nfs/dbraw/zinc/66/78/02/1021667802.db2.gz CBWPXNFWCWSYEX-UHFFFAOYSA-N 1 1 326.396 3.730 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000510460226 1021668085 /nfs/dbraw/zinc/66/80/85/1021668085.db2.gz WIEMZZUXFZYIKD-JKWKAKRGSA-N 1 1 343.471 3.945 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000506771382 1021984890 /nfs/dbraw/zinc/98/48/90/1021984890.db2.gz DSJQZFIHRQDWHS-VURMDHGXSA-N 1 1 342.395 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCOC4)C3)o2)cc1 ZINC000449679606 1033028859 /nfs/dbraw/zinc/02/88/59/1033028859.db2.gz AJSMRDGJCLZCRK-LJQANCHMSA-N 1 1 342.395 3.857 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000441419993 1022375608 /nfs/dbraw/zinc/37/56/08/1022375608.db2.gz KYJSXNHDOIWLOC-HNNXBMFYSA-N 1 1 344.411 3.545 20 5 EHBDMO CSCCC[N@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602657150 1033057548 /nfs/dbraw/zinc/05/75/48/1033057548.db2.gz OZPIROZQUIPYRM-UHFFFAOYSA-N 1 1 339.280 3.604 20 5 EHBDMO CSCCC[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602657150 1033057558 /nfs/dbraw/zinc/05/75/58/1033057558.db2.gz OZPIROZQUIPYRM-UHFFFAOYSA-N 1 1 339.280 3.604 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184224071 1022586801 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INDGGQUCWCADKQ-KGLIPLIRSA-N 1 1 336.432 3.881 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232785 /nfs/dbraw/zinc/23/27/85/1023232785.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 1 1 345.487 3.724 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383496982 1023285135 /nfs/dbraw/zinc/28/51/35/1023285135.db2.gz XLPYTXDNYJDTMB-OAHLLOKOSA-N 1 1 329.375 3.668 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](O)C[C@@H]1c1ccccc1 ZINC000602730807 1033122272 /nfs/dbraw/zinc/12/22/72/1033122272.db2.gz IUIMUHWFAMLNII-MQLVUKKUSA-N 1 1 338.407 3.806 20 5 EHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328655 1033208226 /nfs/dbraw/zinc/20/82/26/1033208226.db2.gz OJUDZPUOKTVGOI-GOSISDBHSA-N 1 1 329.400 3.539 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185218923 1024651148 /nfs/dbraw/zinc/65/11/48/1024651148.db2.gz PXTLHDISBLRQBS-KRWDZBQOSA-N 1 1 330.384 3.590 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507901068 1024760745 /nfs/dbraw/zinc/76/07/45/1024760745.db2.gz DOBAFLPKYWJRAK-OAHLLOKOSA-N 1 1 343.402 3.613 20 5 EHBDMO C[N@@H+](CCCOc1ccc(F)cc1)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520843911 1025080370 /nfs/dbraw/zinc/08/03/70/1025080370.db2.gz VBVDSHJDKRCGSX-UHFFFAOYSA-N 1 1 348.374 3.514 20 5 EHBDMO C[C@H](CO)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000515332139 1025174176 /nfs/dbraw/zinc/17/41/76/1025174176.db2.gz RMUFPAPFPVZNOB-CQSZACIVSA-N 1 1 344.411 3.838 20 5 EHBDMO Cc1c(C[N@H+](C)Cc2ccc(Br)o2)cccc1[N+](=O)[O-] ZINC000051423654 1025192858 /nfs/dbraw/zinc/19/28/58/1025192858.db2.gz UNGJWAFQOZRARK-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1c(C[N@@H+](C)Cc2ccc(Br)o2)cccc1[N+](=O)[O-] ZINC000051423654 1025192865 /nfs/dbraw/zinc/19/28/65/1025192865.db2.gz UNGJWAFQOZRARK-UHFFFAOYSA-N 1 1 339.189 3.891 20 5 EHBDMO Cc1cc(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433140 1025459873 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326.396 3.774 20 5 EHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000339097950 1026375151 /nfs/dbraw/zinc/37/51/51/1026375151.db2.gz YAQWVQGZCJAXLB-NSHDSACASA-N 1 1 334.322 3.568 20 5 EHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000339097950 1026375159 /nfs/dbraw/zinc/37/51/59/1026375159.db2.gz YAQWVQGZCJAXLB-NSHDSACASA-N 1 1 334.322 3.568 20 5 EHBDMO O=[N+]([O-])c1ccc([O-])cc1CN[C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000339125829 1026388639 /nfs/dbraw/zinc/38/86/39/1026388639.db2.gz YEZBELUWKXEAKN-RDJZCZTQSA-N 1 1 348.786 3.574 20 5 EHBDMO COc1cccc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354946 1026510105 /nfs/dbraw/zinc/51/01/05/1026510105.db2.gz SYEYGSMTLNSUBY-HOCLYGCPSA-N 1 1 341.411 3.851 20 5 EHBDMO CC(C)O[C@@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000428344336 1026881522 /nfs/dbraw/zinc/88/15/22/1026881522.db2.gz BKCJWIYJWHYPIM-IBGZPJMESA-N 1 1 341.411 3.514 20 5 EHBDMO CC(C)O[C@@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000428344336 1026881529 /nfs/dbraw/zinc/88/15/29/1026881529.db2.gz BKCJWIYJWHYPIM-IBGZPJMESA-N 1 1 341.411 3.514 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413188175 1027234451 /nfs/dbraw/zinc/23/44/51/1027234451.db2.gz TXPJIMTWDAPQGC-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000204663883 1027287896 /nfs/dbraw/zinc/28/78/96/1027287896.db2.gz GTDWPWYXXXSXQC-GOSISDBHSA-N 1 1 328.412 3.929 20 5 EHBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000413349869 1027572900 /nfs/dbraw/zinc/57/29/00/1027572900.db2.gz UITSHQQHNUSREC-UHFFFAOYSA-N 1 1 342.237 3.644 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495057 1028089326 /nfs/dbraw/zinc/08/93/26/1028089326.db2.gz NZIJVPZOMSCUAQ-CHWSQXEVSA-N 1 1 346.818 3.891 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCC[C@H]1C ZINC000444676935 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O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@@H+](C3CCCC3)C1)CCC2 ZINC000583064228 1028714633 /nfs/dbraw/zinc/71/46/33/1028714633.db2.gz ISPNGHAGZNTJAO-HNAYVOBHSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CC[N@H+](C3CCCC3)C1)CCC2 ZINC000583064228 1028714647 /nfs/dbraw/zinc/71/46/47/1028714647.db2.gz ISPNGHAGZNTJAO-HNAYVOBHSA-N 1 1 329.444 3.579 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCCCCC1 ZINC000026341734 1028851481 /nfs/dbraw/zinc/85/14/81/1028851481.db2.gz AHFVHMZAMPBJGA-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504929040 1029073561 /nfs/dbraw/zinc/07/35/61/1029073561.db2.gz GAQNXWDHYTZGFI-OAHLLOKOSA-N 1 1 349.475 3.909 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000052158067 1029129049 /nfs/dbraw/zinc/12/90/49/1029129049.db2.gz BWJKUASILJYURE-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(-c3ccccc3)n[nH]2)c(Cl)c1 ZINC000183801028 1029532670 /nfs/dbraw/zinc/53/26/70/1029532670.db2.gz MYHBPSUHYXAWKO-UHFFFAOYSA-N 1 1 342.786 3.928 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])s2)cc1 ZINC000192480382 1029685173 /nfs/dbraw/zinc/68/51/73/1029685173.db2.gz HLUOKKYOLSUBMB-SNVBAGLBSA-N 1 1 329.385 3.719 20 5 EHBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000525123970 1029695594 /nfs/dbraw/zinc/69/55/94/1029695594.db2.gz VHEMFJXDMGARTG-AUUYWEPGSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000525123970 1029695600 /nfs/dbraw/zinc/69/56/00/1029695600.db2.gz VHEMFJXDMGARTG-AUUYWEPGSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446715753 1029769806 /nfs/dbraw/zinc/76/98/06/1029769806.db2.gz FDWDGULNQNHVQD-IBGZPJMESA-N 1 1 337.379 3.900 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(C3CC3)CC2)ccc1Br ZINC000724811079 1029845041 /nfs/dbraw/zinc/84/50/41/1029845041.db2.gz DJOHSOKQEZMSDS-UHFFFAOYSA-N 1 1 339.233 3.979 20 5 EHBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868873 1029946095 /nfs/dbraw/zinc/94/60/95/1029946095.db2.gz NZYANAJHMQPGEZ-MRXNPFEDSA-N 1 1 348.443 3.581 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000453335134 1030115739 /nfs/dbraw/zinc/11/57/39/1030115739.db2.gz CXOLTJLIXRRPRQ-RLCCDNCMSA-N 1 1 326.400 3.809 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000052510358 1030431894 /nfs/dbraw/zinc/43/18/94/1030431894.db2.gz BHCBOFPAABGNRZ-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cc(C2CC2)cc[nH+]1 ZINC000520463281 1030576372 /nfs/dbraw/zinc/57/63/72/1030576372.db2.gz ZUKFLAGLJNNELG-GFCCVEGCSA-N 1 1 340.383 3.696 20 5 EHBDMO C[NH+](C)C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776185 1030703301 /nfs/dbraw/zinc/70/33/01/1030703301.db2.gz TXLRGRAJRBHTFZ-FZMUQLTDSA-N 1 1 343.402 3.640 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243072 1030731413 /nfs/dbraw/zinc/73/14/13/1030731413.db2.gz MTEQUISHTPKSTK-HNNXBMFYSA-N 1 1 330.359 3.732 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc4ccccc4c3)C2)nc1 ZINC000237998779 1030806494 /nfs/dbraw/zinc/80/64/94/1030806494.db2.gz DYSAPZMXKCHHBR-GOSISDBHSA-N 1 1 348.406 3.829 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117187 1030977637 /nfs/dbraw/zinc/97/76/37/1030977637.db2.gz OUIHPDHDRBPAJK-ZDUSSCGKSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117187 1030977653 /nfs/dbraw/zinc/97/76/53/1030977653.db2.gz OUIHPDHDRBPAJK-ZDUSSCGKSA-N 1 1 340.358 3.600 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(F)F)CC1 ZINC000483513716 1031204639 /nfs/dbraw/zinc/20/46/39/1031204639.db2.gz FIRNDDHFIMIKDZ-UHFFFAOYSA-N 1 1 328.359 3.859 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)CCc1nccs1 ZINC000179038954 1031612386 /nfs/dbraw/zinc/61/23/86/1031612386.db2.gz VOWROPOJXUHROD-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803381 1031705165 /nfs/dbraw/zinc/70/51/65/1031705165.db2.gz FNMZTTLQLBFLBL-MLGOLLRUSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803381 1031705183 /nfs/dbraw/zinc/70/51/83/1031705183.db2.gz FNMZTTLQLBFLBL-MLGOLLRUSA-N 1 1 345.424 3.820 20 5 EHBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950665 1032037539 /nfs/dbraw/zinc/03/75/39/1032037539.db2.gz HTEWZVLQVWMNJN-SJORKVTESA-N 1 1 333.476 3.922 20 5 EHBDMO CCOc1cncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000598679505 1033380196 /nfs/dbraw/zinc/38/01/96/1033380196.db2.gz VTLNHOGLQBYOEJ-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c2ccncc21 ZINC000594596694 1033444396 /nfs/dbraw/zinc/44/43/96/1033444396.db2.gz BEDQPNFWQPHNQO-SJLPKXTDSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c2ncccc12 ZINC000594596663 1033444653 /nfs/dbraw/zinc/44/46/53/1033444653.db2.gz BAYAFLHWZJROQO-PBHICJAKSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594603457 1033448470 /nfs/dbraw/zinc/44/84/70/1033448470.db2.gz VJSZVSRQCIOUKG-WBVHZDCISA-N 1 1 326.400 3.572 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580857 1033571597 /nfs/dbraw/zinc/57/15/97/1033571597.db2.gz XCLZTCPNWBWQJB-UKRRQHHQSA-N 1 1 331.441 3.836 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(C(F)F)nc1 ZINC000595009909 1033604840 /nfs/dbraw/zinc/60/48/40/1033604840.db2.gz DYCGQXVHIILZJV-JTQLQIEISA-N 1 1 337.326 3.787 20 5 EHBDMO CCOc1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595018517 1033609042 /nfs/dbraw/zinc/60/90/42/1033609042.db2.gz QWSHESBIGADCRJ-CYBMUJFWSA-N 1 1 330.384 3.853 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@@H](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000595297390 1033720141 /nfs/dbraw/zinc/72/01/41/1033720141.db2.gz FCHMUUYWGIAZSB-INIZCTEOSA-N 1 1 329.400 3.654 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnc3ccccc3n2)C2CC2)c1 ZINC000595353188 1033778765 /nfs/dbraw/zinc/77/87/65/1033778765.db2.gz NSGULHMOTMINNM-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnc3ccccc3n2)C2CC2)c1 ZINC000595353188 1033778780 /nfs/dbraw/zinc/77/87/80/1033778780.db2.gz NSGULHMOTMINNM-UHFFFAOYSA-N 1 1 334.379 3.703 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599163641 1033780418 /nfs/dbraw/zinc/78/04/18/1033780418.db2.gz GEZCCEDGVMLISK-ZDUSSCGKSA-N 1 1 325.359 3.961 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000592998552 1033790130 /nfs/dbraw/zinc/79/01/30/1033790130.db2.gz BLHQSAMRAAXYOC-OAHLLOKOSA-N 1 1 346.408 3.780 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000592998552 1033790152 /nfs/dbraw/zinc/79/01/52/1033790152.db2.gz BLHQSAMRAAXYOC-OAHLLOKOSA-N 1 1 346.408 3.780 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000595429696 1033798811 /nfs/dbraw/zinc/79/88/11/1033798811.db2.gz TZEDJLSPMLLNFE-ZDUSSCGKSA-N 1 1 333.363 3.800 20 5 EHBDMO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489413 1033811989 /nfs/dbraw/zinc/81/19/89/1033811989.db2.gz AOOSWTLCHFVISH-DOMZBBRYSA-N 1 1 345.399 3.873 20 5 EHBDMO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595489413 1033811995 /nfs/dbraw/zinc/81/19/95/1033811995.db2.gz AOOSWTLCHFVISH-DOMZBBRYSA-N 1 1 345.399 3.873 20 5 EHBDMO O=C(CC[N@H+]1CC[C@@H]1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595705744 1033955420 /nfs/dbraw/zinc/95/54/20/1033955420.db2.gz VUBJVJSDQZMPEV-QGZVFWFLSA-N 1 1 343.358 3.510 20 5 EHBDMO COc1ccccc1[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040697 1033991855 /nfs/dbraw/zinc/99/18/55/1033991855.db2.gz KHHBTPGEDQCPMW-SFHVURJKSA-N 1 1 342.395 3.819 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595791007 1034000836 /nfs/dbraw/zinc/00/08/36/1034000836.db2.gz SJIJELZLWRGSCJ-MAUKXSAKSA-N 1 1 348.443 3.775 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596097531 1034062265 /nfs/dbraw/zinc/06/22/65/1034062265.db2.gz YSLCWDCUIXHZLA-WBVHZDCISA-N 1 1 331.460 3.676 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCOc1ccccc1F ZINC000604012562 1034136625 /nfs/dbraw/zinc/13/66/25/1034136625.db2.gz PRBKBPKZRIRVDY-UHFFFAOYSA-N 1 1 348.374 3.514 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CCC[N@@H+](CC3CC3)C2)ccc2ncccc21 ZINC000596571586 1034293222 /nfs/dbraw/zinc/29/32/22/1034293222.db2.gz XADIJVOQMCIRRA-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174578 1034379102 /nfs/dbraw/zinc/37/91/02/1034379102.db2.gz IUNWSAUQCFZRMA-XJKSGUPXSA-N 1 1 330.359 3.948 20 5 EHBDMO C[NH2+]Cc1ccccc1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000593315812 1034634238 /nfs/dbraw/zinc/63/42/38/1034634238.db2.gz FERGRDKOYKPFCD-UHFFFAOYSA-N 1 1 327.428 3.727 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](C)C1CCCCC1 ZINC000548929603 1034911604 /nfs/dbraw/zinc/91/16/04/1034911604.db2.gz APTDDDVUKPPNNC-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1cc(C[N@H+](C)CCOc2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000463471583 1035539708 /nfs/dbraw/zinc/53/97/08/1035539708.db2.gz YGIBSOMGJXYNGV-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO COc1cc(C[N@@H+](C)CCOc2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000463471583 1035539726 /nfs/dbraw/zinc/53/97/26/1035539726.db2.gz YGIBSOMGJXYNGV-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO Cc1ccc(CNc2c(F)cccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000588014198 1035682809 /nfs/dbraw/zinc/68/28/09/1035682809.db2.gz IAYRAZXIKTXTGX-UHFFFAOYSA-N 1 1 330.363 3.650 20 5 EHBDMO CC(C)(C)Oc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000443422985 1035795803 /nfs/dbraw/zinc/79/58/03/1035795803.db2.gz AIPVKCZTZVDCHD-CABCVRRESA-N 1 1 333.432 3.811 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000463951744 1035993632 /nfs/dbraw/zinc/99/36/32/1035993632.db2.gz BVQRSDNXQODSDR-HUUCEWRRSA-N 1 1 348.447 3.596 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000589185032 1036297964 /nfs/dbraw/zinc/29/79/64/1036297964.db2.gz QPQWYNXMDLEZPX-NTCAYCPXSA-N 1 1 338.411 3.521 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000535375718 1036416029 /nfs/dbraw/zinc/41/60/29/1036416029.db2.gz XAKGACSZGAXOAT-MRXNPFEDSA-N 1 1 332.787 3.902 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742950 1036599802 /nfs/dbraw/zinc/59/98/02/1036599802.db2.gz KHVSPHNMVGDLFF-OJLVUWQFSA-N 1 1 338.473 3.808 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000464681203 1036656293 /nfs/dbraw/zinc/65/62/93/1036656293.db2.gz ZNLMJFWDZZBWSE-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1CO ZINC000191179471 1036697817 /nfs/dbraw/zinc/69/78/17/1036697817.db2.gz JEGGOZVALSRULW-MLGOLLRUSA-N 1 1 332.425 3.526 20 5 EHBDMO CC(C)[N@@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180394261 1036771553 /nfs/dbraw/zinc/77/15/53/1036771553.db2.gz MVMNGRUFWJNPHU-IBGZPJMESA-N 1 1 327.428 3.614 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)n1 ZINC000541935856 1036860480 /nfs/dbraw/zinc/86/04/80/1036860480.db2.gz NAETWWQEKLWUHA-NVXWUHKLSA-N 1 1 340.427 3.854 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC000443646913 1036945184 /nfs/dbraw/zinc/94/51/84/1036945184.db2.gz KGEDJHMOYGRJGT-KRWDZBQOSA-N 1 1 342.443 3.706 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000365678140 1036968029 /nfs/dbraw/zinc/96/80/29/1036968029.db2.gz ZVIPPTOPMHGJMQ-HUUCEWRRSA-N 1 1 328.416 3.577 20 5 EHBDMO CC(C)[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506938 1037078303 /nfs/dbraw/zinc/07/83/03/1037078303.db2.gz QAXZXMFNNNCXKO-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506938 1037078324 /nfs/dbraw/zinc/07/83/24/1037078324.db2.gz QAXZXMFNNNCXKO-UHFFFAOYSA-N 1 1 339.867 3.800 20 5 EHBDMO C[N@@H+](CCNCc1ccc([N+](=O)[O-])c(Cl)c1)C1CCCCC1 ZINC000761523093 1037089567 /nfs/dbraw/zinc/08/95/67/1037089567.db2.gz RSZJOBHIQNNOQH-UHFFFAOYSA-N 1 1 325.840 3.602 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C2CCC2)C1 ZINC000591061789 1037222284 /nfs/dbraw/zinc/22/22/84/1037222284.db2.gz IJRZIFUAFMCBLT-SWLSCSKDSA-N 1 1 342.399 3.828 20 5 EHBDMO Cc1ccn2cc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000278805560 1037228763 /nfs/dbraw/zinc/22/87/63/1037228763.db2.gz RNHDIJNCTHMPAA-GOSISDBHSA-N 1 1 336.395 3.718 20 5 EHBDMO C[C@H](O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867686 1037274153 /nfs/dbraw/zinc/27/41/53/1037274153.db2.gz XWODQLCQXLMUMB-GXTWGEPZSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2)c1)[NH+]1CCOCC1 ZINC000540297783 1037777929 /nfs/dbraw/zinc/77/79/29/1037777929.db2.gz QBFINBNAEGWUAC-AWEZNQCLSA-N 1 1 327.384 3.732 20 5 EHBDMO COc1cc(C[NH2+]C2(c3ccccc3F)CCC2)ccc1[N+](=O)[O-] ZINC000592144235 1037861617 /nfs/dbraw/zinc/86/16/17/1037861617.db2.gz FRCXQBHATGDJBD-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO Cc1c([C@@H](C)[NH2+][C@H](CCO)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000592402861 1037945088 /nfs/dbraw/zinc/94/50/88/1037945088.db2.gz LCOIQLXINFNTDA-CXAGYDPISA-N 1 1 332.375 3.817 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000181221561 1038363688 /nfs/dbraw/zinc/36/36/88/1038363688.db2.gz IJKPXZPNEPKPAR-RDTXWAMCSA-N 1 1 344.386 3.991 20 5 EHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC001167735155 1038444371 /nfs/dbraw/zinc/44/43/71/1038444371.db2.gz STRPKPGKSOEWCM-IYBDPMFKSA-N 1 1 331.460 3.537 20 5 EHBDMO CO[C@H](C)C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000538720398 1038488946 /nfs/dbraw/zinc/48/89/46/1038488946.db2.gz WWGKFRIQSYCQIY-CYBMUJFWSA-N 1 1 349.456 3.964 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788565 1038611079 /nfs/dbraw/zinc/61/10/79/1038611079.db2.gz XRQODSBVBBMGEA-NEPJUHHUSA-N 1 1 343.349 3.961 20 5 EHBDMO CCN(CC)[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000236850060 1039037589 /nfs/dbraw/zinc/03/75/89/1039037589.db2.gz BGBNBSNFEKEVOL-IBGZPJMESA-N 1 1 327.428 3.768 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000015301014 1039087780 /nfs/dbraw/zinc/08/77/80/1039087780.db2.gz YLNQRWJZTCKFHN-KRWDZBQOSA-N 1 1 340.379 3.703 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC1CCC1 ZINC000478004935 1039131068 /nfs/dbraw/zinc/13/10/68/1039131068.db2.gz UEETVYMKUQUGST-HNNXBMFYSA-N 1 1 328.416 3.655 20 5 EHBDMO Cc1cc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)cc([N+](=O)[O-])c1 ZINC000478031648 1039154832 /nfs/dbraw/zinc/15/48/32/1039154832.db2.gz RVVRZQINKZZECX-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000478049293 1039168951 /nfs/dbraw/zinc/16/89/51/1039168951.db2.gz WFZNUDOBLIHASS-QGZVFWFLSA-N 1 1 348.422 3.520 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177921 1039700417 /nfs/dbraw/zinc/70/04/17/1039700417.db2.gz UFNRFKHHGYNPEY-MRXNPFEDSA-N 1 1 342.395 3.602 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340924 1039705684 /nfs/dbraw/zinc/70/56/84/1039705684.db2.gz AXNCEQHAGFIKLE-SUMWQHHRSA-N 1 1 342.395 3.916 20 5 EHBDMO CN(C)c1cccnc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417354059 1039713257 /nfs/dbraw/zinc/71/32/57/1039713257.db2.gz YTISSFUBSZCVLB-QGZVFWFLSA-N 1 1 340.427 3.613 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000486390274 1040103287 /nfs/dbraw/zinc/10/32/87/1040103287.db2.gz VASNSTUMXLSMFL-NSHDSACASA-N 1 1 342.237 3.501 20 5 EHBDMO COc1cc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000192952395 1040159036 /nfs/dbraw/zinc/15/90/36/1040159036.db2.gz LEUQFGFEZOVMIV-INIZCTEOSA-N 1 1 341.411 3.537 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCc1ccc3c(c1)CCO3)C2 ZINC000555418513 1040553812 /nfs/dbraw/zinc/55/38/12/1040553812.db2.gz GAVDLQPSMYLVDU-UHFFFAOYSA-N 1 1 338.407 3.521 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490822363 1040751258 /nfs/dbraw/zinc/75/12/58/1040751258.db2.gz QFSCTGLZLVKFGI-UHFFFAOYSA-N 1 1 325.412 3.825 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC000570894469 1040966047 /nfs/dbraw/zinc/96/60/47/1040966047.db2.gz XFFCQUIRPAOKGV-HACGYAERSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCC[C@@H]12 ZINC000570894469 1040966068 /nfs/dbraw/zinc/96/60/68/1040966068.db2.gz XFFCQUIRPAOKGV-HACGYAERSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000511745224 1041548439 /nfs/dbraw/zinc/54/84/39/1041548439.db2.gz ZCDPCMKDRABFBB-NSHDSACASA-N 1 1 331.338 3.900 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2cn3ccsc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000279146087 1043449595 /nfs/dbraw/zinc/44/95/95/1043449595.db2.gz SIIDOYCMBHNFLG-OAHLLOKOSA-N 1 1 342.424 3.816 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000301435199 1127889893 /nfs/dbraw/zinc/88/98/93/1127889893.db2.gz KDMKXLRTHHVLHO-KRWDZBQOSA-N 1 1 325.412 3.553 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ncccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301443889 1127926447 /nfs/dbraw/zinc/92/64/47/1127926447.db2.gz VAJAUWOWVMEJHE-SWLSCSKDSA-N 1 1 332.429 3.546 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301572543 1128497617 /nfs/dbraw/zinc/49/76/17/1128497617.db2.gz YSJKTOHZIMEZHZ-NVXWUHKLSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301572542 1128499263 /nfs/dbraw/zinc/49/92/63/1128499263.db2.gz YSJKTOHZIMEZHZ-DOTOQJQBSA-N 1 1 340.427 3.763 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631338 1128528764 /nfs/dbraw/zinc/52/87/64/1128528764.db2.gz PQIBGQQOGIZAOX-AWEZNQCLSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]CCN(C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631338 1128528766 /nfs/dbraw/zinc/52/87/66/1128528766.db2.gz PQIBGQQOGIZAOX-AWEZNQCLSA-N 1 1 335.448 3.519 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488988973 1128917249 /nfs/dbraw/zinc/91/72/49/1128917249.db2.gz WEDXLGORCGBLBB-KGLIPLIRSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488988973 1128917250 /nfs/dbraw/zinc/91/72/50/1128917250.db2.gz WEDXLGORCGBLBB-KGLIPLIRSA-N 1 1 345.374 3.733 20 5 EHBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000494266758 1120524601 /nfs/dbraw/zinc/52/46/01/1120524601.db2.gz AQWJPCQALMSSAV-QINSGFPZSA-N 1 1 339.395 3.569 20 5 EHBDMO C/C(=C/c1ccccc1)C[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000494266758 1120524604 /nfs/dbraw/zinc/52/46/04/1120524604.db2.gz AQWJPCQALMSSAV-QINSGFPZSA-N 1 1 339.395 3.569 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCC(C)C)CC1 ZINC000193106597 1120916705 /nfs/dbraw/zinc/91/67/05/1120916705.db2.gz LSMYCUXEEHDKMZ-UHFFFAOYSA-N 1 1 336.432 3.631 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnn(CC3CCC3)c2)c(Cl)c1 ZINC000922003867 1129017941 /nfs/dbraw/zinc/01/79/41/1129017941.db2.gz KNCPSOUXVHZNFX-UHFFFAOYSA-N 1 1 334.807 3.535 20 5 EHBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154170975 1122343725 /nfs/dbraw/zinc/34/37/25/1122343725.db2.gz HEUKEVXIPHZVNU-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1ccc(F)cc1Cl)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154170975 1122343729 /nfs/dbraw/zinc/34/37/29/1122343729.db2.gz HEUKEVXIPHZVNU-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H]3C3CCCCC3)c2c1 ZINC000917478188 1122613361 /nfs/dbraw/zinc/61/33/61/1122613361.db2.gz LHFDFGWSUPYAPC-KRWDZBQOSA-N 1 1 328.416 3.947 20 5 EHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154427556 1122624460 /nfs/dbraw/zinc/62/44/60/1122624460.db2.gz ZWPJTEUBXXIFQJ-ZMYBRWDISA-N 1 1 326.396 3.506 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000556968291 1123244717 /nfs/dbraw/zinc/24/47/17/1123244717.db2.gz YMYIGSIJUWXSHC-DKWYEQIVSA-N 1 1 328.412 3.642 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000556968291 1123244720 /nfs/dbraw/zinc/24/47/20/1123244720.db2.gz YMYIGSIJUWXSHC-DKWYEQIVSA-N 1 1 328.412 3.642 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000609545274 1123608291 /nfs/dbraw/zinc/60/82/91/1123608291.db2.gz KXAMFFXYCHGJMJ-CQSZACIVSA-N 1 1 348.447 3.617 20 5 EHBDMO COCC[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704821 1123647604 /nfs/dbraw/zinc/64/76/04/1123647604.db2.gz OWPHHUDKCMFZEB-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO COCC[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704821 1123647608 /nfs/dbraw/zinc/64/76/08/1123647608.db2.gz OWPHHUDKCMFZEB-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO COc1cc(C)c([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000179622943 1123809737 /nfs/dbraw/zinc/80/97/37/1123809737.db2.gz JGLZOEJBQIBSBA-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncccc1C(F)(F)F ZINC000619785410 1125403969 /nfs/dbraw/zinc/40/39/69/1125403969.db2.gz ICVHMKBAMSKWBW-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1cccc(F)c1[N+](=O)[O-] ZINC000301860638 1129226198 /nfs/dbraw/zinc/22/61/98/1129226198.db2.gz CEZUCYITICJFCC-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(F)cc1 ZINC000301880077 1129252910 /nfs/dbraw/zinc/25/29/10/1129252910.db2.gz ZPLFHHVYMVASKC-SJORKVTESA-N 1 1 333.338 3.730 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CO)c1cccc(Cl)c1F ZINC000466379722 1129410300 /nfs/dbraw/zinc/41/03/00/1129410300.db2.gz FRJRANMYEBUJFB-HNNXBMFYSA-N 1 1 338.766 3.519 20 5 EHBDMO Cc1nn(C)c(Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c1[N+](=O)[O-] ZINC000301986043 1129470934 /nfs/dbraw/zinc/47/09/34/1129470934.db2.gz JVGQTNLMHQHSLD-ZDUSSCGKSA-N 1 1 343.431 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@H]4C3)s2)cc1 ZINC000543413225 1129473392 /nfs/dbraw/zinc/47/33/92/1129473392.db2.gz ZUKMGJDZOAPXOS-RRQGHBQHSA-N 1 1 344.436 3.526 20 5 EHBDMO O=[N+]([O-])c1cccc2c(N[C@H]3CC[N@@H+](Cc4ccccc4)C3)ccnc21 ZINC000389197214 1129561635 /nfs/dbraw/zinc/56/16/35/1129561635.db2.gz QIKPNDPQLXWVGY-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000922538673 1129565995 /nfs/dbraw/zinc/56/59/95/1129565995.db2.gz VGJWCXKWUPSEQX-ABAIWWIYSA-N 1 1 333.413 3.754 20 5 EHBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482609 1129590370 /nfs/dbraw/zinc/59/03/70/1129590370.db2.gz IJKAJLKDYVRGLE-KBPBESRZSA-N 1 1 330.384 3.590 20 5 EHBDMO Cn1cccc1C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093584555 1129595294 /nfs/dbraw/zinc/59/52/94/1129595294.db2.gz LAMFFAKGUCOUTR-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093584555 1129595297 /nfs/dbraw/zinc/59/52/97/1129595297.db2.gz LAMFFAKGUCOUTR-UHFFFAOYSA-N 1 1 325.368 3.825 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCCc3c2cnn3C)cc1[N+](=O)[O-] ZINC000093864065 1129605727 /nfs/dbraw/zinc/60/57/27/1129605727.db2.gz KOILOZZKVWQDRX-QGZVFWFLSA-N 1 1 342.443 3.961 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429033016 1129714374 /nfs/dbraw/zinc/71/43/74/1129714374.db2.gz YZWPIRXXCCQZSJ-FVQSIRDASA-N 1 1 331.460 3.626 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1Nc1cccc(CC[N@H+](C)C2CC2)c1 ZINC000302005383 1129763049 /nfs/dbraw/zinc/76/30/49/1129763049.db2.gz UMYGEOXYRYHZHV-UHFFFAOYSA-N 1 1 326.400 3.679 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1Cl ZINC000302035780 1129764572 /nfs/dbraw/zinc/76/45/72/1129764572.db2.gz UQLGDNNLCQVDQC-GFCCVEGCSA-N 1 1 334.807 3.576 20 5 EHBDMO CC(C)[C@@]1(CO)CC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC001117680571 1129790684 /nfs/dbraw/zinc/79/06/84/1129790684.db2.gz JCYSKWNVAFSPAV-HNNXBMFYSA-N 1 1 347.242 3.742 20 5 EHBDMO CC(C)[C@@]1(CO)CC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC001117680571 1129790688 /nfs/dbraw/zinc/79/06/88/1129790688.db2.gz JCYSKWNVAFSPAV-HNNXBMFYSA-N 1 1 347.242 3.742 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000303126062 1129818732 /nfs/dbraw/zinc/81/87/32/1129818732.db2.gz NFPLXSYQWGJNCI-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cc(C)c(OC)c(C)c1 ZINC000303126062 1129818737 /nfs/dbraw/zinc/81/87/37/1129818737.db2.gz NFPLXSYQWGJNCI-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000246055884 1130339179 /nfs/dbraw/zinc/33/91/79/1130339179.db2.gz XWJJRVJVCAPJGK-FRRDWIJNSA-N 1 1 330.388 3.684 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107245 1130345569 /nfs/dbraw/zinc/34/55/69/1130345569.db2.gz DOGKNZKQZLWAKG-DVOMOZLQSA-N 1 1 342.399 3.798 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H]2c2cccc3ccccc32)c1 ZINC000174833009 1130387191 /nfs/dbraw/zinc/38/71/91/1130387191.db2.gz DUOMBLPKKHZNSN-IBGZPJMESA-N 1 1 336.395 3.782 20 5 EHBDMO CCOC(=O)CC[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532341 1130390900 /nfs/dbraw/zinc/39/09/00/1130390900.db2.gz CNUYOTNLQMSFMT-HUUCEWRRSA-N 1 1 334.416 3.711 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237609 1131465683 /nfs/dbraw/zinc/46/56/83/1131465683.db2.gz ANAAIQWZGNLNFJ-HNNXBMFYSA-N 1 1 343.431 3.569 20 5 EHBDMO CC(C)OCCC[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000740858393 1131549891 /nfs/dbraw/zinc/54/98/91/1131549891.db2.gz WWYXPRPMLHPGRZ-UHFFFAOYSA-N 1 1 339.417 3.576 20 5 EHBDMO CC(C)OCCC[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000740858393 1131549895 /nfs/dbraw/zinc/54/98/95/1131549895.db2.gz WWYXPRPMLHPGRZ-UHFFFAOYSA-N 1 1 339.417 3.576 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+](C1CCC1)C1CCOCC1)CC2 ZINC001172914071 1131903226 /nfs/dbraw/zinc/90/32/26/1131903226.db2.gz YUEKXQNUXRVOMN-SFHVURJKSA-N 1 1 344.455 3.876 20 5 EHBDMO C[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922644 1131906969 /nfs/dbraw/zinc/90/69/69/1131906969.db2.gz ZWOMGAINXXJFRZ-BBRMVZONSA-N 1 1 348.443 3.504 20 5 EHBDMO C[N@@H+](Cc1cccc(O)c1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910429 1131916126 /nfs/dbraw/zinc/91/61/26/1131916126.db2.gz ZPKCJBFYEUZENQ-QGZVFWFLSA-N 1 1 326.396 3.680 20 5 EHBDMO C[N@@H+](CCOc1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911055 1131918194 /nfs/dbraw/zinc/91/81/94/1131918194.db2.gz QUTATJCOBUZRAS-SFHVURJKSA-N 1 1 340.423 3.853 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC3(CCCC3)C2)c1F ZINC001173188471 1131993803 /nfs/dbraw/zinc/99/38/03/1131993803.db2.gz FOUJUQWVBKJNIS-CYBMUJFWSA-N 1 1 336.407 3.940 20 5 EHBDMO COc1ccc2c(c1)CC[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224434 1132006008 /nfs/dbraw/zinc/00/60/08/1132006008.db2.gz FTZBDHPIQANQQO-AWEZNQCLSA-N 1 1 326.396 3.593 20 5 EHBDMO C[N@@H+]1CCCC[C@@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745081886 1132195575 /nfs/dbraw/zinc/19/55/75/1132195575.db2.gz LLUISQBMGZNVIH-HXUWFJFHSA-N 1 1 334.419 3.916 20 5 EHBDMO C[N@H+]1CCCC[C@@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745081886 1132195579 /nfs/dbraw/zinc/19/55/79/1132195579.db2.gz LLUISQBMGZNVIH-HXUWFJFHSA-N 1 1 334.419 3.916 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](CCc2ccccc2)C2CC2)c1 ZINC000746118816 1132376847 /nfs/dbraw/zinc/37/68/47/1132376847.db2.gz FDBGAHVYWWUGGK-UHFFFAOYSA-N 1 1 326.396 3.681 20 5 EHBDMO CCC[N@H+]1CCc2c(N)sc(Nc3ccc([N+](=O)[O-])cc3)c2C1 ZINC001174477287 1132381012 /nfs/dbraw/zinc/38/10/12/1132381012.db2.gz JBRJZBSBEOKXSL-UHFFFAOYSA-N 1 1 332.429 3.750 20 5 EHBDMO CCCCCC[C@](CC)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)C(=O)OCC ZINC001169006294 1132630155 /nfs/dbraw/zinc/63/01/55/1132630155.db2.gz GQLAKJPMLXMJQU-RYRKJORJSA-N 1 1 342.480 3.704 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035324 1132636777 /nfs/dbraw/zinc/63/67/77/1132636777.db2.gz KGZRHNQMIXRWNC-NHYWBVRUSA-N 1 1 328.334 3.509 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038403 1132638238 /nfs/dbraw/zinc/63/82/38/1132638238.db2.gz YLFGDRTXIUVSHS-XPKDYRNWSA-N 1 1 342.361 3.940 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025937 1132640400 /nfs/dbraw/zinc/64/04/00/1132640400.db2.gz KCLKROIDROIISD-INWMFGNUSA-N 1 1 342.361 3.940 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@H](C3CCC3)C(F)(F)F)ccc([N+](=O)[O-])c2C1 ZINC001169287589 1132717760 /nfs/dbraw/zinc/71/77/60/1132717760.db2.gz LERZYSQUAVTYLD-OAHLLOKOSA-N 1 1 343.349 3.726 20 5 EHBDMO C[N@H+]1CCc2c(N[C@H](C3CCC3)C(F)(F)F)ccc([N+](=O)[O-])c2C1 ZINC001169287589 1132717765 /nfs/dbraw/zinc/71/77/65/1132717765.db2.gz LERZYSQUAVTYLD-OAHLLOKOSA-N 1 1 343.349 3.726 20 5 EHBDMO C[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539514 1132781337 /nfs/dbraw/zinc/78/13/37/1132781337.db2.gz OLJXNAQUIOADKG-YJBOKZPZSA-N 1 1 332.444 3.921 20 5 EHBDMO O=[N+]([O-])/C=C/c1ccc(Nc2ccc(C[NH+]3CCOCC3)cc2)cc1 ZINC001175902584 1132794080 /nfs/dbraw/zinc/79/40/80/1132794080.db2.gz QAOVAXWRJFLBQO-MDZDMXLPSA-N 1 1 339.395 3.510 20 5 EHBDMO COCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)c(C)c1 ZINC001176202827 1132870944 /nfs/dbraw/zinc/87/09/44/1132870944.db2.gz PNLZGWFQMGOCEA-UHFFFAOYSA-N 1 1 342.439 3.903 20 5 EHBDMO Cc1c(C[N@H+]2CCN(c3ccccc3F)C[C@H]2C)cccc1[N+](=O)[O-] ZINC001169927330 1132905649 /nfs/dbraw/zinc/90/56/49/1132905649.db2.gz FFRZYGNSOSGIOH-CQSZACIVSA-N 1 1 343.402 3.753 20 5 EHBDMO Cc1c(C[N@@H+]2CCN(c3ccccc3F)C[C@H]2C)cccc1[N+](=O)[O-] ZINC001169927330 1132905653 /nfs/dbraw/zinc/90/56/53/1132905653.db2.gz FFRZYGNSOSGIOH-CQSZACIVSA-N 1 1 343.402 3.753 20 5 EHBDMO CC1(C)C[NH+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC(C)(C)C1 ZINC000767515091 1133011608 /nfs/dbraw/zinc/01/16/08/1133011608.db2.gz REIGIYAYQJDMOL-UHFFFAOYSA-N 1 1 343.431 3.569 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765743 1133050222 /nfs/dbraw/zinc/05/02/22/1133050222.db2.gz RWZYZTWFGXRRHN-MRXNPFEDSA-N 1 1 343.431 3.856 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774519271 1133703119 /nfs/dbraw/zinc/70/31/19/1133703119.db2.gz WLRZXSHHTDXFCL-ZFWWWQNUSA-N 1 1 329.375 3.981 20 5 EHBDMO COc1c(O)ccc(C[NH+]2CC([C@H]3CCC[C@@H](C)C3)C2)c1[N+](=O)[O-] ZINC001183446436 1133807018 /nfs/dbraw/zinc/80/70/18/1133807018.db2.gz ZSCLUKOEYBCVIR-OLZOCXBDSA-N 1 1 334.416 3.567 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774841944 1134051771 /nfs/dbraw/zinc/05/17/71/1134051771.db2.gz ZXIXVYLXTALZDV-UHFFFAOYSA-N 1 1 343.383 3.958 20 5 EHBDMO C[C@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC001185775485 1134131568 /nfs/dbraw/zinc/13/15/68/1134131568.db2.gz QERDDIRMVBMERO-GXSJLCMTSA-N 1 1 329.322 3.651 20 5 EHBDMO CCC[N@@H+](CC)C[C@H](C)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC001186632992 1134240294 /nfs/dbraw/zinc/24/02/94/1134240294.db2.gz LISRYAMKOWWYIP-NSHDSACASA-N 1 1 344.253 3.890 20 5 EHBDMO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1 ZINC001170305811 1134739611 /nfs/dbraw/zinc/73/96/11/1134739611.db2.gz QERXGBVDCCXFGI-ABAIWWIYSA-N 1 1 328.359 3.702 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335136 1134752703 /nfs/dbraw/zinc/75/27/03/1134752703.db2.gz LQJLLCNQEZMEKT-ABAIWWIYSA-N 1 1 346.349 3.604 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC(F)(F)[C@@H](F)C2)c([N+](=O)[O-])c1 ZINC001170335136 1134752706 /nfs/dbraw/zinc/75/27/06/1134752706.db2.gz LQJLLCNQEZMEKT-ABAIWWIYSA-N 1 1 346.349 3.604 20 5 EHBDMO Cc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n(C)n1 ZINC000793563604 1134958774 /nfs/dbraw/zinc/95/87/74/1134958774.db2.gz DFAREAGTIPALTE-JTQLQIEISA-N 1 1 342.321 3.506 20 5 EHBDMO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424186 1135428091 /nfs/dbraw/zinc/42/80/91/1135428091.db2.gz HXMKKWKEOXIZGJ-NXHRZFHOSA-N 1 1 332.444 3.776 20 5 EHBDMO CC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423188 1135551119 /nfs/dbraw/zinc/55/11/19/1135551119.db2.gz CKXRLBMWKZJGNO-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO CC[N@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423188 1135551126 /nfs/dbraw/zinc/55/11/26/1135551126.db2.gz CKXRLBMWKZJGNO-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO Cc1ccc(N2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000747524237 1135717435 /nfs/dbraw/zinc/71/74/35/1135717435.db2.gz GNCIZGVFPQDUGN-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000747524237 1135717439 /nfs/dbraw/zinc/71/74/39/1135717439.db2.gz GNCIZGVFPQDUGN-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C2CCCC2)C1 ZINC001198707221 1135851733 /nfs/dbraw/zinc/85/17/33/1135851733.db2.gz SRNCGIFDTBMSOU-ZBFHGGJFSA-N 1 1 345.443 3.824 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275757 1136129944 /nfs/dbraw/zinc/12/99/44/1136129944.db2.gz HPFAIAFKYMBXLO-IBGZPJMESA-N 1 1 328.412 3.583 20 5 EHBDMO Cc1[nH+]ccn1-c1ncccc1CNc1cc(C)c([N+](=O)[O-])cc1F ZINC000812462420 1136211983 /nfs/dbraw/zinc/21/19/83/1136211983.db2.gz URPKMUJKBMMWKK-UHFFFAOYSA-N 1 1 341.346 3.544 20 5 EHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851222 1136261333 /nfs/dbraw/zinc/26/13/33/1136261333.db2.gz QOSAXEJOFLIJFB-KXBFYZLASA-N 1 1 328.412 3.847 20 5 EHBDMO C[C@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1ccccc1[N+](=O)[O-] ZINC000813876800 1136370968 /nfs/dbraw/zinc/37/09/68/1136370968.db2.gz YMQPECYPELYEEI-JMPLFQLZSA-N 1 1 348.424 3.580 20 5 EHBDMO Cc1noc(C[NH+]2CCC(CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000851714441 1136401291 /nfs/dbraw/zinc/40/12/91/1136401291.db2.gz RHIATWYFMBNGNY-UHFFFAOYSA-N 1 1 329.400 3.736 20 5 EHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000852066242 1136430813 /nfs/dbraw/zinc/43/08/13/1136430813.db2.gz MXBDBMKSLIXGSA-ACJLOTCBSA-N 1 1 332.375 3.678 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+](C1CC1)C1(CO)CCC1 ZINC000852159981 1136437961 /nfs/dbraw/zinc/43/79/61/1136437961.db2.gz VYEAIWZJVABWFW-UHFFFAOYSA-N 1 1 345.226 3.781 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccccc3)CC2)cc1 ZINC000776582454 1136442340 /nfs/dbraw/zinc/44/23/40/1136442340.db2.gz UQSAUXLICLMWSP-PXNSSMCTSA-N 1 1 340.423 3.898 20 5 EHBDMO CCC[N@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580682 1136444927 /nfs/dbraw/zinc/44/49/27/1136444927.db2.gz YXEQQHWIAUNLAR-SFHVURJKSA-N 1 1 332.375 3.680 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccsc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000852310939 1136447373 /nfs/dbraw/zinc/44/73/73/1136447373.db2.gz BNWJBOBNIGQLQI-INIZCTEOSA-N 1 1 334.441 3.990 20 5 EHBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640857 1136487576 /nfs/dbraw/zinc/48/75/76/1136487576.db2.gz VCSRRZJLDAJTLW-AZUAARDMSA-N 1 1 340.423 3.680 20 5 EHBDMO CCc1ccc([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640858 1136487625 /nfs/dbraw/zinc/48/76/25/1136487625.db2.gz VCSRRZJLDAJTLW-ICSRJNTNSA-N 1 1 340.423 3.680 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000818180152 1136863529 /nfs/dbraw/zinc/86/35/29/1136863529.db2.gz UBJWKJLDMSNMGW-LBPRGKRZSA-N 1 1 348.374 3.876 20 5 EHBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738636 1137075946 /nfs/dbraw/zinc/07/59/46/1137075946.db2.gz CGGKGMVJLWTJDV-GDBMZVCRSA-N 1 1 340.379 3.532 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000862541563 1137149266 /nfs/dbraw/zinc/14/92/66/1137149266.db2.gz WIKLBYKXPVPKCK-CYBMUJFWSA-N 1 1 332.787 3.943 20 5 EHBDMO COC[C@@]1(CO)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000825158616 1137168365 /nfs/dbraw/zinc/16/83/65/1137168365.db2.gz SJFWREVGVCQZDS-QFIPXVFZSA-N 1 1 335.447 3.824 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC4(CC4(F)F)CC3)c2)cc1 ZINC000844730692 1137250834 /nfs/dbraw/zinc/25/08/34/1137250834.db2.gz ZBKCZLRYWQQEJB-UHFFFAOYSA-N 1 1 348.353 3.537 20 5 EHBDMO CCc1nc(C(C)C)ccc1C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000339077121 1137384489 /nfs/dbraw/zinc/38/44/89/1137384489.db2.gz MFOZMLOKPGBONO-UHFFFAOYSA-N 1 1 340.427 3.629 20 5 EHBDMO CCc1nc(C(C)C)ccc1C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000339077121 1137384492 /nfs/dbraw/zinc/38/44/92/1137384492.db2.gz MFOZMLOKPGBONO-UHFFFAOYSA-N 1 1 340.427 3.629 20 5 EHBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ccco1 ZINC001147095661 1137400154 /nfs/dbraw/zinc/40/01/54/1137400154.db2.gz MFAZMSQKYQCKLF-UHFFFAOYSA-N 1 1 347.374 3.536 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@@H](C)OC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001171636202 1137504139 /nfs/dbraw/zinc/50/41/39/1137504139.db2.gz MALWIOVWWAAQJK-CQSZACIVSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@@H](C)OC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001171636202 1137504140 /nfs/dbraw/zinc/50/41/40/1137504140.db2.gz MALWIOVWWAAQJK-CQSZACIVSA-N 1 1 334.416 3.527 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(C2CC2)CC1 ZINC000872018664 1137564964 /nfs/dbraw/zinc/56/49/64/1137564964.db2.gz OGQFIDCFFDMDCM-GFCCVEGCSA-N 1 1 335.473 3.594 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])ccc1OC ZINC000872036387 1137566792 /nfs/dbraw/zinc/56/67/92/1137566792.db2.gz UTGMVCVTSAYYBU-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872039956 1137567142 /nfs/dbraw/zinc/56/71/42/1137567142.db2.gz WVDWBVCZCYYJPO-XJKSGUPXSA-N 1 1 332.375 3.898 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CCO)c1ccco1 ZINC000872062534 1137569023 /nfs/dbraw/zinc/56/90/23/1137569023.db2.gz IDMZOFCWWIKYSX-FZMZJTMJSA-N 1 1 336.413 3.684 20 5 EHBDMO CCn1cc([C@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872078609 1137570219 /nfs/dbraw/zinc/57/02/19/1137570219.db2.gz RMAZQGBEFVLKSS-RYUDHWBXSA-N 1 1 334.445 3.945 20 5 EHBDMO CSC1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000877663810 1137684863 /nfs/dbraw/zinc/68/48/63/1137684863.db2.gz ZMFDRAXORRYYLE-UHFFFAOYSA-N 1 1 345.262 3.685 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000877672557 1137685111 /nfs/dbraw/zinc/68/51/11/1137685111.db2.gz HGFVZQWDTFWLSU-MAUKXSAKSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000877672557 1137685112 /nfs/dbraw/zinc/68/51/12/1137685112.db2.gz HGFVZQWDTFWLSU-MAUKXSAKSA-N 1 1 346.814 3.946 20 5 EHBDMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000877835863 1137692899 /nfs/dbraw/zinc/69/28/99/1137692899.db2.gz YLCJAFORLBXBSI-CYBMUJFWSA-N 1 1 346.452 3.916 20 5 EHBDMO CC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CCC1 ZINC000878116053 1137703146 /nfs/dbraw/zinc/70/31/46/1137703146.db2.gz JDJLRHCQRUCUID-UHFFFAOYSA-N 1 1 336.779 3.673 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878406064 1137714531 /nfs/dbraw/zinc/71/45/31/1137714531.db2.gz YFSPLCRPBKMDNU-GFCCVEGCSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H](C3CCC3)C2)o1 ZINC000878994659 1137734545 /nfs/dbraw/zinc/73/45/45/1137734545.db2.gz XBLPMTXCKMZSDF-CQSZACIVSA-N 1 1 342.399 3.657 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879528879 1137749922 /nfs/dbraw/zinc/74/99/22/1137749922.db2.gz DZNLDTQDOFLOIG-AEGPPILISA-N 1 1 340.383 3.604 20 5 EHBDMO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3[C@@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681207 1137754984 /nfs/dbraw/zinc/75/49/84/1137754984.db2.gz MLLAQDDASMJZCY-PRTUASRFSA-N 1 1 342.399 3.758 20 5 EHBDMO COc1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000883329949 1137855425 /nfs/dbraw/zinc/85/54/25/1137855425.db2.gz UWMUEVKAWQXCPC-MRXNPFEDSA-N 1 1 346.358 3.746 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000332323342 1137939908 /nfs/dbraw/zinc/93/99/08/1137939908.db2.gz NYZKVZSQMMVONP-HUUCEWRRSA-N 1 1 328.416 3.577 20 5 EHBDMO Cc1cnc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)s1 ZINC000332476210 1137944982 /nfs/dbraw/zinc/94/49/82/1137944982.db2.gz WTDGOMFGJADOFX-AWEZNQCLSA-N 1 1 346.456 3.551 20 5 EHBDMO Cc1c(NC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000045960117 1138041340 /nfs/dbraw/zinc/04/13/40/1138041340.db2.gz FYJRAFOHKAXQOD-CQSZACIVSA-N 1 1 348.447 3.537 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122416485 1138258095 /nfs/dbraw/zinc/25/80/95/1138258095.db2.gz KOEMNPQDFRSINL-GFCCVEGCSA-N 1 1 345.355 3.671 20 5 EHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000337191192 1138490673 /nfs/dbraw/zinc/49/06/73/1138490673.db2.gz WZORCJIHBQRNQW-UHFFFAOYSA-N 1 1 347.440 3.896 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000187769667 1140270390 /nfs/dbraw/zinc/27/03/90/1140270390.db2.gz STHCQQPZNJQXQX-RHSMWYFYSA-N 1 1 347.459 3.521 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684237 1141135134 /nfs/dbraw/zinc/13/51/34/1141135134.db2.gz SHZCKIMIUIZJOO-MSOLQXFVSA-N 1 1 330.359 3.604 20 5 EHBDMO CO[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339139375 1141507762 /nfs/dbraw/zinc/50/77/62/1141507762.db2.gz DKRXAXFAEAVDRC-AWEZNQCLSA-N 1 1 332.322 3.615 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339139375 1141507766 /nfs/dbraw/zinc/50/77/66/1141507766.db2.gz DKRXAXFAEAVDRC-AWEZNQCLSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526349 1141545283 /nfs/dbraw/zinc/54/52/83/1141545283.db2.gz UTVBSTPPPOPEMM-SFHVURJKSA-N 1 1 339.395 3.679 20 5 EHBDMO C[C@H](c1ccco1)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000283371419 1141611429 /nfs/dbraw/zinc/61/14/29/1141611429.db2.gz SJDKNNVGLIHXBB-CYBMUJFWSA-N 1 1 343.383 3.742 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])cn1 ZINC000052245059 214124210 /nfs/dbraw/zinc/12/42/10/214124210.db2.gz SGTUHCHDERHDBF-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO CCCC[N@@H+](C)C[C@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000579755589 1014387874 /nfs/dbraw/zinc/38/78/74/1014387874.db2.gz GURTZHJZPIBFGR-JTQLQIEISA-N 1 1 334.342 3.541 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000430204541 1014893779 /nfs/dbraw/zinc/89/37/79/1014893779.db2.gz ROEGBBYGOODGJC-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000430211394 1014992084 /nfs/dbraw/zinc/99/20/84/1014992084.db2.gz IXSFNSREXVINNZ-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO CSc1ccc([C@@H](CNCc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000339591222 1015091098 /nfs/dbraw/zinc/09/10/98/1015091098.db2.gz ZBLLICCHTYDZMI-GOSISDBHSA-N 1 1 345.468 3.709 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000157714128 1015283543 /nfs/dbraw/zinc/28/35/43/1015283543.db2.gz IKPDLIOTMPHJCM-GFCCVEGCSA-N 1 1 334.807 3.670 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000157714128 1015283550 /nfs/dbraw/zinc/28/35/50/1015283550.db2.gz IKPDLIOTMPHJCM-GFCCVEGCSA-N 1 1 334.807 3.670 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941335 1016160195 /nfs/dbraw/zinc/16/01/95/1016160195.db2.gz ZFYSHGAABDHQLO-STQMWFEESA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1 ZINC000066696075 1016412099 /nfs/dbraw/zinc/41/20/99/1016412099.db2.gz ZDNHTVMKKVLPJN-INIZCTEOSA-N 1 1 332.425 3.838 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC1CCCCC1 ZINC001167273380 1016915035 /nfs/dbraw/zinc/91/50/35/1016915035.db2.gz DREQRKKVHBAMDP-CQSZACIVSA-N 1 1 333.432 3.824 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000449452049 1032569963 /nfs/dbraw/zinc/56/99/63/1032569963.db2.gz JRIZISPRDFTQIU-QGZVFWFLSA-N 1 1 334.803 3.722 20 5 EHBDMO NC1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840528 1017232704 /nfs/dbraw/zinc/23/27/04/1017232704.db2.gz KLPJAGSMMDDKII-RDJZCZTQSA-N 1 1 331.460 3.557 20 5 EHBDMO NC1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840530 1017232826 /nfs/dbraw/zinc/23/28/26/1017232826.db2.gz KLPJAGSMMDDKII-WBVHZDCISA-N 1 1 331.460 3.557 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1C ZINC000083186298 1017980627 /nfs/dbraw/zinc/98/06/27/1017980627.db2.gz CCXKMMFCFDZJCI-UHFFFAOYSA-N 1 1 341.367 3.685 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1C ZINC000083186298 1017980639 /nfs/dbraw/zinc/98/06/39/1017980639.db2.gz CCXKMMFCFDZJCI-UHFFFAOYSA-N 1 1 341.367 3.685 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066796075 1018174291 /nfs/dbraw/zinc/17/42/91/1018174291.db2.gz FTCDEIKYYZJRFQ-QGZVFWFLSA-N 1 1 328.416 3.635 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190852 1018988879 /nfs/dbraw/zinc/98/88/79/1018988879.db2.gz MNHFIYNNJLNKRB-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190852 1018988889 /nfs/dbraw/zinc/98/88/89/1018988889.db2.gz MNHFIYNNJLNKRB-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556406 1032819555 /nfs/dbraw/zinc/81/95/55/1032819555.db2.gz NVGITNDEMYXRMG-GOEBONIOSA-N 1 1 343.402 3.914 20 5 EHBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000052907288 1019307228 /nfs/dbraw/zinc/30/72/28/1019307228.db2.gz IAFNLVBPVSRTIR-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000052907288 1019307241 /nfs/dbraw/zinc/30/72/41/1019307241.db2.gz IAFNLVBPVSRTIR-HNNXBMFYSA-N 1 1 341.411 3.843 20 5 EHBDMO CC(C)[C@H]1[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CC=CC2 ZINC000592446791 1032834847 /nfs/dbraw/zinc/83/48/47/1032834847.db2.gz ZKGBVFXRNPFDMG-GOSISDBHSA-N 1 1 343.427 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+]2C2CC2)c2ncccc12 ZINC000433809157 1019634473 /nfs/dbraw/zinc/63/44/73/1019634473.db2.gz IEMMBBMKPRKZGA-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440161 1032849389 /nfs/dbraw/zinc/84/93/89/1032849389.db2.gz AIJXJZIAWXBZLI-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000501006127 1020643120 /nfs/dbraw/zinc/64/31/20/1020643120.db2.gz FPUFUTJCCOBQNX-UHFFFAOYSA-N 1 1 333.432 3.967 20 5 EHBDMO C[C@@H]1COC[C@@H](c2ccccc2)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038367 1020674229 /nfs/dbraw/zinc/67/42/29/1020674229.db2.gz JFAJFLWKWHLHFY-BEFAXECRSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403171 1020768360 /nfs/dbraw/zinc/76/83/60/1020768360.db2.gz UDIOURXSBPUGRQ-KDOFPFPSSA-N 1 1 336.395 3.953 20 5 EHBDMO Cc1cnc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000477169455 1021220532 /nfs/dbraw/zinc/22/05/32/1021220532.db2.gz JRBHEIVLXXTWDH-INIZCTEOSA-N 1 1 346.475 3.779 20 5 EHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000439256661 1021299433 /nfs/dbraw/zinc/29/94/33/1021299433.db2.gz HUYSAMRJZWCPLI-IBGZPJMESA-N 1 1 346.402 3.897 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)no1 ZINC000518779254 1021536330 /nfs/dbraw/zinc/53/63/30/1021536330.db2.gz KGXRNSWMWAPQPI-UHFFFAOYSA-N 1 1 329.381 3.910 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453584 1021624514 /nfs/dbraw/zinc/62/45/14/1021624514.db2.gz HQKURWMNINJHKO-ZYHUDNBSSA-N 1 1 342.342 3.579 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510460228 1021668542 /nfs/dbraw/zinc/66/85/42/1021668542.db2.gz WIEMZZUXFZYIKD-XTFWMQFUSA-N 1 1 343.471 3.945 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)C3CCC3)s2)cc1 ZINC000439777729 1021702840 /nfs/dbraw/zinc/70/28/40/1021702840.db2.gz BXHKJSIZWAPSFZ-UHFFFAOYSA-N 1 1 332.425 3.670 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnn(C3CCC3)c2)C2CC2)cc1 ZINC000891621701 1022138335 /nfs/dbraw/zinc/13/83/35/1022138335.db2.gz AOMJXPDYKDQFFO-UHFFFAOYSA-N 1 1 326.400 3.681 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnn(C3CCC3)c2)C2CC2)cc1 ZINC000891621701 1022138347 /nfs/dbraw/zinc/13/83/47/1022138347.db2.gz AOMJXPDYKDQFFO-UHFFFAOYSA-N 1 1 326.400 3.681 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441353160 1022171114 /nfs/dbraw/zinc/17/11/14/1022171114.db2.gz GKKYYPSNKGKUJH-HNNXBMFYSA-N 1 1 325.840 3.554 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000441386258 1022205276 /nfs/dbraw/zinc/20/52/76/1022205276.db2.gz UJSBQYMMADZMEE-LJQANCHMSA-N 1 1 346.427 3.805 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000341542790 1022220307 /nfs/dbraw/zinc/22/03/07/1022220307.db2.gz FFARSGHQFQPSPP-GFCCVEGCSA-N 1 1 349.460 3.666 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000894529577 1022487164 /nfs/dbraw/zinc/48/71/64/1022487164.db2.gz ZHBMIZZIWUZCSI-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000441427410 1022532274 /nfs/dbraw/zinc/53/22/74/1022532274.db2.gz GTCFVGNKSXSCRP-HNNXBMFYSA-N 1 1 344.411 3.545 20 5 EHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226108 1022587263 /nfs/dbraw/zinc/58/72/63/1022587263.db2.gz WFRQDXZGIGODBT-STQMWFEESA-N 1 1 342.436 3.849 20 5 EHBDMO Cc1cc(NC[C@H](C)C[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302054564 1022681489 /nfs/dbraw/zinc/68/14/89/1022681489.db2.gz ACHNLTWTCCXCDO-ZDUSSCGKSA-N 1 1 328.416 3.595 20 5 EHBDMO Cn1ncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720598 1022793005 /nfs/dbraw/zinc/79/30/05/1022793005.db2.gz WKFBELZSPMPLEY-INIZCTEOSA-N 1 1 340.427 3.585 20 5 EHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000507185288 1023170167 /nfs/dbraw/zinc/17/01/67/1023170167.db2.gz WOXCPBXOSKVRPM-MRXNPFEDSA-N 1 1 326.396 3.772 20 5 EHBDMO CCOc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1 ZINC000610675405 1023172879 /nfs/dbraw/zinc/17/28/79/1023172879.db2.gz MYMAJYCAQNJEJO-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](c2nc(C)cs2)C2CC2)ccc1[N+](=O)[O-] ZINC000276932839 1023409245 /nfs/dbraw/zinc/40/92/45/1023409245.db2.gz RBCFXGYZWIXJMQ-INIZCTEOSA-N 1 1 347.440 3.999 20 5 EHBDMO CCc1ccc([C@@H]2CCCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259661 1023944716 /nfs/dbraw/zinc/94/47/16/1023944716.db2.gz WJVMGTDWXNOLEJ-HNNXBMFYSA-N 1 1 332.404 3.564 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000443663764 1024364472 /nfs/dbraw/zinc/36/44/72/1024364472.db2.gz YVLVVXCRERNYMZ-ZIAGYGMSSA-N 1 1 333.432 3.600 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000430112700 1024380438 /nfs/dbraw/zinc/38/04/38/1024380438.db2.gz DZMVXDRVKUWYJT-HTHKKOALSA-N 1 1 343.471 3.660 20 5 EHBDMO COc1c(O)ccc(C[NH2+]C2(c3ccccc3F)CCC2)c1[N+](=O)[O-] ZINC000895103905 1024405872 /nfs/dbraw/zinc/40/58/72/1024405872.db2.gz DCZVYILMKNJLJX-UHFFFAOYSA-N 1 1 346.358 3.617 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857294 1033210929 /nfs/dbraw/zinc/21/09/29/1033210929.db2.gz UGKWJRSKOPWQEH-QGZVFWFLSA-N 1 1 341.411 3.768 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](CF)C3)cs2)c1 ZINC000895545932 1024603600 /nfs/dbraw/zinc/60/36/00/1024603600.db2.gz IVVWQGARSJZDLL-LBPRGKRZSA-N 1 1 335.404 3.900 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](CF)C3)cs2)c1 ZINC000895545932 1024603607 /nfs/dbraw/zinc/60/36/07/1024603607.db2.gz IVVWQGARSJZDLL-LBPRGKRZSA-N 1 1 335.404 3.900 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505631832 1024702358 /nfs/dbraw/zinc/70/23/58/1024702358.db2.gz DWNSIQTXPLORTO-ZFWWWQNUSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505631832 1024702366 /nfs/dbraw/zinc/70/23/66/1024702366.db2.gz DWNSIQTXPLORTO-ZFWWWQNUSA-N 1 1 330.384 3.854 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895844052 1024891554 /nfs/dbraw/zinc/89/15/54/1024891554.db2.gz LOBOKPPTPOVYLV-WFASDCNBSA-N 1 1 344.333 3.615 20 5 EHBDMO CC[C@H](C)c1nnc([C@H](C)[NH2+]CC=Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000277436429 1025095765 /nfs/dbraw/zinc/09/57/65/1025095765.db2.gz NZZYEAJBZJLFKI-VOWYIILJSA-N 1 1 329.404 3.590 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000521063260 1025192478 /nfs/dbraw/zinc/19/24/78/1025192478.db2.gz NTXOIVBDEVOQGU-ZDUSSCGKSA-N 1 1 331.803 3.941 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281738124 1025436834 /nfs/dbraw/zinc/43/68/34/1025436834.db2.gz BDPZHNJBQSAAKK-ZDUSSCGKSA-N 1 1 344.390 3.651 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334245 1025505828 /nfs/dbraw/zinc/50/58/28/1025505828.db2.gz UIYFFZSXAPYMGB-UONOGXRCSA-N 1 1 331.441 3.985 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000451545143 1026095261 /nfs/dbraw/zinc/09/52/61/1026095261.db2.gz GLELBJLYDSFWTO-SFHVURJKSA-N 1 1 331.460 3.650 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCC[NH+]3CCCCC3)C2)cc1 ZINC000451545143 1026095277 /nfs/dbraw/zinc/09/52/77/1026095277.db2.gz GLELBJLYDSFWTO-SFHVURJKSA-N 1 1 331.460 3.650 20 5 EHBDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475127548 1026221967 /nfs/dbraw/zinc/22/19/67/1026221967.db2.gz IXGDLWOALZFNEE-GOSISDBHSA-N 1 1 330.384 3.592 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141484 1026234669 /nfs/dbraw/zinc/23/46/69/1026234669.db2.gz WCQGTNDXSBZOFG-YRVHBARZSA-N 1 1 340.423 3.798 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(Cl)cc1Cl ZINC000511126479 1026279741 /nfs/dbraw/zinc/27/97/41/1026279741.db2.gz QHVIEAVZRHSDPO-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(Cl)cc1Cl ZINC000511126479 1026279745 /nfs/dbraw/zinc/27/97/45/1026279745.db2.gz QHVIEAVZRHSDPO-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCCC[C@@H]1C ZINC000530855960 1026355274 /nfs/dbraw/zinc/35/52/74/1026355274.db2.gz XNTOVWNKPHESMM-UONOGXRCSA-N 1 1 328.416 3.818 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1ccc(F)cc1 ZINC000065596729 1026917052 /nfs/dbraw/zinc/91/70/52/1026917052.db2.gz MVSQGLRAISKOAW-UHFFFAOYSA-N 1 1 332.375 3.677 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000342803081 1027193233 /nfs/dbraw/zinc/19/32/33/1027193233.db2.gz UJWFVEHDTLLLIU-UHFFFAOYSA-N 1 1 343.214 3.933 20 5 EHBDMO Cc1c(CN[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663385 1027580079 /nfs/dbraw/zinc/58/00/79/1027580079.db2.gz FKFXORYIULODQB-KXBFYZLASA-N 1 1 339.439 3.656 20 5 EHBDMO Cc1c(CN[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663385 1027580089 /nfs/dbraw/zinc/58/00/89/1027580089.db2.gz FKFXORYIULODQB-KXBFYZLASA-N 1 1 339.439 3.656 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186687779 1027862995 /nfs/dbraw/zinc/86/29/95/1027862995.db2.gz BLFMMJZSSHBTGN-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186687779 1027863020 /nfs/dbraw/zinc/86/30/20/1027863020.db2.gz BLFMMJZSSHBTGN-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435391 1027873487 /nfs/dbraw/zinc/87/34/87/1027873487.db2.gz WJKGYXCQRINMJF-LSDHHAIUSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000523332953 1028180817 /nfs/dbraw/zinc/18/08/17/1028180817.db2.gz VHCRJFHGPLOASP-INIZCTEOSA-N 1 1 347.462 3.848 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(O)CCC1 ZINC000546255807 1028425391 /nfs/dbraw/zinc/42/53/91/1028425391.db2.gz AAOQJQYLAPQYLJ-UHFFFAOYSA-N 1 1 332.425 3.670 20 5 EHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000513750314 1028500051 /nfs/dbraw/zinc/50/00/51/1028500051.db2.gz GHHIXQFELKFNRR-QGZVFWFLSA-N 1 1 341.411 3.583 20 5 EHBDMO CC[N@H+](C)[C@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000504261655 1028517357 /nfs/dbraw/zinc/51/73/57/1028517357.db2.gz YDYVDGQNKFWGJN-INIZCTEOSA-N 1 1 338.367 3.686 20 5 EHBDMO CC[N@@H+](C)[C@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000504261655 1028517373 /nfs/dbraw/zinc/51/73/73/1028517373.db2.gz YDYVDGQNKFWGJN-INIZCTEOSA-N 1 1 338.367 3.686 20 5 EHBDMO CCCOc1cccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001167647467 1028540364 /nfs/dbraw/zinc/54/03/64/1028540364.db2.gz MPPUSXGDWQVAMM-UHFFFAOYSA-N 1 1 326.396 3.942 20 5 EHBDMO CCCOc1cccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001167647467 1028540374 /nfs/dbraw/zinc/54/03/74/1028540374.db2.gz MPPUSXGDWQVAMM-UHFFFAOYSA-N 1 1 326.396 3.942 20 5 EHBDMO COCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000523702111 1028555656 /nfs/dbraw/zinc/55/56/56/1028555656.db2.gz FERTZQIZYRXNEQ-MRXNPFEDSA-N 1 1 328.412 3.847 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968687 1028589493 /nfs/dbraw/zinc/58/94/93/1028589493.db2.gz ZJHBSVBAMYGEFM-AWEZNQCLSA-N 1 1 348.353 3.614 20 5 EHBDMO Cc1c([C@H](C)[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)cccc1[N+](=O)[O-] ZINC000296407322 1028924921 /nfs/dbraw/zinc/92/49/21/1028924921.db2.gz KSQCGCUWOVRWQC-GJZGRUSLSA-N 1 1 347.459 3.578 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504906415 1029050924 /nfs/dbraw/zinc/05/09/24/1029050924.db2.gz XSFHVCQTHSZNNN-JYJNAYRXSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504906415 1029050937 /nfs/dbraw/zinc/05/09/37/1029050937.db2.gz XSFHVCQTHSZNNN-JYJNAYRXSA-N 1 1 349.475 3.765 20 5 EHBDMO COc1ccc(Cl)cc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000524426353 1029181762 /nfs/dbraw/zinc/18/17/62/1029181762.db2.gz KXWUUMVWUQXZNL-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)C2CCC(C)(C)CC2)c([N+](=O)[O-])c1 ZINC001167658469 1029191564 /nfs/dbraw/zinc/19/15/64/1029191564.db2.gz HWFOKUMXNAOKGV-UHFFFAOYSA-N 1 1 336.432 3.883 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445871368 1029202381 /nfs/dbraw/zinc/20/23/81/1029202381.db2.gz KWGMEUHSWZNVTM-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288262 1029582217 /nfs/dbraw/zinc/58/22/17/1029582217.db2.gz WUFPQVPSYZPABD-TZMCWYRMSA-N 1 1 333.432 3.741 20 5 EHBDMO CSc1ccc(OCC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000446735599 1029784918 /nfs/dbraw/zinc/78/49/18/1029784918.db2.gz KSHYACLLILSPHZ-UHFFFAOYSA-N 1 1 344.436 3.754 20 5 EHBDMO CSc1ccc(OCC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000446735599 1029784921 /nfs/dbraw/zinc/78/49/21/1029784921.db2.gz KSHYACLLILSPHZ-UHFFFAOYSA-N 1 1 344.436 3.754 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000235689451 1029831082 /nfs/dbraw/zinc/83/10/82/1029831082.db2.gz FAUQPZUEACTAGG-WDEREUQCSA-N 1 1 342.237 3.560 20 5 EHBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000531868641 1029942811 /nfs/dbraw/zinc/94/28/11/1029942811.db2.gz SESRZOQVTBCNDA-CQSZACIVSA-N 1 1 334.416 3.539 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccccc3)n2)o1 ZINC000453264618 1029995266 /nfs/dbraw/zinc/99/52/66/1029995266.db2.gz WJQYDEDWZZXLFN-ZDUSSCGKSA-N 1 1 340.339 3.575 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCC[N@H+]3Cc3ccccc3)n2)o1 ZINC000453264618 1029995278 /nfs/dbraw/zinc/99/52/78/1029995278.db2.gz WJQYDEDWZZXLFN-ZDUSSCGKSA-N 1 1 340.339 3.575 20 5 EHBDMO Cc1noc([C@@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529479 1030120203 /nfs/dbraw/zinc/12/02/03/1030120203.db2.gz RLFWDKNBSQVDCM-GXTWGEPZSA-N 1 1 330.388 3.535 20 5 EHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453349655 1030138613 /nfs/dbraw/zinc/13/86/13/1030138613.db2.gz LTFLPXGZUFUELY-MLGOLLRUSA-N 1 1 328.416 3.884 20 5 EHBDMO COc1ccc(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000441271834 1030212019 /nfs/dbraw/zinc/21/20/19/1030212019.db2.gz YWTDFSYWNXZVGZ-UHFFFAOYSA-N 1 1 326.396 3.811 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC1CCCC1 ZINC000064020993 1030394869 /nfs/dbraw/zinc/39/48/69/1030394869.db2.gz FDZYFZNTDBLJDT-GFCCVEGCSA-N 1 1 330.388 3.828 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)n1 ZINC000526954271 1030502767 /nfs/dbraw/zinc/50/27/67/1030502767.db2.gz DPUKKFPPBRUGII-XQQFMLRXSA-N 1 1 330.388 3.887 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483101037 1030954401 /nfs/dbraw/zinc/95/44/01/1030954401.db2.gz OWRUPAWTHTURGU-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483246056 1031055480 /nfs/dbraw/zinc/05/54/80/1031055480.db2.gz RWIOYWUCQRFFFF-AWEZNQCLSA-N 1 1 333.432 3.600 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000343567909 1031415495 /nfs/dbraw/zinc/41/54/95/1031415495.db2.gz NUEGBVJTQPOUFB-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475728528 1031663610 /nfs/dbraw/zinc/66/36/10/1031663610.db2.gz UAMPBEVZILFAKW-OAHLLOKOSA-N 1 1 348.830 3.938 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475728528 1031663620 /nfs/dbraw/zinc/66/36/20/1031663620.db2.gz UAMPBEVZILFAKW-OAHLLOKOSA-N 1 1 348.830 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](CC(F)(F)F)C3)nc2c1 ZINC000278623101 1031702390 /nfs/dbraw/zinc/70/23/90/1031702390.db2.gz FZNAEDIDEHRQDJ-SECBINFHSA-N 1 1 329.278 3.510 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](CC(F)(F)F)C3)nc2c1 ZINC000278623101 1031702403 /nfs/dbraw/zinc/70/24/03/1031702403.db2.gz FZNAEDIDEHRQDJ-SECBINFHSA-N 1 1 329.278 3.510 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3nccs3)C2)cc1Cl ZINC000898071742 1033324867 /nfs/dbraw/zinc/32/48/67/1033324867.db2.gz RNYMPCPEUXLUNI-GFCCVEGCSA-N 1 1 337.832 3.769 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1F ZINC000593610718 1033441697 /nfs/dbraw/zinc/44/16/97/1033441697.db2.gz AFTQYQKUBCQEHQ-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CCSc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)ccn1 ZINC000595034223 1033655002 /nfs/dbraw/zinc/65/50/02/1033655002.db2.gz WDEZQJZVHLUIOO-LBPRGKRZSA-N 1 1 347.440 3.961 20 5 EHBDMO COc1ccnc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1F ZINC000595080374 1033695828 /nfs/dbraw/zinc/69/58/28/1033695828.db2.gz LHMIUIUIUXGKGV-HNNXBMFYSA-N 1 1 345.374 3.695 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000599064273 1033702486 /nfs/dbraw/zinc/70/24/86/1033702486.db2.gz LXEGXCNRDGFZFE-QAPCUYQASA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599064273 1033702499 /nfs/dbraw/zinc/70/24/99/1033702499.db2.gz LXEGXCNRDGFZFE-QAPCUYQASA-N 1 1 329.444 3.579 20 5 EHBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000078558901 1033705321 /nfs/dbraw/zinc/70/53/21/1033705321.db2.gz JHFUCTWHSGMBTK-KRWDZBQOSA-N 1 1 340.358 3.863 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC000595304129 1033738609 /nfs/dbraw/zinc/73/86/09/1033738609.db2.gz NUUAWWUZWAIALO-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000472354638 1033807348 /nfs/dbraw/zinc/80/73/48/1033807348.db2.gz VDHLDGNPSYODML-INIZCTEOSA-N 1 1 346.402 3.814 20 5 EHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000472354638 1033807357 /nfs/dbraw/zinc/80/73/57/1033807357.db2.gz VDHLDGNPSYODML-INIZCTEOSA-N 1 1 346.402 3.814 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000603837174 1033962800 /nfs/dbraw/zinc/96/28/00/1033962800.db2.gz AJHYNQWJRCGOLA-KRWDZBQOSA-N 1 1 326.396 3.983 20 5 EHBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000603853713 1033976936 /nfs/dbraw/zinc/97/69/36/1033976936.db2.gz KHPXTNFVBKJDLO-ZIAGYGMSSA-N 1 1 328.416 3.818 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595747222 1033980663 /nfs/dbraw/zinc/98/06/63/1033980663.db2.gz IHYFDYCGZWCNKI-ZAAXVRCTSA-N 1 1 340.423 3.754 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CO)c1ccc(F)cc1F ZINC000595867417 1034012892 /nfs/dbraw/zinc/01/28/92/1034012892.db2.gz MVPSVXFMKDUUEL-PIGZYNQJSA-N 1 1 336.338 3.566 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccon2)CC1 ZINC000595829684 1034016644 /nfs/dbraw/zinc/01/66/44/1034016644.db2.gz ZHONKNSWOLUFHF-UHFFFAOYSA-N 1 1 345.399 3.750 20 5 EHBDMO COc1ccc(CNc2cc(C)c3ccc(C)cc3[nH+]2)cc1[N+](=O)[O-] ZINC000603932471 1034043109 /nfs/dbraw/zinc/04/31/09/1034043109.db2.gz RLQSHGBQWLJERN-UHFFFAOYSA-N 1 1 337.379 3.802 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCc2ccccc2-n2ccnc21 ZINC000596063749 1034065917 /nfs/dbraw/zinc/06/59/17/1034065917.db2.gz SCDWUQWEUPMKKO-GOSISDBHSA-N 1 1 348.406 3.866 20 5 EHBDMO Cc1ccc(C[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596062433 1034066691 /nfs/dbraw/zinc/06/66/91/1034066691.db2.gz REJZQVXPXNIBEK-QGZVFWFLSA-N 1 1 348.406 3.866 20 5 EHBDMO Cn1c2ccc(Nc3cc[nH]c(=O)c3[N+](=O)[O-])cc2[nH+]c1C(C)(C)C ZINC000596179860 1034099462 /nfs/dbraw/zinc/09/94/62/1034099462.db2.gz QYFHPXMNWGRTOW-UHFFFAOYSA-N 1 1 341.371 3.623 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000604012343 1034137978 /nfs/dbraw/zinc/13/79/78/1034137978.db2.gz YLCUENQSOOYYFV-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000596596799 1034312369 /nfs/dbraw/zinc/31/23/69/1034312369.db2.gz FYHNXRIRSBHVBR-CYBMUJFWSA-N 1 1 328.416 3.772 20 5 EHBDMO Cc1c([C@@H](C)[NH2+][C@@H]2CNCC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000596647960 1034345883 /nfs/dbraw/zinc/34/58/83/1034345883.db2.gz DRSVVTVXLIDBSI-ATZDWAIDSA-N 1 1 339.439 3.700 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC/C=C/c3ccccc3)C2)nc1 ZINC000450556367 1034520380 /nfs/dbraw/zinc/52/03/80/1034520380.db2.gz AVTHHOJQMCSCAH-IOMDMTNGSA-N 1 1 338.411 3.580 20 5 EHBDMO C[C@H](c1ccccc1)[C@@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600320 1034551064 /nfs/dbraw/zinc/55/10/64/1034551064.db2.gz NGSUKYRUVHZTSN-QRWLVFNGSA-N 1 1 340.423 3.724 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948229 1034730487 /nfs/dbraw/zinc/73/04/87/1034730487.db2.gz UADYPSSSQNFBNO-QWRGUYRKSA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411128054 1034796204 /nfs/dbraw/zinc/79/62/04/1034796204.db2.gz DEHZBRSGBVCJEW-AWEZNQCLSA-N 1 1 327.384 3.616 20 5 EHBDMO CN(c1ccccc1)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000065956252 1035008975 /nfs/dbraw/zinc/00/89/75/1035008975.db2.gz WLZUONQRISHJAV-UHFFFAOYSA-N 1 1 331.441 3.757 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000612577377 1035072360 /nfs/dbraw/zinc/07/23/60/1035072360.db2.gz BZDOYKPCWPCTSW-IBGZPJMESA-N 1 1 326.396 3.867 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)nc1 ZINC000177628314 1035282545 /nfs/dbraw/zinc/28/25/45/1035282545.db2.gz TUWIKBQPZWUUBQ-UHFFFAOYSA-N 1 1 335.791 3.544 20 5 EHBDMO COc1cc(C[N@H+](C)CCOc2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463468351 1035537709 /nfs/dbraw/zinc/53/77/09/1035537709.db2.gz DKYAQILKPPVFMA-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO COc1cc(C[N@@H+](C)CCOc2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463468351 1035537722 /nfs/dbraw/zinc/53/77/22/1035537722.db2.gz DKYAQILKPPVFMA-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000463527852 1035586111 /nfs/dbraw/zinc/58/61/11/1035586111.db2.gz UGLBIQOEGGZCQJ-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000414180693 1035932915 /nfs/dbraw/zinc/93/29/15/1035932915.db2.gz LREOZIFPUHWLEU-JMPLFQLZSA-N 1 1 348.424 3.580 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000535077669 1036000330 /nfs/dbraw/zinc/00/03/30/1036000330.db2.gz XWGVQEOXAIVLJE-BOTMBNHJSA-N 1 1 344.333 3.651 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000535077669 1036000353 /nfs/dbraw/zinc/00/03/53/1036000353.db2.gz XWGVQEOXAIVLJE-BOTMBNHJSA-N 1 1 344.333 3.651 20 5 EHBDMO CCc1ccc(C[N@H+](C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])cc1 ZINC000589494739 1036437119 /nfs/dbraw/zinc/43/71/19/1036437119.db2.gz VJIFROYAJLPWLH-UHFFFAOYSA-N 1 1 342.395 3.576 20 5 EHBDMO CCc1ccc(C[N@@H+](C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])cc1 ZINC000589494739 1036437124 /nfs/dbraw/zinc/43/71/24/1036437124.db2.gz VJIFROYAJLPWLH-UHFFFAOYSA-N 1 1 342.395 3.576 20 5 EHBDMO COc1cccc([C@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000464497477 1036511557 /nfs/dbraw/zinc/51/15/57/1036511557.db2.gz YIOYBQCHIGDKOS-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC=C(c3cccnc3)C2)cc1 ZINC000590741971 1037041030 /nfs/dbraw/zinc/04/10/30/1037041030.db2.gz QGXYGHUBDLBBPJ-UHFFFAOYSA-N 1 1 339.395 3.548 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[NH+](Cc2ccsc2)CC1 ZINC000539802730 1037216180 /nfs/dbraw/zinc/21/61/80/1037216180.db2.gz MXZNSPADYJDPMI-HNNXBMFYSA-N 1 1 345.468 3.844 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000171128684 1037464307 /nfs/dbraw/zinc/46/43/07/1037464307.db2.gz RIJRXNAVAAMFRZ-CQSZACIVSA-N 1 1 339.395 3.572 20 5 EHBDMO Cc1ccnc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311171154 1037536113 /nfs/dbraw/zinc/53/61/13/1037536113.db2.gz SUQSETMRCZAANT-QGZVFWFLSA-N 1 1 340.427 3.622 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCCC[C@H]1C ZINC000462925659 1037554333 /nfs/dbraw/zinc/55/43/33/1037554333.db2.gz CMUKFZHEYVCLEP-VXGBXAGGSA-N 1 1 343.374 3.871 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@H+]1CCCC[C@H]1C ZINC000462925656 1037554474 /nfs/dbraw/zinc/55/44/74/1037554474.db2.gz CMUKFZHEYVCLEP-NEPJUHHUSA-N 1 1 343.374 3.871 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(CO)CC1 ZINC000188952645 1037575055 /nfs/dbraw/zinc/57/50/55/1037575055.db2.gz SGBWQGWDEWKOJU-UHFFFAOYSA-N 1 1 332.425 3.528 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000030154309 1037632328 /nfs/dbraw/zinc/63/23/28/1037632328.db2.gz NVCZMMILDDLNQO-UHFFFAOYSA-N 1 1 339.439 3.611 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H]1CCC3(CCCCC3)O1)CC2 ZINC000467199691 1038604235 /nfs/dbraw/zinc/60/42/35/1038604235.db2.gz ATYPZYHUYSJYFO-GOSISDBHSA-N 1 1 330.428 3.835 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1CCC3(CCCCC3)O1)CC2 ZINC000467199691 1038604242 /nfs/dbraw/zinc/60/42/42/1038604242.db2.gz ATYPZYHUYSJYFO-GOSISDBHSA-N 1 1 330.428 3.835 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccn(-c2ccccc2)n1 ZINC000539068804 1038669351 /nfs/dbraw/zinc/66/93/51/1038669351.db2.gz WXIKYHQLPFBOSB-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488034876 1038791650 /nfs/dbraw/zinc/79/16/50/1038791650.db2.gz VIWDORJEFLDZPP-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488034876 1038791664 /nfs/dbraw/zinc/79/16/64/1038791664.db2.gz VIWDORJEFLDZPP-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](CO)CC2)s1 ZINC000552146503 1039023129 /nfs/dbraw/zinc/02/31/29/1039023129.db2.gz LHSAWLJQGQMDJW-AWEZNQCLSA-N 1 1 346.452 3.918 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2CC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480064999 1039090199 /nfs/dbraw/zinc/09/01/99/1039090199.db2.gz UFKWSYXMUUHXSA-CQSZACIVSA-N 1 1 333.432 3.577 20 5 EHBDMO COc1ccc(C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000015309547 1039106821 /nfs/dbraw/zinc/10/68/21/1039106821.db2.gz KAOMDIJMIPFNLS-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000015309547 1039106827 /nfs/dbraw/zinc/10/68/27/1039106827.db2.gz KAOMDIJMIPFNLS-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO CC(C)[N@H+](CC(=O)N1[C@H](C)CCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138400083 1039149638 /nfs/dbraw/zinc/14/96/38/1039149638.db2.gz OXLLUGHVHOLFFV-HZPDHXFCSA-N 1 1 347.459 3.595 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N1[C@H](C)CCC[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000138400083 1039149655 /nfs/dbraw/zinc/14/96/55/1039149655.db2.gz OXLLUGHVHOLFFV-HZPDHXFCSA-N 1 1 347.459 3.595 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000549674502 1039606895 /nfs/dbraw/zinc/60/68/95/1039606895.db2.gz VNJZALUIVWGPAB-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000549674502 1039606900 /nfs/dbraw/zinc/60/69/00/1039606900.db2.gz VNJZALUIVWGPAB-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000930868624 1039953477 /nfs/dbraw/zinc/95/34/77/1039953477.db2.gz XLUJTGOKRSABMR-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000930868624 1039953495 /nfs/dbraw/zinc/95/34/95/1039953495.db2.gz XLUJTGOKRSABMR-LBPRGKRZSA-N 1 1 347.159 3.588 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000486390273 1040103711 /nfs/dbraw/zinc/10/37/11/1040103711.db2.gz VASNSTUMXLSMFL-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO Cc1cc(N[C@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555192530 1040266220 /nfs/dbraw/zinc/26/62/20/1040266220.db2.gz IYJNTJSFCZVRIF-JTQLQIEISA-N 1 1 340.305 3.545 20 5 EHBDMO COc1ccc(CSCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000433033876 1040521099 /nfs/dbraw/zinc/52/10/99/1040521099.db2.gz QTIJNCYQMSXAAI-UHFFFAOYSA-N 1 1 346.452 3.969 20 5 EHBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593284 1040621709 /nfs/dbraw/zinc/62/17/09/1040621709.db2.gz VJJPCHYUCBINMU-SGTLLEGYSA-N 1 1 330.359 3.558 20 5 EHBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593284 1040621721 /nfs/dbraw/zinc/62/17/21/1040621721.db2.gz VJJPCHYUCBINMU-SGTLLEGYSA-N 1 1 330.359 3.558 20 5 EHBDMO COCCCC[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000418131304 1040623042 /nfs/dbraw/zinc/62/30/42/1040623042.db2.gz HQEFWPXQDFWGAZ-UHFFFAOYSA-N 1 1 348.399 3.722 20 5 EHBDMO CC1(C)C[C@@H](N[C@@H]2CC[N@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114677 1040764951 /nfs/dbraw/zinc/76/49/51/1040764951.db2.gz GTIKIRFAQFDIBV-AUUYWEPGSA-N 1 1 343.471 3.924 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@@H]2CCN(C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114677 1040764961 /nfs/dbraw/zinc/76/49/61/1040764961.db2.gz GTIKIRFAQFDIBV-AUUYWEPGSA-N 1 1 343.471 3.924 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000600198324 1040818879 /nfs/dbraw/zinc/81/88/79/1040818879.db2.gz WMOWPLBDTPRTQR-GDBMZVCRSA-N 1 1 348.443 3.703 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c(F)c1 ZINC000586768620 1041005903 /nfs/dbraw/zinc/00/59/03/1041005903.db2.gz TXWJYHSIXCUWJE-CHWSQXEVSA-N 1 1 340.370 3.512 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c(F)c1 ZINC000586768620 1041005917 /nfs/dbraw/zinc/00/59/17/1041005917.db2.gz TXWJYHSIXCUWJE-CHWSQXEVSA-N 1 1 340.370 3.512 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC[C@H](C)C1 ZINC000481604704 1041145798 /nfs/dbraw/zinc/14/57/98/1041145798.db2.gz ZYHVPOVZUUZLIJ-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@H](C)C1 ZINC000481604704 1041145805 /nfs/dbraw/zinc/14/58/05/1041145805.db2.gz ZYHVPOVZUUZLIJ-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481674263 1041236325 /nfs/dbraw/zinc/23/63/25/1041236325.db2.gz IWKIIOCQZISGRG-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481674263 1041236342 /nfs/dbraw/zinc/23/63/42/1041236342.db2.gz IWKIIOCQZISGRG-LJQANCHMSA-N 1 1 342.370 3.755 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@H](C)c1ccccc1 ZINC000066854386 1041237876 /nfs/dbraw/zinc/23/78/76/1041237876.db2.gz KZQAWKQAQTVDBG-HNNXBMFYSA-N 1 1 341.411 3.577 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000511837980 1041684593 /nfs/dbraw/zinc/68/45/93/1041684593.db2.gz KUCYAYKTDJCAOP-BXUZGUMPSA-N 1 1 326.343 3.961 20 5 EHBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000181758774 1041951106 /nfs/dbraw/zinc/95/11/06/1041951106.db2.gz XCGLPVFZGYRVSM-GFCCVEGCSA-N 1 1 339.351 3.630 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979138 1042829955 /nfs/dbraw/zinc/82/99/55/1042829955.db2.gz RUAGUVIYCFUGTI-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979138 1042829961 /nfs/dbraw/zinc/82/99/61/1042829961.db2.gz RUAGUVIYCFUGTI-CYBMUJFWSA-N 1 1 330.384 3.854 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)(C)c1ccccc1 ZINC000585754342 1043024340 /nfs/dbraw/zinc/02/43/40/1043024340.db2.gz IOBYMVNZEFMLSL-UHFFFAOYSA-N 1 1 342.395 3.828 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cncc(F)c1 ZINC000279506881 1044150567 /nfs/dbraw/zinc/15/05/67/1044150567.db2.gz NDMOOOWGMHNGCT-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO COCCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000512297833 1044564075 /nfs/dbraw/zinc/56/40/75/1044564075.db2.gz AGGVEMSMDSQIMB-UHFFFAOYSA-N 1 1 348.374 3.995 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000178568464 1044638255 /nfs/dbraw/zinc/63/82/55/1044638255.db2.gz BLYZQVSFFUZECA-IBGZPJMESA-N 1 1 342.370 3.557 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1ccccc1 ZINC000301279156 1127626490 /nfs/dbraw/zinc/62/64/90/1127626490.db2.gz NGGIRIFVLRWJKD-GFCCVEGCSA-N 1 1 334.807 3.576 20 5 EHBDMO COc1cc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301410310 1127742984 /nfs/dbraw/zinc/74/29/84/1127742984.db2.gz XQFPFCBJHWJXEK-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCc3sccc3C2)c1 ZINC000338644309 1127968570 /nfs/dbraw/zinc/96/85/70/1127968570.db2.gz FOAQLISWYSQFHP-LBPRGKRZSA-N 1 1 347.440 3.524 20 5 EHBDMO CC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@H]1C ZINC001307703134 1128456279 /nfs/dbraw/zinc/45/62/79/1128456279.db2.gz OMQOOHXQGCZZCN-WDEREUQCSA-N 1 1 327.222 3.978 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428835 1128486268 /nfs/dbraw/zinc/48/62/68/1128486268.db2.gz OSHFTHORABYXHH-ZBFHGGJFSA-N 1 1 326.400 3.546 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428834 1128486461 /nfs/dbraw/zinc/48/64/61/1128486461.db2.gz OSHFTHORABYXHH-HOCLYGCPSA-N 1 1 326.400 3.546 20 5 EHBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000153663248 1128574306 /nfs/dbraw/zinc/57/43/06/1128574306.db2.gz RXNONKXRNDGFOQ-UHFFFAOYSA-N 1 1 328.416 3.760 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccc(F)cc1[N+](=O)[O-] ZINC000338716788 1128745549 /nfs/dbraw/zinc/74/55/49/1128745549.db2.gz DHVZJHOFCANMNT-UHFFFAOYSA-N 1 1 326.331 3.840 20 5 EHBDMO CN(C(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCC[N@@H+](C)C1 ZINC000172659541 1128775026 /nfs/dbraw/zinc/77/50/26/1128775026.db2.gz YBEUWLSSRCQSOP-MRXNPFEDSA-N 1 1 333.435 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c2ccncc21 ZINC000715711903 1128810340 /nfs/dbraw/zinc/81/03/40/1128810340.db2.gz KYWVJRXURMAUFF-INIZCTEOSA-N 1 1 348.406 3.829 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)c2ccc(F)c(F)c2)C2CC2)c1 ZINC000153259913 1120928081 /nfs/dbraw/zinc/92/80/81/1120928081.db2.gz PLKDHQPJVLEGND-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138277 1121126162 /nfs/dbraw/zinc/12/61/62/1121126162.db2.gz LJVDFIHJARUPST-LLVKDONJSA-N 1 1 334.807 3.820 20 5 EHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138277 1121126166 /nfs/dbraw/zinc/12/61/66/1121126166.db2.gz LJVDFIHJARUPST-LLVKDONJSA-N 1 1 334.807 3.820 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326334684 1121649158 /nfs/dbraw/zinc/64/91/58/1121649158.db2.gz IJIYDXWYDQBPOJ-AWEZNQCLSA-N 1 1 328.416 3.594 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326334684 1121649160 /nfs/dbraw/zinc/64/91/60/1121649160.db2.gz IJIYDXWYDQBPOJ-AWEZNQCLSA-N 1 1 328.416 3.594 20 5 EHBDMO CC(C)[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000497201732 1122370887 /nfs/dbraw/zinc/37/08/87/1122370887.db2.gz WXZMKCYBWWJKKJ-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000497201732 1122370893 /nfs/dbraw/zinc/37/08/93/1122370893.db2.gz WXZMKCYBWWJKKJ-SFHVURJKSA-N 1 1 330.384 3.712 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154339240 1122564484 /nfs/dbraw/zinc/56/44/84/1122564484.db2.gz VMMZNGBALPVJJB-NRXGSXMXSA-N 1 1 344.386 3.645 20 5 EHBDMO C[C@H]([N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406103 1123364601 /nfs/dbraw/zinc/36/46/01/1123364601.db2.gz JHNZYJSYRPUWBC-JTQLQIEISA-N 1 1 327.812 3.553 20 5 EHBDMO COc1ccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609800393 1123664519 /nfs/dbraw/zinc/66/45/19/1123664519.db2.gz FEYUTJRMHRJUKA-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO COc1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609800393 1123664521 /nfs/dbraw/zinc/66/45/21/1123664521.db2.gz FEYUTJRMHRJUKA-GOSISDBHSA-N 1 1 344.436 3.894 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610133754 1123739054 /nfs/dbraw/zinc/73/90/54/1123739054.db2.gz SUFGRGRJXAHMFI-AAEUAGOBSA-N 1 1 345.365 3.923 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@@H]1c1ccccc1 ZINC000301823519 1129144202 /nfs/dbraw/zinc/14/42/02/1129144202.db2.gz CMIYZSKDHAOAIF-CABCVRRESA-N 1 1 332.791 3.501 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@@H]1c1ccccc1 ZINC000301823520 1129144969 /nfs/dbraw/zinc/14/49/69/1129144969.db2.gz CMIYZSKDHAOAIF-GJZGRUSLSA-N 1 1 332.791 3.501 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000615835118 1123883982 /nfs/dbraw/zinc/88/39/82/1123883982.db2.gz PURRORKVIFRPAP-BLSFAOBESA-N 1 1 340.427 3.741 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000069064189 1124102986 /nfs/dbraw/zinc/10/29/86/1124102986.db2.gz ISWLZJNBDZWBRC-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845873 1129194684 /nfs/dbraw/zinc/19/46/84/1129194684.db2.gz TXXGTEDYCCIEBF-MJGOQNOKSA-N 1 1 339.395 3.655 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(C)cc1OC ZINC000543427805 1129482201 /nfs/dbraw/zinc/48/22/01/1129482201.db2.gz UDWCRCHUSUTSDF-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383681 1129504340 /nfs/dbraw/zinc/50/43/40/1129504340.db2.gz CLSQHRJCGPYMRK-STQMWFEESA-N 1 1 326.824 3.764 20 5 EHBDMO O=[N+]([O-])c1cccc2c(N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)ccnc21 ZINC000389197215 1129561525 /nfs/dbraw/zinc/56/15/25/1129561525.db2.gz QIKPNDPQLXWVGY-MRXNPFEDSA-N 1 1 348.406 3.829 20 5 EHBDMO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302051570 1129765960 /nfs/dbraw/zinc/76/59/60/1129765960.db2.gz OCOCNFJNRACJEQ-NEPJUHHUSA-N 1 1 338.839 3.708 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000302207311 1129773231 /nfs/dbraw/zinc/77/32/31/1129773231.db2.gz XJHPIQVARRZXLT-CQSZACIVSA-N 1 1 328.416 3.595 20 5 EHBDMO CCC[N@@H+]1CC[C@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302207311 1129773234 /nfs/dbraw/zinc/77/32/34/1129773234.db2.gz XJHPIQVARRZXLT-CQSZACIVSA-N 1 1 328.416 3.595 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)C1 ZINC000302207311 1129773235 /nfs/dbraw/zinc/77/32/35/1129773235.db2.gz XJHPIQVARRZXLT-CQSZACIVSA-N 1 1 328.416 3.595 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226690049 1129864496 /nfs/dbraw/zinc/86/44/96/1129864496.db2.gz GLZVVTHSZLYJMZ-SWLSCSKDSA-N 1 1 346.818 3.891 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)cc1 ZINC000059406600 1129986648 /nfs/dbraw/zinc/98/66/48/1129986648.db2.gz AKWHETXMDVEIGM-LJQANCHMSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)cc1 ZINC000059406600 1129986649 /nfs/dbraw/zinc/98/66/49/1129986649.db2.gz AKWHETXMDVEIGM-LJQANCHMSA-N 1 1 344.386 3.915 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000246429302 1130380966 /nfs/dbraw/zinc/38/09/66/1130380966.db2.gz MVSOINKKYRPZFS-HNAYVOBHSA-N 1 1 342.443 3.998 20 5 EHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150030 1131693402 /nfs/dbraw/zinc/69/34/02/1131693402.db2.gz TYFOILBQSHBOSC-GOEBONIOSA-N 1 1 343.431 3.711 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000742423495 1131723654 /nfs/dbraw/zinc/72/36/54/1131723654.db2.gz VGTFBWHSXCFCHW-INIZCTEOSA-N 1 1 345.830 3.959 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](F)C(F)(F)CC1)CC2 ZINC001172907905 1131887448 /nfs/dbraw/zinc/88/74/48/1131887448.db2.gz JJPLPXJAMUCTLY-ZBFHGGJFSA-N 1 1 342.361 3.911 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1Cc3cccc(F)c3C1)CC2 ZINC001172914459 1131902339 /nfs/dbraw/zinc/90/23/39/1131902339.db2.gz GWFHBLAYHZYLJS-INIZCTEOSA-N 1 1 326.371 3.997 20 5 EHBDMO CC[NH+](CC)C1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918204 1131904698 /nfs/dbraw/zinc/90/46/98/1131904698.db2.gz YXVJFGYUSACLML-SFHVURJKSA-N 1 1 345.487 3.648 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CCc2ccccc2)c1F ZINC001173184527 1131993537 /nfs/dbraw/zinc/99/35/37/1131993537.db2.gz NPXLCFKPNODJKY-CQSZACIVSA-N 1 1 346.402 3.848 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](CC2CCCCC2)C1 ZINC001173219498 1132003007 /nfs/dbraw/zinc/00/30/07/1132003007.db2.gz COJWEAUVNCFSFX-APWZRJJASA-N 1 1 345.487 3.770 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CCCCC2)C1 ZINC001173219498 1132003014 /nfs/dbraw/zinc/00/30/14/1132003014.db2.gz COJWEAUVNCFSFX-APWZRJJASA-N 1 1 345.487 3.770 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(CC(C)(C)C)CC1 ZINC001173220910 1132004686 /nfs/dbraw/zinc/00/46/86/1132004686.db2.gz IAKBWNHUTQFSTE-OAHLLOKOSA-N 1 1 333.476 3.626 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226557 1132007055 /nfs/dbraw/zinc/00/70/55/1132007055.db2.gz KJSGJZPSVPNKMY-MJGOQNOKSA-N 1 1 345.487 3.866 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001173228542 1132008215 /nfs/dbraw/zinc/00/82/15/1132008215.db2.gz XMSPKYVQYRCTLA-HNAYVOBHSA-N 1 1 325.412 3.628 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236663 1132025927 /nfs/dbraw/zinc/02/59/27/1132025927.db2.gz DQVIUSGKYFOMKW-CQSZACIVSA-N 1 1 342.395 3.777 20 5 EHBDMO CCCCn1cc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c(C)n1 ZINC000773409403 1132472720 /nfs/dbraw/zinc/47/27/20/1132472720.db2.gz MISBSABNUQWQLC-UHFFFAOYSA-N 1 1 336.823 3.843 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009405 1132631441 /nfs/dbraw/zinc/63/14/41/1132631441.db2.gz WCMXKLXGHJCEBU-IEBWSBKVSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039023 1132638527 /nfs/dbraw/zinc/63/85/27/1132638527.db2.gz MPANHCCZJQYBLO-DGCLKSJQSA-N 1 1 328.334 3.509 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@@H](C3CCC3)C(F)(F)F)ccc([N+](=O)[O-])c2C1 ZINC001169287588 1132717536 /nfs/dbraw/zinc/71/75/36/1132717536.db2.gz LERZYSQUAVTYLD-HNNXBMFYSA-N 1 1 343.349 3.726 20 5 EHBDMO C[N@H+]1CCc2c(N[C@@H](C3CCC3)C(F)(F)F)ccc([N+](=O)[O-])c2C1 ZINC001169287588 1132717539 /nfs/dbraw/zinc/71/75/39/1132717539.db2.gz LERZYSQUAVTYLD-HNNXBMFYSA-N 1 1 343.349 3.726 20 5 EHBDMO C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C1CCCC1 ZINC001176153309 1132864618 /nfs/dbraw/zinc/86/46/18/1132864618.db2.gz DMOSAILYOOOUEK-ZDUSSCGKSA-N 1 1 337.851 3.697 20 5 EHBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936031 1133072289 /nfs/dbraw/zinc/07/22/89/1133072289.db2.gz OJGMATXFUBRMSZ-WOJBJXKFSA-N 1 1 340.423 3.725 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC001180229682 1133346655 /nfs/dbraw/zinc/34/66/55/1133346655.db2.gz QNMYCFNZWLZBAW-FQEVSTJZSA-N 1 1 340.423 3.959 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC001180229682 1133346659 /nfs/dbraw/zinc/34/66/59/1133346659.db2.gz QNMYCFNZWLZBAW-FQEVSTJZSA-N 1 1 340.423 3.959 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC001180488491 1133376592 /nfs/dbraw/zinc/37/65/92/1133376592.db2.gz PFZLJODRLJYGSY-UHFFFAOYSA-N 1 1 345.365 3.530 20 5 EHBDMO Cc1nn(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670937 1133457727 /nfs/dbraw/zinc/45/77/27/1133457727.db2.gz UUMJLEBWSMXHCG-CYBMUJFWSA-N 1 1 328.416 3.723 20 5 EHBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126797 1133810807 /nfs/dbraw/zinc/81/08/07/1133810807.db2.gz UHWRNXWMLPYYCO-ZTNFWEORSA-N 1 1 340.423 3.815 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000774764041 1133966628 /nfs/dbraw/zinc/96/66/28/1133966628.db2.gz QRRHGUPQDGZRFM-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000774877080 1134085754 /nfs/dbraw/zinc/08/57/54/1134085754.db2.gz VYKICJUBPXHKBK-CYBMUJFWSA-N 1 1 329.356 3.739 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886614 1134100514 /nfs/dbraw/zinc/10/05/14/1134100514.db2.gz WGAZCGAXJHFDSH-XJKSGUPXSA-N 1 1 341.367 3.881 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000788481274 1134130382 /nfs/dbraw/zinc/13/03/82/1134130382.db2.gz HFPCAGTVIXUVBJ-QGZVFWFLSA-N 1 1 343.402 3.835 20 5 EHBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788614604 1134151824 /nfs/dbraw/zinc/15/18/24/1134151824.db2.gz SWHALRKVKXFSRF-WDEREUQCSA-N 1 1 333.363 3.737 20 5 EHBDMO CCC1(CC)C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCS1 ZINC000775068408 1134281057 /nfs/dbraw/zinc/28/10/57/1134281057.db2.gz OELARUILANGQFJ-UHFFFAOYSA-N 1 1 339.417 3.611 20 5 EHBDMO CCC1(CC)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCS1 ZINC000775068408 1134281061 /nfs/dbraw/zinc/28/10/61/1134281061.db2.gz OELARUILANGQFJ-UHFFFAOYSA-N 1 1 339.417 3.611 20 5 EHBDMO CC(C)c1cccc2c1CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549159 1134295587 /nfs/dbraw/zinc/29/55/87/1134295587.db2.gz PRMUAJJNYVRIFI-HXUWFJFHSA-N 1 1 340.423 3.810 20 5 EHBDMO CCOc1cc(N[C@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001187081314 1134296736 /nfs/dbraw/zinc/29/67/36/1134296736.db2.gz JYHZBSPREAUCQG-HNNXBMFYSA-N 1 1 333.432 3.812 20 5 EHBDMO C[N@H+]1C[C@@H]2CC[C@@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001187913798 1134396236 /nfs/dbraw/zinc/39/62/36/1134396236.db2.gz QCYXKPKVKRNJLG-ATZCPNFKSA-N 1 1 330.215 3.654 20 5 EHBDMO CCC(CC)C[N@@H+](CC)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001190325983 1134682563 /nfs/dbraw/zinc/68/25/63/1134682563.db2.gz WBQYTTGBBFAOLX-UHFFFAOYSA-N 1 1 335.448 3.990 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352870 1134754301 /nfs/dbraw/zinc/75/43/01/1134754301.db2.gz SIFBYIAYZFONLV-ZDUSSCGKSA-N 1 1 330.384 3.792 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350550 1134760487 /nfs/dbraw/zinc/76/04/87/1134760487.db2.gz BCKOBKZPJAPXAH-KBXCAEBGSA-N 1 1 326.396 3.981 20 5 EHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192196260 1134978036 /nfs/dbraw/zinc/97/80/36/1134978036.db2.gz AZLOPFGKFAFTQW-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287104 1135407228 /nfs/dbraw/zinc/40/72/28/1135407228.db2.gz APXAMQVWRIXMFT-GDBMZVCRSA-N 1 1 348.443 3.580 20 5 EHBDMO C[C@]1(Cc2ccccc2Cl)CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC001196020270 1135506953 /nfs/dbraw/zinc/50/69/53/1135506953.db2.gz AQCKLEYBYZAAPB-QGZVFWFLSA-N 1 1 348.834 3.542 20 5 EHBDMO O=C(C[N@H+]1CCCC[C@H]1CC1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC001196330481 1135547104 /nfs/dbraw/zinc/54/71/04/1135547104.db2.gz ZEXPNZGIFAECCE-HNNXBMFYSA-N 1 1 331.416 3.578 20 5 EHBDMO CC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423211 1135551266 /nfs/dbraw/zinc/55/12/66/1135551266.db2.gz ROTMMRPKVDVILH-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO CC[N@H+]1CC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423211 1135551270 /nfs/dbraw/zinc/55/12/70/1135551270.db2.gz ROTMMRPKVDVILH-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO CCC(CC)[N@@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000808782346 1135736662 /nfs/dbraw/zinc/73/66/62/1135736662.db2.gz PBLPKLANUOURKV-UHFFFAOYSA-N 1 1 325.384 3.573 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563869 1135831016 /nfs/dbraw/zinc/83/10/16/1135831016.db2.gz TXPOPYPMTOLTCL-LSDHHAIUSA-N 1 1 338.835 3.887 20 5 EHBDMO CCc1ccc2c(c1)CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C2 ZINC001198821734 1135859548 /nfs/dbraw/zinc/85/95/48/1135859548.db2.gz VISBNPQSTOYTKR-UHFFFAOYSA-N 1 1 326.396 3.724 20 5 EHBDMO CCc1ccc2c(c1)CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C2 ZINC001198821734 1135859552 /nfs/dbraw/zinc/85/95/52/1135859552.db2.gz VISBNPQSTOYTKR-UHFFFAOYSA-N 1 1 326.396 3.724 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000809973118 1135907412 /nfs/dbraw/zinc/90/74/12/1135907412.db2.gz ITOOKFSZXQFMKL-IINYFYTJSA-N 1 1 347.242 3.885 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000811474567 1136096465 /nfs/dbraw/zinc/09/64/65/1136096465.db2.gz LVQMHQZRVZDYEH-STQMWFEESA-N 1 1 344.242 3.618 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476038 1136096553 /nfs/dbraw/zinc/09/65/53/1136096553.db2.gz WKFSFKPNLSHIIS-LLVKDONJSA-N 1 1 346.258 3.723 20 5 EHBDMO CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000850434320 1136258315 /nfs/dbraw/zinc/25/83/15/1136258315.db2.gz WXNNFDFUZXHGGU-CQSZACIVSA-N 1 1 343.427 3.910 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)cc1 ZINC000776578048 1136443540 /nfs/dbraw/zinc/44/35/40/1136443540.db2.gz CSAZXMUZXYTHMR-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO CC(C)(C)[N@H+](Cc1ccsc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000852312003 1136447908 /nfs/dbraw/zinc/44/79/08/1136447908.db2.gz RQGRNQVDTLDTAK-INIZCTEOSA-N 1 1 334.441 3.990 20 5 EHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588693 1136453193 /nfs/dbraw/zinc/45/31/93/1136453193.db2.gz NXTNMRJAGUIMAG-AZUAARDMSA-N 1 1 342.439 3.890 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593024 1136453605 /nfs/dbraw/zinc/45/36/05/1136453605.db2.gz TUKXPSXDBHFJJB-SJORKVTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593024 1136453609 /nfs/dbraw/zinc/45/36/09/1136453609.db2.gz TUKXPSXDBHFJJB-SJORKVTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000852426872 1136455525 /nfs/dbraw/zinc/45/55/25/1136455525.db2.gz PURCLXDHKAYYCH-SJLPKXTDSA-N 1 1 342.395 3.839 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H](O)C12CCCC2 ZINC000814667997 1136492473 /nfs/dbraw/zinc/49/24/73/1136492473.db2.gz VJWYIAGCPYVDTE-ZDUSSCGKSA-N 1 1 345.226 3.781 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@H](O)C12CCCC2 ZINC000814667997 1136492475 /nfs/dbraw/zinc/49/24/75/1136492475.db2.gz VJWYIAGCPYVDTE-ZDUSSCGKSA-N 1 1 345.226 3.781 20 5 EHBDMO C[C@H](OC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448823 1136597297 /nfs/dbraw/zinc/59/72/97/1136597297.db2.gz VGJNTCBBHHMVRF-KBXCAEBGSA-N 1 1 346.427 3.996 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035856 1136934222 /nfs/dbraw/zinc/93/42/22/1136934222.db2.gz LVVHUJVNYVJDLT-CABCVRRESA-N 1 1 327.384 3.513 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3cccc(F)c3)CC2)cc1F ZINC000859396491 1137013519 /nfs/dbraw/zinc/01/35/19/1137013519.db2.gz DXNCSZKTCVXCQJ-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@](C)(O)c1ccccc1 ZINC000822515552 1137064076 /nfs/dbraw/zinc/06/40/76/1137064076.db2.gz CGHJLOWZENLVKU-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@](C)(O)c1ccccc1 ZINC000822515552 1137064078 /nfs/dbraw/zinc/06/40/78/1137064078.db2.gz CGHJLOWZENLVKU-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215309 1137169130 /nfs/dbraw/zinc/16/91/30/1137169130.db2.gz LWNXIXZSRQCZDJ-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215308 1137169209 /nfs/dbraw/zinc/16/92/09/1137169209.db2.gz LWNXIXZSRQCZDJ-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO CC(C)c1ccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867943118 1137390609 /nfs/dbraw/zinc/39/06/09/1137390609.db2.gz MIXBKFQBJSLSFG-SFHVURJKSA-N 1 1 327.384 3.531 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(N2CCCC2)nc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020137 1137565147 /nfs/dbraw/zinc/56/51/47/1137565147.db2.gz DHFLPEWLXMADMP-ZDUSSCGKSA-N 1 1 344.390 3.580 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1cc(C)[nH]n1 ZINC000872049625 1137567815 /nfs/dbraw/zinc/56/78/15/1137567815.db2.gz UHWNETMYKFWAGM-CMPLNLGQSA-N 1 1 334.445 3.630 20 5 EHBDMO COc1ccc([C@@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C2CC2)cn1 ZINC000872090962 1137570821 /nfs/dbraw/zinc/57/08/21/1137570821.db2.gz GHBAGEIXHQUDTQ-VOJFVSQTSA-N 1 1 345.374 3.939 20 5 EHBDMO Cc1c(C[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000873101707 1137590119 /nfs/dbraw/zinc/59/01/19/1137590119.db2.gz HUMAKPQEWNIBOF-INIZCTEOSA-N 1 1 328.416 3.848 20 5 EHBDMO COc1cc2c(c(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])c1)O[C@H](C)C2 ZINC000873183668 1137592950 /nfs/dbraw/zinc/59/29/50/1137592950.db2.gz ZJBZAHRHZKRDHM-OLZOCXBDSA-N 1 1 342.395 3.778 20 5 EHBDMO COCCC[N@@H+](Cc1ccncc1)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877526578 1137679709 /nfs/dbraw/zinc/67/97/09/1137679709.db2.gz SRMARFPSEXOIHN-UHFFFAOYSA-N 1 1 343.427 3.645 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000880030611 1137765982 /nfs/dbraw/zinc/76/59/82/1137765982.db2.gz VIDVTROCJCJJQN-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000880030611 1137765983 /nfs/dbraw/zinc/76/59/83/1137765983.db2.gz VIDVTROCJCJJQN-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCOC1 ZINC000119753323 1137944361 /nfs/dbraw/zinc/94/43/61/1137944361.db2.gz GFEYTGFMVBCBDA-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO CCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC000885969648 1138029330 /nfs/dbraw/zinc/02/93/30/1138029330.db2.gz YYMXCEVGHXYGFR-CQSZACIVSA-N 1 1 329.400 3.972 20 5 EHBDMO CCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC000885969648 1138029331 /nfs/dbraw/zinc/02/93/31/1138029331.db2.gz YYMXCEVGHXYGFR-CQSZACIVSA-N 1 1 329.400 3.972 20 5 EHBDMO Cc1occc1C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092438426 1138228243 /nfs/dbraw/zinc/22/82/43/1138228243.db2.gz UTVIECZHQWNQKU-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC4(C3)CCCCC4)o2)cc1 ZINC000129973591 1138429886 /nfs/dbraw/zinc/42/98/86/1138429886.db2.gz CXBVZWHEVCEFLF-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337261167 1138512241 /nfs/dbraw/zinc/51/22/41/1138512241.db2.gz XSBIQZQGPMDLGV-AWEZNQCLSA-N 1 1 339.395 3.543 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccco2)on1 ZINC000338360767 1138855485 /nfs/dbraw/zinc/85/54/85/1138855485.db2.gz OYFKWTPKTGQXKG-UHFFFAOYSA-N 1 1 327.340 3.517 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccco2)on1 ZINC000338360767 1138855496 /nfs/dbraw/zinc/85/54/96/1138855496.db2.gz OYFKWTPKTGQXKG-UHFFFAOYSA-N 1 1 327.340 3.517 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000184009893 1140073878 /nfs/dbraw/zinc/07/38/78/1140073878.db2.gz YDISQABVBKCBEH-JTQLQIEISA-N 1 1 325.821 3.940 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(O)(c3ccccc3)CC2)c(Cl)c1 ZINC000185475880 1140151928 /nfs/dbraw/zinc/15/19/28/1140151928.db2.gz GKDGIMIYKTWPFK-UHFFFAOYSA-N 1 1 346.814 3.732 20 5 EHBDMO CC(C)n1cnnc1[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924391 1140738161 /nfs/dbraw/zinc/73/81/61/1140738161.db2.gz MUKRJPMPPQTOKN-GJZGRUSLSA-N 1 1 343.431 3.708 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)cc1 ZINC000267463495 1140794358 /nfs/dbraw/zinc/79/43/58/1140794358.db2.gz TVBWOBSWKPVSCE-JKSUJKDBSA-N 1 1 332.425 3.744 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000269635597 1141130028 /nfs/dbraw/zinc/13/00/28/1141130028.db2.gz HJBHHNZIJWSCTR-IRXDYDNUSA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000269635597 1141130031 /nfs/dbraw/zinc/13/00/31/1141130031.db2.gz HJBHHNZIJWSCTR-IRXDYDNUSA-N 1 1 332.787 3.729 20 5 EHBDMO CC(C)OCCC[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000271164591 1141316410 /nfs/dbraw/zinc/31/64/10/1141316410.db2.gz CBEIYXYMFIYQBO-UHFFFAOYSA-N 1 1 349.456 3.965 20 5 EHBDMO CC(C)OCCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000271164591 1141316418 /nfs/dbraw/zinc/31/64/18/1141316418.db2.gz CBEIYXYMFIYQBO-UHFFFAOYSA-N 1 1 349.456 3.965 20 5 EHBDMO Cc1ccoc1C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000430154568 1014447919 /nfs/dbraw/zinc/44/79/19/1014447919.db2.gz IFBOUGKIDKEFMU-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346963 1015073418 /nfs/dbraw/zinc/07/34/18/1015073418.db2.gz NTOQKCUDNVCIKN-HNNXBMFYSA-N 1 1 330.388 3.655 20 5 EHBDMO CCn1nc(C)c(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154283829 1015340845 /nfs/dbraw/zinc/34/08/45/1015340845.db2.gz ZBPWPWKCNWFWHT-UHFFFAOYSA-N 1 1 328.416 3.593 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154283829 1015340855 /nfs/dbraw/zinc/34/08/55/1015340855.db2.gz ZBPWPWKCNWFWHT-UHFFFAOYSA-N 1 1 328.416 3.593 20 5 EHBDMO Cc1cc(NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000311211006 1016397513 /nfs/dbraw/zinc/39/75/13/1016397513.db2.gz PCTBCYAEXHAYHY-IBGZPJMESA-N 1 1 340.427 3.622 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@@H]1c1ccc(Cl)cc1 ZINC000192515047 1032176196 /nfs/dbraw/zinc/17/61/96/1032176196.db2.gz LLIBOTIGPVRNIG-AAEUAGOBSA-N 1 1 338.820 3.562 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@@H]1c1ccc(Cl)cc1 ZINC000192515047 1032176209 /nfs/dbraw/zinc/17/62/09/1032176209.db2.gz LLIBOTIGPVRNIG-AAEUAGOBSA-N 1 1 338.820 3.562 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C(C)(C)C)no1 ZINC000449280745 1032400732 /nfs/dbraw/zinc/40/07/32/1032400732.db2.gz YIPLSXVSLUIVJF-NWDGAFQWSA-N 1 1 332.404 3.557 20 5 EHBDMO CCN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414716278 1017149425 /nfs/dbraw/zinc/14/94/25/1017149425.db2.gz NUZKJBJBJYWORT-MRXNPFEDSA-N 1 1 343.427 3.819 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]([C@H]4CCOC4)C3)o2)c1 ZINC000377237779 1017513626 /nfs/dbraw/zinc/51/36/26/1017513626.db2.gz JJAAWQQJODIPTA-HOTGVXAUSA-N 1 1 342.395 3.713 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000610281964 1017615073 /nfs/dbraw/zinc/61/50/73/1017615073.db2.gz OLFSPAKKHCNUOI-MRXNPFEDSA-N 1 1 345.830 3.959 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134946190 1017709062 /nfs/dbraw/zinc/70/90/62/1017709062.db2.gz FNOSIDDXGZQZIQ-DYVFJYSZSA-N 1 1 349.862 3.697 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000177638695 1017923619 /nfs/dbraw/zinc/92/36/19/1017923619.db2.gz IGZMJVOWAPWTFH-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000177638695 1017923630 /nfs/dbraw/zinc/92/36/30/1017923630.db2.gz IGZMJVOWAPWTFH-QGZVFWFLSA-N 1 1 329.400 3.669 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610004258 1017981985 /nfs/dbraw/zinc/98/19/85/1017981985.db2.gz IAPOYJQLJXUVSZ-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610004258 1017981995 /nfs/dbraw/zinc/98/19/95/1017981995.db2.gz IAPOYJQLJXUVSZ-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](Cc3ccccc3)C2)c1 ZINC001167332759 1018224949 /nfs/dbraw/zinc/22/49/49/1018224949.db2.gz RMFFABLLYJSPRF-GOSISDBHSA-N 1 1 340.423 3.928 20 5 EHBDMO Cc1ccnc([C@H]2CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)c1 ZINC000594004998 1032757425 /nfs/dbraw/zinc/75/74/25/1032757425.db2.gz RXIOHCKYTMGYAM-ZDUSSCGKSA-N 1 1 331.803 3.941 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072746 1032763562 /nfs/dbraw/zinc/76/35/62/1032763562.db2.gz KEAMYLBHTGPGTP-HNNXBMFYSA-N 1 1 328.416 3.821 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368004 1018536341 /nfs/dbraw/zinc/53/63/41/1018536341.db2.gz AQKGNPWQJAHLQC-ZFWWWQNUSA-N 1 1 326.400 3.634 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000137063138 1018776441 /nfs/dbraw/zinc/77/64/41/1018776441.db2.gz GGAGMRADXFUKGU-MRXNPFEDSA-N 1 1 330.384 3.980 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000137063138 1018776464 /nfs/dbraw/zinc/77/64/64/1018776464.db2.gz GGAGMRADXFUKGU-MRXNPFEDSA-N 1 1 330.384 3.980 20 5 EHBDMO C[C@@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[NH+](C)C ZINC000449556444 1032796369 /nfs/dbraw/zinc/79/63/69/1032796369.db2.gz MVOQCFBOIDPBTD-ZDUSSCGKSA-N 1 1 347.390 3.566 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000419374435 1018973059 /nfs/dbraw/zinc/97/30/59/1018973059.db2.gz PVIFARGSWNYDJN-DDHJBXDOSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000419374435 1018973073 /nfs/dbraw/zinc/97/30/73/1018973073.db2.gz PVIFARGSWNYDJN-DDHJBXDOSA-N 1 1 339.823 3.552 20 5 EHBDMO CN(c1ccsc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610431090 1019084393 /nfs/dbraw/zinc/08/43/93/1019084393.db2.gz QAYHKZROZCFXQP-OAHLLOKOSA-N 1 1 331.441 3.757 20 5 EHBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000178857584 1019131519 /nfs/dbraw/zinc/13/15/19/1019131519.db2.gz JMCVYZJBCVBKOH-IFXJQAMLSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)c2ccncc21 ZINC000433812023 1019638274 /nfs/dbraw/zinc/63/82/74/1019638274.db2.gz TXVFYFJMSZQQTE-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccc(NC(=O)[C@H]2CCCC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117778 1019884417 /nfs/dbraw/zinc/88/44/17/1019884417.db2.gz VHERSKVWRWYSJO-MRXNPFEDSA-N 1 1 331.416 3.639 20 5 EHBDMO Cc1ncc([C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000602438109 1032889307 /nfs/dbraw/zinc/88/93/07/1032889307.db2.gz AVHWEWRAZPAFMU-ZDUSSCGKSA-N 1 1 326.400 3.727 20 5 EHBDMO Cc1ncc([C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)n1 ZINC000602438109 1032889322 /nfs/dbraw/zinc/88/93/22/1032889322.db2.gz AVHWEWRAZPAFMU-ZDUSSCGKSA-N 1 1 326.400 3.727 20 5 EHBDMO CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000602448225 1032896423 /nfs/dbraw/zinc/89/64/23/1032896423.db2.gz HKIPYIJUCHUERF-GFCCVEGCSA-N 1 1 328.372 3.658 20 5 EHBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000602448225 1032896437 /nfs/dbraw/zinc/89/64/37/1032896437.db2.gz HKIPYIJUCHUERF-GFCCVEGCSA-N 1 1 328.372 3.658 20 5 EHBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602467018 1032903596 /nfs/dbraw/zinc/90/35/96/1032903596.db2.gz CKYQHVQUDZVJQF-LBPRGKRZSA-N 1 1 346.349 3.862 20 5 EHBDMO Cc1occc1C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602517452 1032928196 /nfs/dbraw/zinc/92/81/96/1032928196.db2.gz CBGOEUZPDJAGSY-UHFFFAOYSA-N 1 1 331.191 3.610 20 5 EHBDMO Cc1nc(C)c(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000602571919 1032981099 /nfs/dbraw/zinc/98/10/99/1032981099.db2.gz WKZHXFLJEXXNMI-UHFFFAOYSA-N 1 1 345.346 3.977 20 5 EHBDMO Cc1cc(CNc2ccc([N+](=O)[O-])c(C)c2)cc(N2CCCC2)[nH+]1 ZINC000519788450 1021691190 /nfs/dbraw/zinc/69/11/90/1021691190.db2.gz DUQXRJNURCRRTR-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(Cl)cc1O ZINC000602580303 1032998498 /nfs/dbraw/zinc/99/84/98/1032998498.db2.gz DBJKQRMHNCLJOU-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000891499840 1021773166 /nfs/dbraw/zinc/77/31/66/1021773166.db2.gz YUZNXAAEMGBTGB-LBPRGKRZSA-N 1 1 334.397 3.708 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000891499840 1021773182 /nfs/dbraw/zinc/77/31/82/1021773182.db2.gz YUZNXAAEMGBTGB-LBPRGKRZSA-N 1 1 334.397 3.708 20 5 EHBDMO COCCC[N@H+](Cc1ccncc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894463245 1022324815 /nfs/dbraw/zinc/32/48/15/1022324815.db2.gz VCBMOOOWEXJODE-UHFFFAOYSA-N 1 1 349.818 3.682 20 5 EHBDMO COCCC[N@@H+](Cc1ccncc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894463245 1022324832 /nfs/dbraw/zinc/32/48/32/1022324832.db2.gz VCBMOOOWEXJODE-UHFFFAOYSA-N 1 1 349.818 3.682 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C1CCC(C)(C)CC1 ZINC000438482656 1022702737 /nfs/dbraw/zinc/70/27/37/1022702737.db2.gz BJSRUNWNDSRHNT-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498571 1022727643 /nfs/dbraw/zinc/72/76/43/1022727643.db2.gz YFWBLTLOKRLXGT-JSGCOSHPSA-N 1 1 330.388 3.684 20 5 EHBDMO CCC1(CC)CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438507905 1022744718 /nfs/dbraw/zinc/74/47/18/1022744718.db2.gz LBMBGYFPYHUHHJ-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697644 1022902665 /nfs/dbraw/zinc/90/26/65/1022902665.db2.gz IEQQEGLSNQLCNF-FQEVSTJZSA-N 1 1 340.423 3.775 20 5 EHBDMO CCOc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000507189510 1023182427 /nfs/dbraw/zinc/18/24/27/1023182427.db2.gz VWJNHOCPMRRWHK-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO CCOc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000507189510 1023182431 /nfs/dbraw/zinc/18/24/31/1023182431.db2.gz VWJNHOCPMRRWHK-UHFFFAOYSA-N 1 1 329.400 3.799 20 5 EHBDMO CC1(C)C[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414974006 1023203439 /nfs/dbraw/zinc/20/34/39/1023203439.db2.gz NJWMUQGEAKZSIS-KRWDZBQOSA-N 1 1 345.468 3.801 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000546126938 1023265245 /nfs/dbraw/zinc/26/52/45/1023265245.db2.gz PUTZJQDYMLWPSE-JSGCOSHPSA-N 1 1 333.432 3.598 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)o2)c1 ZINC000535801270 1023647569 /nfs/dbraw/zinc/64/75/69/1023647569.db2.gz GFPMOJHYYBTBHI-QAPCUYQASA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000277069289 1023735178 /nfs/dbraw/zinc/73/51/78/1023735178.db2.gz RCAVQLIFWTXFEQ-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO C[N@H+](CCOc1ccccc1F)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522535370 1024061457 /nfs/dbraw/zinc/06/14/57/1024061457.db2.gz CXCSJHUYFCYKDT-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccccc1F)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522535370 1024061464 /nfs/dbraw/zinc/06/14/64/1024061464.db2.gz CXCSJHUYFCYKDT-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857292 1033211291 /nfs/dbraw/zinc/21/12/91/1033211291.db2.gz UGKWJRSKOPWQEH-KRWDZBQOSA-N 1 1 341.411 3.768 20 5 EHBDMO Cc1noc(C[NH+]2CCC3(CC2)c2ccccc2N=C3C)c1[N+](=O)[O-] ZINC000602861975 1033214408 /nfs/dbraw/zinc/21/44/08/1033214408.db2.gz JVODCARYROPIGC-UHFFFAOYSA-N 1 1 340.383 3.531 20 5 EHBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319061 1024618715 /nfs/dbraw/zinc/61/87/15/1024618715.db2.gz DGJNAZASLOLAEC-ZDUSSCGKSA-N 1 1 346.383 3.628 20 5 EHBDMO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383927376 1024634194 /nfs/dbraw/zinc/63/41/94/1024634194.db2.gz RZLKOBUNVLYCMS-RDJZCZTQSA-N 1 1 325.412 3.917 20 5 EHBDMO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000430132981 1024665302 /nfs/dbraw/zinc/66/53/02/1024665302.db2.gz DKTGVSHXAIZFJH-STQMWFEESA-N 1 1 332.425 3.669 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)s2)cc1 ZINC000895785649 1024830531 /nfs/dbraw/zinc/83/05/31/1024830531.db2.gz ZUKMGJDZOAPXOS-XOKHGSTOSA-N 1 1 344.436 3.526 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H](C)CO1 ZINC000508017251 1024846049 /nfs/dbraw/zinc/84/60/49/1024846049.db2.gz SYVNJKOIOGYZML-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H](C)CO1 ZINC000508017251 1024846073 /nfs/dbraw/zinc/84/60/73/1024846073.db2.gz SYVNJKOIOGYZML-CHWSQXEVSA-N 1 1 332.425 3.933 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000281308151 1024873906 /nfs/dbraw/zinc/87/39/06/1024873906.db2.gz HUSLGUPQFZAQQS-KRWDZBQOSA-N 1 1 337.419 3.947 20 5 EHBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000611322286 1025087535 /nfs/dbraw/zinc/08/75/35/1025087535.db2.gz IQTARADSKNIRTJ-DZGCQCFKSA-N 1 1 334.416 3.567 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)O1 ZINC000435769513 1025129838 /nfs/dbraw/zinc/12/98/38/1025129838.db2.gz WUBPCXGAUNKJBQ-BETUJISGSA-N 1 1 332.425 3.933 20 5 EHBDMO COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000521221372 1025280585 /nfs/dbraw/zinc/28/05/85/1025280585.db2.gz AQSBFJCMRHZKGP-INIZCTEOSA-N 1 1 344.411 3.683 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510213 1025304510 /nfs/dbraw/zinc/30/45/10/1025304510.db2.gz HLSZEEKUGVNTGR-QGZVFWFLSA-N 1 1 344.386 3.950 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000438996703 1025381933 /nfs/dbraw/zinc/38/19/33/1025381933.db2.gz PPOLSGIVJKGAMM-FDQGKXFDSA-N 1 1 336.407 3.640 20 5 EHBDMO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000436311837 1025575304 /nfs/dbraw/zinc/57/53/04/1025575304.db2.gz XVIUJYGWTNQQBW-QWRGUYRKSA-N 1 1 346.353 3.683 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C(C)(C)C)CC1 ZINC000530361421 1025704963 /nfs/dbraw/zinc/70/49/63/1025704963.db2.gz JSYZERUPSXOKIB-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425557011 1025725622 /nfs/dbraw/zinc/72/56/22/1025725622.db2.gz VNOWHFQQZBIYKM-KBXCAEBGSA-N 1 1 330.428 3.937 20 5 EHBDMO Cc1ccccc1[C@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053279182 1025727553 /nfs/dbraw/zinc/72/75/53/1025727553.db2.gz JEPCSVMXSAPOBQ-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053279182 1025727574 /nfs/dbraw/zinc/72/75/74/1025727574.db2.gz JEPCSVMXSAPOBQ-QGZVFWFLSA-N 1 1 339.395 3.679 20 5 EHBDMO C[N@@H+]1CCCC[C@@H]1CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099255 /nfs/dbraw/zinc/09/92/55/1026099255.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 1 1 331.460 3.649 20 5 EHBDMO C[N@H+]1CCCC[C@@H]1CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099276 /nfs/dbraw/zinc/09/92/76/1026099276.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@@H]1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099293 /nfs/dbraw/zinc/09/92/93/1026099293.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@@H]1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099308 /nfs/dbraw/zinc/09/93/08/1026099308.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 1 1 331.460 3.649 20 5 EHBDMO COc1ccccc1CCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127892 1026280913 /nfs/dbraw/zinc/28/09/13/1026280913.db2.gz XRENYHWZXLPIGB-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO Cc1ccccc1C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000023816699 1026587315 /nfs/dbraw/zinc/58/73/15/1026587315.db2.gz YNOJFNBPCJWBCJ-UHFFFAOYSA-N 1 1 338.367 3.585 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000023816699 1026587325 /nfs/dbraw/zinc/58/73/25/1026587325.db2.gz YNOJFNBPCJWBCJ-UHFFFAOYSA-N 1 1 338.367 3.585 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542699 1026841498 /nfs/dbraw/zinc/84/14/98/1026841498.db2.gz IDABGWASBRMWFE-QGZVFWFLSA-N 1 1 347.459 3.568 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000277845604 1027249714 /nfs/dbraw/zinc/24/97/14/1027249714.db2.gz SMMASRNHWLXDDK-YWPYICTPSA-N 1 1 346.349 3.599 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1O ZINC000459289159 1027312817 /nfs/dbraw/zinc/31/28/17/1027312817.db2.gz BCIBDQUFZFEQQJ-UHFFFAOYSA-N 1 1 342.395 3.864 20 5 EHBDMO CCOc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000459292498 1027336072 /nfs/dbraw/zinc/33/60/72/1027336072.db2.gz FAGJMAGYSLTMRL-UHFFFAOYSA-N 1 1 342.395 3.864 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000475556006 1027596698 /nfs/dbraw/zinc/59/66/98/1027596698.db2.gz ZRJJDNKSXBPNMV-LSDHHAIUSA-N 1 1 348.447 3.596 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420951912 1027917017 /nfs/dbraw/zinc/91/70/17/1027917017.db2.gz RIZWGNORHYERGG-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000444774559 1028263289 /nfs/dbraw/zinc/26/32/89/1028263289.db2.gz JOTANCZXHJUJEX-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO Cn1cc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(-c2ccccc2)n1 ZINC000342943239 1028277830 /nfs/dbraw/zinc/27/78/30/1028277830.db2.gz PDDLNHFZFQECAG-UHFFFAOYSA-N 1 1 348.406 3.554 20 5 EHBDMO Cn1cc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(-c2ccccc2)n1 ZINC000342943239 1028277843 /nfs/dbraw/zinc/27/78/43/1028277843.db2.gz PDDLNHFZFQECAG-UHFFFAOYSA-N 1 1 348.406 3.554 20 5 EHBDMO CCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(C)O ZINC000513751074 1028550093 /nfs/dbraw/zinc/55/00/93/1028550093.db2.gz VZAHEROHLYXVSC-UHFFFAOYSA-N 1 1 332.400 3.838 20 5 EHBDMO C[N@@H+](CCCCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CC1 ZINC000583029556 1028592813 /nfs/dbraw/zinc/59/28/13/1028592813.db2.gz UVGVCLYAVUVATF-OAHLLOKOSA-N 1 1 345.365 3.662 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926343 1029072819 /nfs/dbraw/zinc/07/28/19/1029072819.db2.gz IFXOJFJNEITEKA-XHSDSOJGSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926343 1029072838 /nfs/dbraw/zinc/07/28/38/1029072838.db2.gz IFXOJFJNEITEKA-XHSDSOJGSA-N 1 1 349.475 3.765 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC2(CCCC2)C1 ZINC000445850243 1029187168 /nfs/dbraw/zinc/18/71/68/1029187168.db2.gz RPOHDJODEDWZQV-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc4ccccc4c4cccnc34)[C@@H]2C1 ZINC000425061020 1029512679 /nfs/dbraw/zinc/51/26/79/1029512679.db2.gz XKMRKHGZBGOBFE-OXJNMPFZSA-N 1 1 345.446 3.554 20 5 EHBDMO O=[N+]([O-])c1cnc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000192453159 1029667023 /nfs/dbraw/zinc/66/70/23/1029667023.db2.gz KPBKPPYFHVCSFN-GOOCMWNKSA-N 1 1 344.440 3.659 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+](C[C@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686681 1029765052 /nfs/dbraw/zinc/76/50/52/1029765052.db2.gz RQFZJGJQUVCAEM-CQSZACIVSA-N 1 1 340.370 3.797 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686681 1029765059 /nfs/dbraw/zinc/76/50/59/1029765059.db2.gz RQFZJGJQUVCAEM-CQSZACIVSA-N 1 1 340.370 3.797 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc(Br)n1)c1cccc([N+](=O)[O-])c1 ZINC000161734795 1029897261 /nfs/dbraw/zinc/89/72/61/1029897261.db2.gz ZAKHXKZOOXRAHZ-SNVBAGLBSA-N 1 1 336.189 3.603 20 5 EHBDMO C[C@@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1C ZINC000537626540 1029903606 /nfs/dbraw/zinc/90/36/06/1029903606.db2.gz WSZYTMWERBGAOR-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1C ZINC000537626540 1029903622 /nfs/dbraw/zinc/90/36/22/1029903622.db2.gz WSZYTMWERBGAOR-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000159410757 1030178286 /nfs/dbraw/zinc/17/82/86/1030178286.db2.gz NDNRVXJOIFWZPT-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO Cc1ccsc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042473764 1030625437 /nfs/dbraw/zinc/62/54/37/1030625437.db2.gz JVQCVARDIKZGLN-ZDUSSCGKSA-N 1 1 347.440 3.732 20 5 EHBDMO Cc1ccsc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042473764 1030625443 /nfs/dbraw/zinc/62/54/43/1030625443.db2.gz JVQCVARDIKZGLN-ZDUSSCGKSA-N 1 1 347.440 3.732 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CNCCC[NH+]3CCCC3)s2)cc1 ZINC000237988488 1030710631 /nfs/dbraw/zinc/71/06/31/1030710631.db2.gz YGDIJWMBYUBPMY-UHFFFAOYSA-N 1 1 345.468 3.899 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026194047 1030926501 /nfs/dbraw/zinc/92/65/01/1030926501.db2.gz UVVXJPRAUBQADY-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026194047 1030926511 /nfs/dbraw/zinc/92/65/11/1030926511.db2.gz UVVXJPRAUBQADY-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCC[C@@H]1O ZINC000537687565 1030981485 /nfs/dbraw/zinc/98/14/85/1030981485.db2.gz HYTDQOLQYIBJPM-PBHICJAKSA-N 1 1 346.452 3.916 20 5 EHBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360661 1030985439 /nfs/dbraw/zinc/98/54/39/1030985439.db2.gz CORVCHKFCXLNDS-RHSMWYFYSA-N 1 1 344.411 3.980 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000537695046 1031082390 /nfs/dbraw/zinc/08/23/90/1031082390.db2.gz WKPYBIAGIZHFQK-MLGOLLRUSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000032801167 1031375584 /nfs/dbraw/zinc/37/55/84/1031375584.db2.gz YHGWVTSDARVQOK-RYUDHWBXSA-N 1 1 347.802 3.926 20 5 EHBDMO Cc1c(NC(=O)NC[C@H]2CCCC[N@@H+]2CC(C)C)cccc1[N+](=O)[O-] ZINC000483874487 1031386640 /nfs/dbraw/zinc/38/66/40/1031386640.db2.gz VNQRSFRJJZENTI-OAHLLOKOSA-N 1 1 348.447 3.535 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071952 1033325179 /nfs/dbraw/zinc/32/51/79/1033325179.db2.gz VNRSXUGSAJGJDY-LYKUJDHUSA-N 1 1 329.425 3.629 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccs1 ZINC000063482990 1033389681 /nfs/dbraw/zinc/38/96/81/1033389681.db2.gz RRUCEJHFEVXLRK-UHFFFAOYSA-N 1 1 347.440 3.815 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1COc2c1cccc2Cl ZINC000594497517 1033399084 /nfs/dbraw/zinc/39/90/84/1033399084.db2.gz CTYIGAYUEXHJTP-HUUCEWRRSA-N 1 1 330.771 3.959 20 5 EHBDMO Cc1nn(C[N@H+](C)C[C@@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291553 1033549630 /nfs/dbraw/zinc/54/96/30/1033549630.db2.gz UTPPTUHRNUMZQV-CQSZACIVSA-N 1 1 338.411 3.946 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccnc(SC)c1 ZINC000595013032 1033607475 /nfs/dbraw/zinc/60/74/75/1033607475.db2.gz FYAMUDBENSKKTF-LLVKDONJSA-N 1 1 333.413 3.571 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](c1ccccc1)[NH+](C)C ZINC000595003160 1033628586 /nfs/dbraw/zinc/62/85/86/1033628586.db2.gz FKWJXWFHEUCCAW-KBXCAEBGSA-N 1 1 343.427 3.557 20 5 EHBDMO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289230 1033718820 /nfs/dbraw/zinc/71/88/20/1033718820.db2.gz QXNXYWAKZOZDOE-UHFFFAOYSA-N 1 1 348.374 3.773 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289230 1033718837 /nfs/dbraw/zinc/71/88/37/1033718837.db2.gz QXNXYWAKZOZDOE-UHFFFAOYSA-N 1 1 348.374 3.773 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595340899 1033732235 /nfs/dbraw/zinc/73/22/35/1033732235.db2.gz YNGPCEUNNPKQLO-SFHVURJKSA-N 1 1 329.400 3.736 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)C1 ZINC000046934147 1033894792 /nfs/dbraw/zinc/89/47/92/1033894792.db2.gz YTTKYRGZUUVAED-CYBMUJFWSA-N 1 1 343.383 3.672 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC2(CCCCC2)CC1 ZINC000608833362 1033907518 /nfs/dbraw/zinc/90/75/18/1033907518.db2.gz RCOZLUPNGGBXJY-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)cc1 ZINC000603855033 1033980301 /nfs/dbraw/zinc/98/03/01/1033980301.db2.gz ZYTDPNPREXZJHD-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO COc1ccccc1C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000603857625 1033981148 /nfs/dbraw/zinc/98/11/48/1033981148.db2.gz IBBOZIUMYYYUDH-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856398 1034010144 /nfs/dbraw/zinc/01/01/44/1034010144.db2.gz BWGNLJJOSXVNAC-AHBJDQSVSA-N 1 1 342.399 3.969 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092477 1034079522 /nfs/dbraw/zinc/07/95/22/1034079522.db2.gz ANXVASDKIBDLBR-OXQOHEQNSA-N 1 1 343.471 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092477 1034079533 /nfs/dbraw/zinc/07/95/33/1034079533.db2.gz ANXVASDKIBDLBR-OXQOHEQNSA-N 1 1 343.471 3.684 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688046 1034115772 /nfs/dbraw/zinc/11/57/72/1034115772.db2.gz BNGUZGQGSJRJAW-HSWBROFVSA-N 1 1 342.399 3.823 20 5 EHBDMO CN(c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000596231515 1034130043 /nfs/dbraw/zinc/13/00/43/1034130043.db2.gz KGRBSPAWLPWZGL-QYJAPNMZSA-N 1 1 343.349 3.675 20 5 EHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000604013397 1034137557 /nfs/dbraw/zinc/13/75/57/1034137557.db2.gz GVUAEQNJDHJTRQ-UHFFFAOYSA-N 1 1 344.411 3.894 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596307890 1034163818 /nfs/dbraw/zinc/16/38/18/1034163818.db2.gz QDUZMCHGAHCXLB-ZDUSSCGKSA-N 1 1 333.432 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596569740 1034292260 /nfs/dbraw/zinc/29/22/60/1034292260.db2.gz DMABIKMGFMDNKH-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO C[C@H](NC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413040 1034298608 /nfs/dbraw/zinc/29/86/08/1034298608.db2.gz SKMDWINSCADWGZ-KSSFIOAISA-N 1 1 345.443 3.569 20 5 EHBDMO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCC[C@@H](C)C1 ZINC000229718874 1034370665 /nfs/dbraw/zinc/37/06/65/1034370665.db2.gz PYRIPQLZTJNOGG-VXGBXAGGSA-N 1 1 334.445 3.737 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174577 1034378431 /nfs/dbraw/zinc/37/84/31/1034378431.db2.gz IUNWSAUQCFZRMA-CZUORRHYSA-N 1 1 330.359 3.948 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435881 1034379272 /nfs/dbraw/zinc/37/92/72/1034379272.db2.gz CJFQXNNXBGLRGE-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(NC(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000054355513 1034410833 /nfs/dbraw/zinc/41/08/33/1034410833.db2.gz QHPOIARBYBJAJR-CYBMUJFWSA-N 1 1 348.447 3.535 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000597225036 1034625217 /nfs/dbraw/zinc/62/52/17/1034625217.db2.gz LXIGQLRSVOSRPP-MGFNVVHASA-N 1 1 330.428 3.889 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000177148083 1034697264 /nfs/dbraw/zinc/69/72/64/1034697264.db2.gz ABBLYWBAWVSBJK-SFHVURJKSA-N 1 1 344.386 3.568 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](Oc3cccc(Cl)c3)C2)cs1 ZINC000534657341 1034777201 /nfs/dbraw/zinc/77/72/01/1034777201.db2.gz XSMOCWVXSHEFNG-CQSZACIVSA-N 1 1 338.816 3.963 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Oc3cccc(Cl)c3)C2)cs1 ZINC000534657341 1034777212 /nfs/dbraw/zinc/77/72/12/1034777212.db2.gz XSMOCWVXSHEFNG-CQSZACIVSA-N 1 1 338.816 3.963 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007156 1035024758 /nfs/dbraw/zinc/02/47/58/1035024758.db2.gz SQDBNSHQAHRVLN-QGZVFWFLSA-N 1 1 341.411 3.768 20 5 EHBDMO COCC[N@H+](CCCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000065958714 1035031429 /nfs/dbraw/zinc/03/14/29/1035031429.db2.gz AHTMUBJKBWKMDK-UHFFFAOYSA-N 1 1 334.441 3.738 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000065958714 1035031439 /nfs/dbraw/zinc/03/14/39/1035031439.db2.gz AHTMUBJKBWKMDK-UHFFFAOYSA-N 1 1 334.441 3.738 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000412001749 1035269773 /nfs/dbraw/zinc/26/97/73/1035269773.db2.gz QZQJEBMFOIQPQV-IBGZPJMESA-N 1 1 338.407 3.949 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000412001749 1035269780 /nfs/dbraw/zinc/26/97/80/1035269780.db2.gz QZQJEBMFOIQPQV-IBGZPJMESA-N 1 1 338.407 3.949 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCCCCCC1 ZINC000003538922 1035397481 /nfs/dbraw/zinc/39/74/81/1035397481.db2.gz SOLMLAAQCPSESB-GFCCVEGCSA-N 1 1 339.823 3.841 20 5 EHBDMO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655304 1035446498 /nfs/dbraw/zinc/44/64/98/1035446498.db2.gz FFNWWEVGUCISAO-SFHVURJKSA-N 1 1 340.427 3.616 20 5 EHBDMO CC(C)C[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000467181740 1035486305 /nfs/dbraw/zinc/48/63/05/1035486305.db2.gz PTGUTZNAVJMZCD-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000467181740 1035486310 /nfs/dbraw/zinc/48/63/10/1035486310.db2.gz PTGUTZNAVJMZCD-LBPRGKRZSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129240 1035594646 /nfs/dbraw/zinc/59/46/46/1035594646.db2.gz OKVNABLJFOSDOT-INIZCTEOSA-N 1 1 339.439 3.910 20 5 EHBDMO CC[N@@H+](CCc1cccs1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463517940 1035596159 /nfs/dbraw/zinc/59/61/59/1035596159.db2.gz ZOVXGQUFBMMQHI-UHFFFAOYSA-N 1 1 338.404 3.869 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1 ZINC000540906904 1035787171 /nfs/dbraw/zinc/78/71/71/1035787171.db2.gz AJWCMXNXBDGEAW-HOTGVXAUSA-N 1 1 347.459 3.694 20 5 EHBDMO CCOc1cc(C[N@@H+](C)C2Cc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000492460276 1035843323 /nfs/dbraw/zinc/84/33/23/1035843323.db2.gz IHRZVKNBNYJMRJ-UHFFFAOYSA-N 1 1 326.396 3.593 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492510719 1035921239 /nfs/dbraw/zinc/92/12/39/1035921239.db2.gz HYUZUTOLYGEGJX-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cccc1[N+](=O)[O-] ZINC000535091575 1036016531 /nfs/dbraw/zinc/01/65/31/1036016531.db2.gz FYFVCLQVJAQYRW-FQEVSTJZSA-N 1 1 340.423 3.676 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687389 1036246258 /nfs/dbraw/zinc/24/62/58/1036246258.db2.gz JCIPZARFMLWMOV-KXBFYZLASA-N 1 1 328.412 3.938 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)c(F)c1 ZINC000589196622 1036303478 /nfs/dbraw/zinc/30/34/78/1036303478.db2.gz OWDRHDCWAMOIBM-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO CC1(C)CCC[N@H+]1CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572652669 1036448001 /nfs/dbraw/zinc/44/80/01/1036448001.db2.gz ZLRXOYDDGHDSML-CQSZACIVSA-N 1 1 345.365 3.662 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000589519801 1036489034 /nfs/dbraw/zinc/48/90/34/1036489034.db2.gz ANUWUELLRUGZPY-SDSFWRRZSA-N 1 1 346.818 3.795 20 5 EHBDMO CC(C)[N@@H+](C)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180394284 1036771090 /nfs/dbraw/zinc/77/10/90/1036771090.db2.gz MVMNGRUFWJNPHU-LJQANCHMSA-N 1 1 327.428 3.614 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2CCCc2ccccc2)n1 ZINC000443637417 1036913103 /nfs/dbraw/zinc/91/31/03/1036913103.db2.gz IYBLFRPPGGQMPV-SFHVURJKSA-N 1 1 342.443 3.669 20 5 EHBDMO CCC[C@@]1(C)CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000464858622 1036913407 /nfs/dbraw/zinc/91/34/07/1036913407.db2.gz XEQWPHIVBAENHQ-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000464858622 1036913419 /nfs/dbraw/zinc/91/34/19/1036913419.db2.gz XEQWPHIVBAENHQ-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000249777560 1036924272 /nfs/dbraw/zinc/92/42/72/1036924272.db2.gz CJIMKUAUUMBZER-MLGOLLRUSA-N 1 1 332.425 3.526 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000595042565 1037210377 /nfs/dbraw/zinc/21/03/77/1037210377.db2.gz AMMSCGCNPPPKCZ-SJCJKPOMSA-N 1 1 328.368 3.526 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C2CCC2)C1 ZINC000591061790 1037223693 /nfs/dbraw/zinc/22/36/93/1037223693.db2.gz IJRZIFUAFMCBLT-WFASDCNBSA-N 1 1 342.399 3.828 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@@H]3C3CC3)s2)cc1 ZINC000539818357 1037239945 /nfs/dbraw/zinc/23/99/45/1037239945.db2.gz XEPAFFHOCNSBKM-QGZVFWFLSA-N 1 1 344.436 3.934 20 5 EHBDMO CC(C)c1ccc(CN2CCCC23CC[NH+](C)CC3)cc1[N+](=O)[O-] ZINC000472612860 1037377200 /nfs/dbraw/zinc/37/72/00/1037377200.db2.gz QRNVJKPXELICTK-UHFFFAOYSA-N 1 1 331.460 3.778 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1cccs1)C(C)C ZINC000532483752 1037521842 /nfs/dbraw/zinc/52/18/42/1037521842.db2.gz WTLANZUMFUMJTA-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1cccs1)C(C)C ZINC000532483752 1037521855 /nfs/dbraw/zinc/52/18/55/1037521855.db2.gz WTLANZUMFUMJTA-UHFFFAOYSA-N 1 1 347.440 3.814 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462921742 1037563064 /nfs/dbraw/zinc/56/30/64/1037563064.db2.gz JERSJMKSUIRRMG-GFCCVEGCSA-N 1 1 343.374 3.873 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000532553302 1037609262 /nfs/dbraw/zinc/60/92/62/1037609262.db2.gz YRQVJPCGSZUNOF-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO CC[N@@H+](CCSC)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000592202977 1037946655 /nfs/dbraw/zinc/94/66/55/1037946655.db2.gz UHLIKGPNPAROJF-UHFFFAOYSA-N 1 1 333.251 3.542 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000595324878 1038004289 /nfs/dbraw/zinc/00/42/89/1038004289.db2.gz CIORXQOOXNPBKT-MRXNPFEDSA-N 1 1 344.386 3.773 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592529434 1038028639 /nfs/dbraw/zinc/02/86/39/1038028639.db2.gz ZIRDBJVHHPMVQO-KMPOOHAWSA-N 1 1 330.428 3.889 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000470171217 1038408904 /nfs/dbraw/zinc/40/89/04/1038408904.db2.gz GXTDTUNWXKRLPH-ZSOIEALJSA-N 1 1 340.379 3.859 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000378632456 1038796222 /nfs/dbraw/zinc/79/62/22/1038796222.db2.gz KEYNUPZZXPQNHE-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO C[C@H](NCCC[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253206 1039340535 /nfs/dbraw/zinc/34/05/35/1039340535.db2.gz VHPBZYMNWBXPRN-INIZCTEOSA-N 1 1 339.439 3.694 20 5 EHBDMO C[C@H](NCCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253206 1039340552 /nfs/dbraw/zinc/34/05/52/1039340552.db2.gz VHPBZYMNWBXPRN-INIZCTEOSA-N 1 1 339.439 3.694 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)c1 ZINC000500773264 1039463370 /nfs/dbraw/zinc/46/33/70/1039463370.db2.gz KPFJWTLUILEWLD-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cc(C[N@H+](Cc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485739821 1039492420 /nfs/dbraw/zinc/49/24/20/1039492420.db2.gz UCNVBTATANNUIW-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO COc1cc(C[N@@H+](Cc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485739821 1039492424 /nfs/dbraw/zinc/49/24/24/1039492424.db2.gz UCNVBTATANNUIW-UHFFFAOYSA-N 1 1 330.359 3.907 20 5 EHBDMO Cc1c(C[NH2+]Cc2nc3cc(Cl)ccc3n2C)cccc1[N+](=O)[O-] ZINC000480490189 1039597414 /nfs/dbraw/zinc/59/74/14/1039597414.db2.gz ZCPJLQGGOMWAKL-UHFFFAOYSA-N 1 1 344.802 3.733 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCOc2ccccc2)ccc1[N+](=O)[O-] ZINC000485819673 1039598985 /nfs/dbraw/zinc/59/89/85/1039598985.db2.gz VLQFTRDWXCWGJG-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CCn1ccnc1[C@@H](C)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349283 1039699497 /nfs/dbraw/zinc/69/94/97/1039699497.db2.gz KOAYLJNKVCKFEV-DYVFJYSZSA-N 1 1 328.416 3.930 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](CCO)c1ccco1)CCCC2 ZINC000417345686 1039709113 /nfs/dbraw/zinc/70/91/13/1039709113.db2.gz SEZWJDNCEDSATM-IAGOWNOFSA-N 1 1 330.384 3.669 20 5 EHBDMO Cc1noc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc12 ZINC000893946351 1039869131 /nfs/dbraw/zinc/86/91/31/1039869131.db2.gz ZBIXCAUJSABHSP-UHFFFAOYSA-N 1 1 340.383 3.850 20 5 EHBDMO Cc1noc2ncc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cc12 ZINC000893945929 1039870949 /nfs/dbraw/zinc/87/09/49/1039870949.db2.gz OANMYAWMHBTHBD-UHFFFAOYSA-N 1 1 338.367 3.604 20 5 EHBDMO Cc1noc2ncc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cc12 ZINC000893945929 1039870966 /nfs/dbraw/zinc/87/09/66/1039870966.db2.gz OANMYAWMHBTHBD-UHFFFAOYSA-N 1 1 338.367 3.604 20 5 EHBDMO CCc1ccc([C@H](COC)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])o1 ZINC000573741483 1040214464 /nfs/dbraw/zinc/21/44/64/1040214464.db2.gz IXNNUZQCZWBIEN-HOTGVXAUSA-N 1 1 330.384 3.715 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000489883375 1040220387 /nfs/dbraw/zinc/22/03/87/1040220387.db2.gz OKQHLCBZNWZKSH-ZDUSSCGKSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000489883375 1040220401 /nfs/dbraw/zinc/22/04/01/1040220401.db2.gz OKQHLCBZNWZKSH-ZDUSSCGKSA-N 1 1 340.358 3.600 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128286715 1040284974 /nfs/dbraw/zinc/28/49/74/1040284974.db2.gz BAXAMESXXUOEJA-OLZOCXBDSA-N 1 1 337.395 3.573 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787131 1040444213 /nfs/dbraw/zinc/44/42/13/1040444213.db2.gz HEDIZDDHMCMDDG-PBHICJAKSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804450 1040472468 /nfs/dbraw/zinc/47/24/68/1040472468.db2.gz YQTBZWDQIKKDOP-SUMWQHHRSA-N 1 1 333.432 3.742 20 5 EHBDMO Cn1cc(C[N@H+]2CCCC3(CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600216440 1040860331 /nfs/dbraw/zinc/86/03/31/1040860331.db2.gz ZVZNQGYPISRPSF-UHFFFAOYSA-N 1 1 340.427 3.761 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022886 1040868339 /nfs/dbraw/zinc/86/83/39/1040868339.db2.gz QDAMCVZUECETNM-FXAWDEMLSA-N 1 1 337.423 3.511 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000491022886 1040868353 /nfs/dbraw/zinc/86/83/53/1040868353.db2.gz QDAMCVZUECETNM-FXAWDEMLSA-N 1 1 337.423 3.511 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000054981072 1041090879 /nfs/dbraw/zinc/09/08/79/1041090879.db2.gz KEYUIKSVPRIXEO-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(=O)c1cc(NCCCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000341520194 1041213542 /nfs/dbraw/zinc/21/35/42/1041213542.db2.gz ACZOJNISNHTZQC-CQSZACIVSA-N 1 1 333.432 3.721 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854518 1041236391 /nfs/dbraw/zinc/23/63/91/1041236391.db2.gz QCVNWMDOXGJSKO-AWEZNQCLSA-N 1 1 342.395 3.697 20 5 EHBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854650 1041246510 /nfs/dbraw/zinc/24/65/10/1041246510.db2.gz GJHRWOUHORNMFS-HNNXBMFYSA-N 1 1 341.411 3.659 20 5 EHBDMO C[C@@H]([NH3+])C[C@@H](C)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593641 1041366940 /nfs/dbraw/zinc/36/69/40/1041366940.db2.gz KIRTVSKWOUTVJY-CHWSQXEVSA-N 1 1 347.390 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000108086122 1042004880 /nfs/dbraw/zinc/00/48/80/1042004880.db2.gz GUHLIAGHEAMTPI-QGZVFWFLSA-N 1 1 346.452 3.880 20 5 EHBDMO CCCO[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000108392797 1042046446 /nfs/dbraw/zinc/04/64/46/1042046446.db2.gz WXGBAZRQQNUKMO-QGZVFWFLSA-N 1 1 336.432 3.645 20 5 EHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820816 1042907061 /nfs/dbraw/zinc/90/70/61/1042907061.db2.gz WUSMMBICVPLTBQ-IAGOWNOFSA-N 1 1 336.432 3.716 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCCCC[C@@H]3CCO)o2)c1 ZINC000585767888 1043030250 /nfs/dbraw/zinc/03/02/50/1043030250.db2.gz XQHFCCFJTCYKMB-MRXNPFEDSA-N 1 1 344.411 3.982 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344212991 1043438428 /nfs/dbraw/zinc/43/84/28/1043438428.db2.gz NZXDTOSLAFSCEE-CYBMUJFWSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898519 1043598028 /nfs/dbraw/zinc/59/80/28/1043598028.db2.gz YMKUBPLKMLTKQD-KSSFIOAISA-N 1 1 328.416 3.926 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279259957 1043667293 /nfs/dbraw/zinc/66/72/93/1043667293.db2.gz MAQMXLSQKHEHSX-LBPRGKRZSA-N 1 1 333.413 3.577 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000183370829 1125545415 /nfs/dbraw/zinc/54/54/15/1125545415.db2.gz PUEUHYLRAIGBCX-SFHVURJKSA-N 1 1 340.423 3.942 20 5 EHBDMO O=[N+]([O-])c1ccc(CNC[C@@H](c2ccco2)[NH+]2CCCC2)c(Cl)c1 ZINC000183383813 1125549274 /nfs/dbraw/zinc/54/92/74/1125549274.db2.gz MPEBUPLQKHZRRO-INIZCTEOSA-N 1 1 349.818 3.768 20 5 EHBDMO CN1CCN(CCC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000072786139 1126881940 /nfs/dbraw/zinc/88/19/40/1126881940.db2.gz BTJPCNXTDLFKHH-UHFFFAOYSA-N 1 1 347.506 3.720 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185856072 1127163261 /nfs/dbraw/zinc/16/32/61/1127163261.db2.gz SSJGJWBGBZIDIQ-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000282220540 1128097726 /nfs/dbraw/zinc/09/77/26/1128097726.db2.gz HYNJQAUBNSDKQW-CZUORRHYSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cc(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000273031456 1128433690 /nfs/dbraw/zinc/43/36/90/1128433690.db2.gz ULUQQYMTPBQBEA-AWEZNQCLSA-N 1 1 328.416 3.875 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c2ccncc21 ZINC000301465043 1128437212 /nfs/dbraw/zinc/43/72/12/1128437212.db2.gz LGLPTVZJCAMYPQ-OAHLLOKOSA-N 1 1 340.427 3.819 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000301581784 1128500567 /nfs/dbraw/zinc/50/05/67/1128500567.db2.gz PRELDAMHWFKVFH-WFASDCNBSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000301581784 1128500569 /nfs/dbraw/zinc/50/05/69/1128500569.db2.gz PRELDAMHWFKVFH-WFASDCNBSA-N 1 1 345.424 3.820 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000542704095 1128547480 /nfs/dbraw/zinc/54/74/80/1128547480.db2.gz RRCCQHGRBXKUFV-LJQANCHMSA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000542704095 1128547483 /nfs/dbraw/zinc/54/74/83/1128547483.db2.gz RRCCQHGRBXKUFV-LJQANCHMSA-N 1 1 326.396 3.651 20 5 EHBDMO C[N@@H+]1CCc2c(N[C@@H]3CCNc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001168648461 1128638920 /nfs/dbraw/zinc/63/89/20/1128638920.db2.gz IYSJMFALUAUTBO-GOSISDBHSA-N 1 1 338.411 3.552 20 5 EHBDMO C[N@H+]1CCc2c(N[C@@H]3CCNc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001168648461 1128638921 /nfs/dbraw/zinc/63/89/21/1128638921.db2.gz IYSJMFALUAUTBO-GOSISDBHSA-N 1 1 338.411 3.552 20 5 EHBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCC[C@H](C)C1 ZINC000252132112 1120423896 /nfs/dbraw/zinc/42/38/96/1120423896.db2.gz KYXJZOWUMBHMGD-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000487962411 1121362202 /nfs/dbraw/zinc/36/22/02/1121362202.db2.gz IZXLJTKMSGREQN-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000487962411 1121362210 /nfs/dbraw/zinc/36/22/10/1121362210.db2.gz IZXLJTKMSGREQN-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)nc1 ZINC000311225885 1128989516 /nfs/dbraw/zinc/98/95/16/1128989516.db2.gz POIWVMGPFMRQMR-QGZVFWFLSA-N 1 1 340.427 3.704 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(CSC(F)F)o2)cc1 ZINC000077221005 1129000386 /nfs/dbraw/zinc/00/03/86/1129000386.db2.gz OUUXFUDMILYYFV-UHFFFAOYSA-N 1 1 328.340 3.933 20 5 EHBDMO C[C@@H](O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536203 1121681446 /nfs/dbraw/zinc/68/14/46/1121681446.db2.gz OCUXWHABLIVFPY-OLZOCXBDSA-N 1 1 332.425 3.526 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000301735105 1129010757 /nfs/dbraw/zinc/01/07/57/1129010757.db2.gz ZPKKDYFANIYQHD-DGCLKSJQSA-N 1 1 343.349 3.534 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775458 1129064388 /nfs/dbraw/zinc/06/43/88/1129064388.db2.gz LCIRCOFLJCIHFP-WBMJQRKESA-N 1 1 335.835 3.701 20 5 EHBDMO CCCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](C)CC ZINC000917438452 1122602710 /nfs/dbraw/zinc/60/27/10/1122602710.db2.gz VEFJWLBSNUARMY-CQSZACIVSA-N 1 1 331.420 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]3C3CCCCC3)c2c1 ZINC000917478189 1122613495 /nfs/dbraw/zinc/61/34/95/1122613495.db2.gz LHFDFGWSUPYAPC-QGZVFWFLSA-N 1 1 328.416 3.947 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)c1 ZINC000154493448 1122667157 /nfs/dbraw/zinc/66/71/57/1122667157.db2.gz POTZCJZWMPUMGU-PMACEKPBSA-N 1 1 338.407 3.780 20 5 EHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566356 1122777641 /nfs/dbraw/zinc/77/76/41/1122777641.db2.gz FAARRBCIBVTZCQ-LBPRGKRZSA-N 1 1 348.424 3.801 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000609744780 1123655504 /nfs/dbraw/zinc/65/55/04/1123655504.db2.gz XJTPWWLWEAXGMG-UHFFFAOYSA-N 1 1 344.386 3.820 20 5 EHBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCCCC1 ZINC000609771037 1123659894 /nfs/dbraw/zinc/65/98/94/1123659894.db2.gz VMKTUMNOEXCCOJ-UHFFFAOYSA-N 1 1 347.415 3.547 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301827770 1129141919 /nfs/dbraw/zinc/14/19/19/1129141919.db2.gz FUTNLCPLXOIZSC-DOTOQJQBSA-N 1 1 333.338 3.730 20 5 EHBDMO Cn1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C(C)(C)C)n1 ZINC000179695298 1123826867 /nfs/dbraw/zinc/82/68/67/1123826867.db2.gz XVAIWBGHTWWTNX-UHFFFAOYSA-N 1 1 342.443 3.790 20 5 EHBDMO Cn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C(C)(C)C)n1 ZINC000179695298 1123826871 /nfs/dbraw/zinc/82/68/71/1123826871.db2.gz XVAIWBGHTWWTNX-UHFFFAOYSA-N 1 1 342.443 3.790 20 5 EHBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301838379 1129171664 /nfs/dbraw/zinc/17/16/64/1129171664.db2.gz WRIXLILWBLKQTR-FZMZJTMJSA-N 1 1 343.349 3.534 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000735491019 1131349780 /nfs/dbraw/zinc/34/97/80/1131349780.db2.gz AACZPPAZPCZBFS-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000735491019 1131349785 /nfs/dbraw/zinc/34/97/85/1131349785.db2.gz AACZPPAZPCZBFS-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC(C)(C)C1 ZINC000543182043 1129316017 /nfs/dbraw/zinc/31/60/17/1129316017.db2.gz NCNACEOJEUHGGI-GFCCVEGCSA-N 1 1 330.388 3.513 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000067961106 1129326674 /nfs/dbraw/zinc/32/66/74/1129326674.db2.gz JMNOHFLUJXLWSN-HNNXBMFYSA-N 1 1 341.411 3.925 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000466488075 1129489548 /nfs/dbraw/zinc/48/95/48/1129489548.db2.gz GOVSWUWMHVMYIY-HNNXBMFYSA-N 1 1 333.432 3.744 20 5 EHBDMO COCc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000154307477 1129548378 /nfs/dbraw/zinc/54/83/78/1129548378.db2.gz ADMLRNADULSDSD-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO COCc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000154307477 1129548381 /nfs/dbraw/zinc/54/83/81/1129548381.db2.gz ADMLRNADULSDSD-UHFFFAOYSA-N 1 1 326.396 3.906 20 5 EHBDMO Cn1cc(C[N@H+]2CCc3ccccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154427670 1129558094 /nfs/dbraw/zinc/55/80/94/1129558094.db2.gz VARPRRRLHKNENL-UHFFFAOYSA-N 1 1 348.406 3.554 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H]4CCC[C@@H]4C3)cs2)c1 ZINC000093442935 1129588461 /nfs/dbraw/zinc/58/84/61/1129588461.db2.gz XLQLIOQXVGIDJG-OKILXGFUSA-N 1 1 329.425 3.950 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000330961009 1129649888 /nfs/dbraw/zinc/64/98/88/1129649888.db2.gz JMLMJWGCHJEKBS-ZDUSSCGKSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000330952840 1129649932 /nfs/dbraw/zinc/64/99/32/1129649932.db2.gz FQFXDUQZBRLGOV-ZDUSSCGKSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000330952840 1129649934 /nfs/dbraw/zinc/64/99/34/1129649934.db2.gz FQFXDUQZBRLGOV-ZDUSSCGKSA-N 1 1 332.322 3.766 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000331075866 1129652849 /nfs/dbraw/zinc/65/28/49/1129652849.db2.gz WDVWGTMYWVFDSU-CABCVRRESA-N 1 1 348.447 3.548 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000509030920 1129672013 /nfs/dbraw/zinc/67/20/13/1129672013.db2.gz KLWISOUNMUSEMC-UGSOOPFHSA-N 1 1 348.349 3.740 20 5 EHBDMO Cc1ccc(NCc2ccc(C)[nH+]c2N2CCCC2)c([N+](=O)[O-])c1 ZINC000302033769 1129764621 /nfs/dbraw/zinc/76/46/21/1129764621.db2.gz DJHGVKAGQGIJJK-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO Cc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)o1 ZINC000171129184 1130014804 /nfs/dbraw/zinc/01/48/04/1130014804.db2.gz PFYGEWHAHKDXPU-LLVKDONJSA-N 1 1 332.356 3.522 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245515291 1130228556 /nfs/dbraw/zinc/22/85/56/1130228556.db2.gz DJQBSAGIKSFGQZ-VKJFTORMSA-N 1 1 328.416 3.744 20 5 EHBDMO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000246581874 1130393308 /nfs/dbraw/zinc/39/33/08/1130393308.db2.gz SMIVESIBAYNJRX-DYVFJYSZSA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccsc2)O1 ZINC000246581874 1130393314 /nfs/dbraw/zinc/39/33/14/1130393314.db2.gz SMIVESIBAYNJRX-DYVFJYSZSA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208670 1130779128 /nfs/dbraw/zinc/77/91/28/1130779128.db2.gz CSRIBIGJRIOEQO-VXGBXAGGSA-N 1 1 334.445 3.737 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000738228766 1131463775 /nfs/dbraw/zinc/46/37/75/1131463775.db2.gz ZNMMIKVUACILEQ-OAHLLOKOSA-N 1 1 334.445 3.510 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)s1 ZINC000737414553 1131575290 /nfs/dbraw/zinc/57/52/90/1131575290.db2.gz MEQLPSPELGPPRK-UHFFFAOYSA-N 1 1 349.431 3.680 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC000064793869 1131860955 /nfs/dbraw/zinc/86/09/55/1131860955.db2.gz XLTLQZNPTPONEK-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](c3ccccn3)C1)CC2 ZINC001172914248 1131902793 /nfs/dbraw/zinc/90/27/93/1131902793.db2.gz FSYUFEQUSQZVQT-MSOLQXFVSA-N 1 1 337.423 3.727 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380842 1131907260 /nfs/dbraw/zinc/90/72/60/1131907260.db2.gz SZYDYGVHTNKFKH-PBHICJAKSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223966 1132005985 /nfs/dbraw/zinc/00/59/85/1132005985.db2.gz CKWYELAXGZOPQT-MPKXVKKWSA-N 1 1 334.313 3.606 20 5 EHBDMO Cc1ccccc1O[C@H]1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226641 1132006232 /nfs/dbraw/zinc/00/62/32/1132006232.db2.gz KWGPDJQXFPUFSZ-APWZRJJASA-N 1 1 340.423 3.988 20 5 EHBDMO Cc1ccn2cc(C[N@H+](C)[C@@H](C)Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001173237750 1132026455 /nfs/dbraw/zinc/02/64/55/1132026455.db2.gz LYSXLJIXSRAALN-HNNXBMFYSA-N 1 1 338.411 3.614 20 5 EHBDMO COc1ccccc1OCC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509394499 1132486915 /nfs/dbraw/zinc/48/69/15/1132486915.db2.gz XZWVTWRHAXYBKN-VQHVLOKHSA-N 1 1 342.395 3.627 20 5 EHBDMO Cc1ccc(N2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1C ZINC001168918928 1132605304 /nfs/dbraw/zinc/60/53/04/1132605304.db2.gz QPEAOBNFZLILSK-UHFFFAOYSA-N 1 1 325.412 3.534 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057651 1132646341 /nfs/dbraw/zinc/64/63/41/1132646341.db2.gz WOSRAXVKTSOMDS-ZACQAIPSSA-N 1 1 338.398 3.632 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057651 1132646346 /nfs/dbraw/zinc/64/63/46/1132646346.db2.gz WOSRAXVKTSOMDS-ZACQAIPSSA-N 1 1 338.398 3.632 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1[C@H](C)C[C@H](c2ccccc2)C1(C)C ZINC001175650096 1132722428 /nfs/dbraw/zinc/72/24/28/1132722428.db2.gz DXKYPXGICRVRIG-RHSMWYFYSA-N 1 1 342.443 3.756 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761574 1133049295 /nfs/dbraw/zinc/04/92/95/1133049295.db2.gz BGMBBGSIXKPNTB-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000773699588 1133091600 /nfs/dbraw/zinc/09/16/00/1133091600.db2.gz IAJNUQAHLUBJJK-KBPBESRZSA-N 1 1 338.835 3.887 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155632 /nfs/dbraw/zinc/15/56/32/1133155632.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 1 1 325.840 3.553 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCCO)Cc2ccccc2)ccc1Cl ZINC000768558259 1133155661 /nfs/dbraw/zinc/15/56/61/1133155661.db2.gz ZUVWYISZBDJTOM-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO CC(C)(C)[N@@H+]1CC[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142759 1133228332 /nfs/dbraw/zinc/22/83/32/1133228332.db2.gz MNGINLRZARKVOR-INIZCTEOSA-N 1 1 343.427 3.817 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142759 1133228339 /nfs/dbraw/zinc/22/83/39/1133228339.db2.gz MNGINLRZARKVOR-INIZCTEOSA-N 1 1 343.427 3.817 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnn(-c2ccc(F)cc2)c1)c1ccccc1[N+](=O)[O-] ZINC001179507112 1133257539 /nfs/dbraw/zinc/25/75/39/1133257539.db2.gz PZONNPRUKQXYDS-CYBMUJFWSA-N 1 1 340.358 3.770 20 5 EHBDMO CSC[C@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769517388 1133308706 /nfs/dbraw/zinc/30/87/06/1133308706.db2.gz UWOJUIFZDLLLMJ-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769517388 1133308710 /nfs/dbraw/zinc/30/87/10/1133308710.db2.gz UWOJUIFZDLLLMJ-SNVBAGLBSA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907259 1134116259 /nfs/dbraw/zinc/11/62/59/1134116259.db2.gz GHVBJHIXGZQUFS-SUMWQHHRSA-N 1 1 341.367 3.881 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)c1ncc[nH]1 ZINC001187735882 1134377946 /nfs/dbraw/zinc/37/79/46/1134377946.db2.gz HAFPLVQNSGLRKT-UHFFFAOYSA-N 1 1 345.406 3.738 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC(F)(F)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329842 1134748948 /nfs/dbraw/zinc/74/89/48/1134748948.db2.gz VRCMLUXFOADKFF-RYUDHWBXSA-N 1 1 328.359 3.512 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2Cc3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170353120 1134753851 /nfs/dbraw/zinc/75/38/51/1134753851.db2.gz WGZOCBFUQGLFNY-GJZGRUSLSA-N 1 1 340.423 3.981 20 5 EHBDMO COc1ccc2c(c1)C[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170347611 1134759248 /nfs/dbraw/zinc/75/92/48/1134759248.db2.gz SFOKPKZMKBUCKZ-CYBMUJFWSA-N 1 1 342.395 3.559 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170347611 1134759255 /nfs/dbraw/zinc/75/92/55/1134759255.db2.gz SFOKPKZMKBUCKZ-CYBMUJFWSA-N 1 1 342.395 3.559 20 5 EHBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204364 1134814879 /nfs/dbraw/zinc/81/48/79/1134814879.db2.gz SQTXHELUKBAAOM-GOEBONIOSA-N 1 1 326.824 3.884 20 5 EHBDMO CC[C@@H]1C[N@@H+](CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325121 1135257327 /nfs/dbraw/zinc/25/73/27/1135257327.db2.gz QCTLGZVJTYAVNA-CYBMUJFWSA-N 1 1 345.365 3.530 20 5 EHBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834343 1135333031 /nfs/dbraw/zinc/33/30/31/1135333031.db2.gz FWOAMEDKWYVDSD-QZTJIDSGSA-N 1 1 344.411 3.720 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000805840170 1135333364 /nfs/dbraw/zinc/33/33/64/1135333364.db2.gz MMTQTRMJJPTKFD-ZBFHGGJFSA-N 1 1 332.425 3.773 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](C4CCCCC4)C3)nc2c1 ZINC001195892634 1135481943 /nfs/dbraw/zinc/48/19/43/1135481943.db2.gz IKLZXVHIBXXBDI-CQSZACIVSA-N 1 1 328.416 3.873 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccccc2)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000775766389 1135669202 /nfs/dbraw/zinc/66/92/02/1135669202.db2.gz XKJRSMYNTVVOIR-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCCC12CCC2 ZINC001198027159 1135767187 /nfs/dbraw/zinc/76/71/87/1135767187.db2.gz NADFOZJSBNORQX-UHFFFAOYSA-N 1 1 325.206 3.876 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCCC12CCC2 ZINC001198027159 1135767190 /nfs/dbraw/zinc/76/71/90/1135767190.db2.gz NADFOZJSBNORQX-UHFFFAOYSA-N 1 1 325.206 3.876 20 5 EHBDMO Cc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC001170571897 1135788103 /nfs/dbraw/zinc/78/81/03/1135788103.db2.gz JWAJGJDYQMXHQU-HNNXBMFYSA-N 1 1 341.411 3.671 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1occc1Br ZINC000809689160 1135871868 /nfs/dbraw/zinc/87/18/68/1135871868.db2.gz VZPORIQMJXLCPA-UHFFFAOYSA-N 1 1 339.189 3.625 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1occc1Br ZINC000809689160 1135871871 /nfs/dbraw/zinc/87/18/71/1135871871.db2.gz VZPORIQMJXLCPA-UHFFFAOYSA-N 1 1 339.189 3.625 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809940046 1135902791 /nfs/dbraw/zinc/90/27/91/1135902791.db2.gz BSGODCSIIOAJSS-UHFFFAOYSA-N 1 1 346.258 3.818 20 5 EHBDMO CC(C)(C)C[N@@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809943993 1135903164 /nfs/dbraw/zinc/90/31/64/1135903164.db2.gz HPPJEMLDDUTDQL-UHFFFAOYSA-N 1 1 335.231 3.742 20 5 EHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccnc(Cl)c1Cl ZINC000811505956 1136101349 /nfs/dbraw/zinc/10/13/49/1136101349.db2.gz UTYRTPQFSZNHIU-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccnc(Cl)c1Cl ZINC000811505956 1136101350 /nfs/dbraw/zinc/10/13/50/1136101350.db2.gz UTYRTPQFSZNHIU-UHFFFAOYSA-N 1 1 340.210 3.971 20 5 EHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2ccccc21 ZINC000776270562 1136123863 /nfs/dbraw/zinc/12/38/63/1136123863.db2.gz CTNWEHDRUXFYBE-OALUTQOASA-N 1 1 326.396 3.638 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274365 1136130206 /nfs/dbraw/zinc/13/02/06/1136130206.db2.gz HFTLOTDYQPDFFQ-DIFFPNOSSA-N 1 1 336.338 3.599 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000850428327 1136257219 /nfs/dbraw/zinc/25/72/19/1136257219.db2.gz MVOUMJBOOFVYPX-RYUDHWBXSA-N 1 1 345.355 3.923 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814226410 1136425287 /nfs/dbraw/zinc/42/52/87/1136425287.db2.gz WNGPKDSMEKMOQO-INIZCTEOSA-N 1 1 336.395 3.782 20 5 EHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583740 1136442313 /nfs/dbraw/zinc/44/23/13/1136442313.db2.gz GMKLKTWJRPXIIA-PMACEKPBSA-N 1 1 340.423 3.644 20 5 EHBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000776580719 1136445462 /nfs/dbraw/zinc/44/54/62/1136445462.db2.gz ZGNAYPLDXVBUNY-ACJLOTCBSA-N 1 1 332.375 3.850 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000852426873 1136455516 /nfs/dbraw/zinc/45/55/16/1136455516.db2.gz PURCLXDHKAYYCH-WMZOPIPTSA-N 1 1 342.395 3.839 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccccc2)[C@@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000112659813 1136644015 /nfs/dbraw/zinc/64/40/15/1136644015.db2.gz IHGPFIAUVSJTLB-FQEVSTJZSA-N 1 1 342.439 3.922 20 5 EHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000818050575 1136860514 /nfs/dbraw/zinc/86/05/14/1136860514.db2.gz LQHXROSXEKKHCF-LCYFTJDESA-N 1 1 336.351 3.593 20 5 EHBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000859530343 1137018482 /nfs/dbraw/zinc/01/84/82/1137018482.db2.gz NHNLRRCDYGJIIU-ZDUSSCGKSA-N 1 1 337.420 3.502 20 5 EHBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000859530343 1137018483 /nfs/dbraw/zinc/01/84/83/1137018483.db2.gz NHNLRRCDYGJIIU-ZDUSSCGKSA-N 1 1 337.420 3.502 20 5 EHBDMO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1C ZINC000794640912 1137220715 /nfs/dbraw/zinc/22/07/15/1137220715.db2.gz JFNQCTKKUAISLY-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1C ZINC000794640912 1137220717 /nfs/dbraw/zinc/22/07/17/1137220717.db2.gz JFNQCTKKUAISLY-UHFFFAOYSA-N 1 1 329.356 3.752 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000120221061 1137244926 /nfs/dbraw/zinc/24/49/26/1137244926.db2.gz WXNKVAQTEOIBPK-UHFFFAOYSA-N 1 1 342.321 3.645 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1F ZINC000847020773 1137382983 /nfs/dbraw/zinc/38/29/83/1137382983.db2.gz OCAGADPNXISDPQ-OAHLLOKOSA-N 1 1 333.319 3.883 20 5 EHBDMO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348191074 1137452202 /nfs/dbraw/zinc/45/22/02/1137452202.db2.gz FQQJHAGJRKCQES-INIZCTEOSA-N 1 1 332.375 3.507 20 5 EHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348191074 1137452203 /nfs/dbraw/zinc/45/22/03/1137452203.db2.gz FQQJHAGJRKCQES-INIZCTEOSA-N 1 1 332.375 3.507 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCc3ccc(C)cc3C2)ccc1[N+](=O)[O-] ZINC001171815818 1137514760 /nfs/dbraw/zinc/51/47/60/1137514760.db2.gz WCPJBNLLBYHFEB-UHFFFAOYSA-N 1 1 326.396 3.860 20 5 EHBDMO CCOc1cc(C[N@H+]2CCc3ccc(C)cc3C2)ccc1[N+](=O)[O-] ZINC001171815818 1137514761 /nfs/dbraw/zinc/51/47/61/1137514761.db2.gz WCPJBNLLBYHFEB-UHFFFAOYSA-N 1 1 326.396 3.860 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CCO)c1ccco1 ZINC000872062532 1137569044 /nfs/dbraw/zinc/56/90/44/1137569044.db2.gz IDMZOFCWWIKYSX-BXUZGUMPSA-N 1 1 336.413 3.684 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)cc1O ZINC000876633515 1137657753 /nfs/dbraw/zinc/65/77/53/1137657753.db2.gz RFQWEPONYBWQMA-UHFFFAOYSA-N 1 1 330.384 3.558 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000877795127 1137690015 /nfs/dbraw/zinc/69/00/15/1137690015.db2.gz AAZGSDBUJZOKDM-LLVKDONJSA-N 1 1 347.242 3.885 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000877795127 1137690016 /nfs/dbraw/zinc/69/00/16/1137690016.db2.gz AAZGSDBUJZOKDM-LLVKDONJSA-N 1 1 347.242 3.885 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC2(CCOCC2)O1 ZINC000877993107 1137698839 /nfs/dbraw/zinc/69/88/39/1137698839.db2.gz XHLRZJCXRLBHBI-GOSISDBHSA-N 1 1 348.443 3.533 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000879205007 1137741117 /nfs/dbraw/zinc/74/11/17/1137741117.db2.gz BYKVNKYJHJEUEE-UHFFFAOYSA-N 1 1 335.404 3.645 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(C(=O)CC(C)C)CC1 ZINC000879760763 1137758194 /nfs/dbraw/zinc/75/81/94/1137758194.db2.gz LKJXTSPJHQYZBD-INIZCTEOSA-N 1 1 347.459 3.545 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(C(=O)CC(C)C)CC1 ZINC000879760763 1137758195 /nfs/dbraw/zinc/75/81/95/1137758195.db2.gz LKJXTSPJHQYZBD-INIZCTEOSA-N 1 1 347.459 3.545 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880103175 1137768231 /nfs/dbraw/zinc/76/82/31/1137768231.db2.gz SEFZSTKPXZTNHX-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000883322129 1137854700 /nfs/dbraw/zinc/85/47/00/1137854700.db2.gz VMGKUZJPDYWLJQ-DZJNRPSUSA-N 1 1 340.427 3.586 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)cc1[N+](=O)[O-] ZINC000111312371 1137904190 /nfs/dbraw/zinc/90/41/90/1137904190.db2.gz MHCBZZDZCJEMDK-CQSZACIVSA-N 1 1 347.440 3.878 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901931 1137925167 /nfs/dbraw/zinc/92/51/67/1137925167.db2.gz JRXSICFUKJONQJ-RTOBDTNUSA-N 1 1 332.444 3.917 20 5 EHBDMO COc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(F)c1OC ZINC000886125448 1138049522 /nfs/dbraw/zinc/04/95/22/1138049522.db2.gz RQLPKWVNTOPPAH-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cc1F ZINC000886617268 1138102462 /nfs/dbraw/zinc/10/24/62/1138102462.db2.gz JAJHDXRDKNDNFO-FZMZJTMJSA-N 1 1 332.297 3.898 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2ncccn2)C1 ZINC000886685947 1138115132 /nfs/dbraw/zinc/11/51/32/1138115132.db2.gz HGJWUBWRTKQUAU-CABCVRRESA-N 1 1 326.400 3.634 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2cc(C3CC3)no2)c2cc([N+](=O)[O-])ccc21 ZINC000886684921 1138115155 /nfs/dbraw/zinc/11/51/55/1138115155.db2.gz WCVWOMLKGMDQMN-KRWDZBQOSA-N 1 1 327.384 3.972 20 5 EHBDMO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091413797 1138219387 /nfs/dbraw/zinc/21/93/87/1138219387.db2.gz UBSCZOBBSNQOFO-APPDUMDISA-N 1 1 336.338 3.911 20 5 EHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCO1 ZINC000092406825 1138227485 /nfs/dbraw/zinc/22/74/85/1138227485.db2.gz ZUCDAIMRWCQYFM-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCO1 ZINC000092406825 1138227487 /nfs/dbraw/zinc/22/74/87/1138227487.db2.gz ZUCDAIMRWCQYFM-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO C[C@H]1C[C@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130655966 1138467466 /nfs/dbraw/zinc/46/74/66/1138467466.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130655966 1138467468 /nfs/dbraw/zinc/46/74/68/1138467468.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130655966 1138467470 /nfs/dbraw/zinc/46/74/70/1138467470.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 1 1 343.427 3.769 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000338012311 1138723743 /nfs/dbraw/zinc/72/37/43/1138723743.db2.gz QEOCSBDLMILIHX-VXGBXAGGSA-N 1 1 333.363 3.939 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cc3c2OCOC3)cc1[N+](=O)[O-] ZINC000181821367 1139934577 /nfs/dbraw/zinc/93/45/77/1139934577.db2.gz SYTYLIRJYJTNSY-LBPRGKRZSA-N 1 1 346.358 3.760 20 5 EHBDMO COc1cc(Cn2cc[nH+]c2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000182812095 1139994454 /nfs/dbraw/zinc/99/44/54/1139994454.db2.gz CHQNUGLKIZPFEA-UHFFFAOYSA-N 1 1 341.314 3.573 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1O ZINC000182840930 1139996196 /nfs/dbraw/zinc/99/61/96/1139996196.db2.gz JTQUKYLVEKBBKB-ZDUSSCGKSA-N 1 1 330.384 3.810 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186072079 1140185762 /nfs/dbraw/zinc/18/57/62/1140185762.db2.gz WOZILTKWKDBUIL-NSHDSACASA-N 1 1 344.333 3.808 20 5 EHBDMO O=C(c1ccc(F)cc1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000192474323 1140533728 /nfs/dbraw/zinc/53/37/28/1140533728.db2.gz NADCXWUZOLDNLC-UHFFFAOYSA-N 1 1 342.370 3.829 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000267441947 1140791814 /nfs/dbraw/zinc/79/18/14/1140791814.db2.gz IDZVVRPXWQOADD-ZBFHGGJFSA-N 1 1 332.425 3.744 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634851 1141129876 /nfs/dbraw/zinc/12/98/76/1141129876.db2.gz AFDRQEPHEWTHAP-GTNSWQLSSA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634851 1141129878 /nfs/dbraw/zinc/12/98/78/1141129878.db2.gz AFDRQEPHEWTHAP-GTNSWQLSSA-N 1 1 336.338 3.599 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000271045873 1141299411 /nfs/dbraw/zinc/29/94/11/1141299411.db2.gz VDHFSCYRFVGLQG-KRWDZBQOSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000271045873 1141299414 /nfs/dbraw/zinc/29/94/14/1141299414.db2.gz VDHFSCYRFVGLQG-KRWDZBQOSA-N 1 1 327.384 3.726 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN(C2CC2)C1 ZINC000271128439 1141310279 /nfs/dbraw/zinc/31/02/79/1141310279.db2.gz LAIZTEMBCWBCRL-CABCVRRESA-N 1 1 349.500 3.539 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000271558782 1141397642 /nfs/dbraw/zinc/39/76/42/1141397642.db2.gz WIBDAPHEKCVWEI-UONOGXRCSA-N 1 1 346.456 3.856 20 5 EHBDMO CCN(C(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271582816 1141402252 /nfs/dbraw/zinc/40/22/52/1141402252.db2.gz CLHGRDAVVKZEGS-CABCVRRESA-N 1 1 341.411 3.687 20 5 EHBDMO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271582817 1141402323 /nfs/dbraw/zinc/40/23/23/1141402323.db2.gz CLHGRDAVVKZEGS-GJZGRUSLSA-N 1 1 341.411 3.687 20 5 EHBDMO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000271665262 1141415137 /nfs/dbraw/zinc/41/51/37/1141415137.db2.gz ZCLBRJODALWYSM-HUUCEWRRSA-N 1 1 341.411 3.889 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCC[C@@H](C)C1 ZINC000052160046 214121291 /nfs/dbraw/zinc/12/12/91/214121291.db2.gz KYXJZOWUMBHMGD-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248617894 1032068833 /nfs/dbraw/zinc/06/88/33/1032068833.db2.gz JOCTYIWNKJCBKK-CZUORRHYSA-N 1 1 340.420 3.603 20 5 EHBDMO COc1cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F ZINC000248617894 1032068846 /nfs/dbraw/zinc/06/88/46/1032068846.db2.gz JOCTYIWNKJCBKK-CZUORRHYSA-N 1 1 340.420 3.603 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2sccc2Br)cc1 ZINC000043675044 1019961854 /nfs/dbraw/zinc/96/18/54/1019961854.db2.gz MWPIQGJFCFUJNC-UHFFFAOYSA-N 1 1 327.203 3.709 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000339670821 1015491894 /nfs/dbraw/zinc/49/18/94/1015491894.db2.gz FUFRMWBBMHGYDF-OCCSQVGLSA-N 1 1 342.399 3.828 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)c1 ZINC000339908754 1015881656 /nfs/dbraw/zinc/88/16/56/1015881656.db2.gz FLVVAGQVUXXFCJ-KRWDZBQOSA-N 1 1 336.395 3.609 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCC[N@H+]3C3CCCC3)n2)c1 ZINC000275420252 1016733306 /nfs/dbraw/zinc/73/33/06/1016733306.db2.gz HHCPFBBMBUCEME-HNNXBMFYSA-N 1 1 328.372 3.724 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC1CCCCC1 ZINC001167273379 1016913708 /nfs/dbraw/zinc/91/37/08/1016913708.db2.gz DREQRKKVHBAMDP-AWEZNQCLSA-N 1 1 333.432 3.824 20 5 EHBDMO CC(C)[C@H]1[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527942 1016953420 /nfs/dbraw/zinc/95/34/20/1016953420.db2.gz NJYBVTZHILJHEM-SUQGKYDKSA-N 1 1 330.428 3.745 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000538196273 1032211456 /nfs/dbraw/zinc/21/14/56/1032211456.db2.gz ZSGYWUIYOHYONY-UHFFFAOYSA-N 1 1 343.349 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc4c[nH]nc4c3)C2)cc1 ZINC000449500937 1032677731 /nfs/dbraw/zinc/67/77/31/1032677731.db2.gz OSNGRZIZDGBKGI-KRWDZBQOSA-N 1 1 336.395 3.851 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000468033652 1017512384 /nfs/dbraw/zinc/51/23/84/1017512384.db2.gz MWZGSFFKUXUJEX-IAQYHMDHSA-N 1 1 346.358 3.917 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000377237781 1017514905 /nfs/dbraw/zinc/51/49/05/1017514905.db2.gz JJAAWQQJODIPTA-JKSUJKDBSA-N 1 1 342.395 3.713 20 5 EHBDMO C[C@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610294691 1017899040 /nfs/dbraw/zinc/89/90/40/1017899040.db2.gz WYRGYSNRZZTMSP-YJBOKZPZSA-N 1 1 336.395 3.883 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010020 1018198251 /nfs/dbraw/zinc/19/82/51/1018198251.db2.gz BSXIIFICMOXOGP-PBHICJAKSA-N 1 1 340.427 3.678 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000449551000 1032772686 /nfs/dbraw/zinc/77/26/86/1032772686.db2.gz FEIPREZFTDINMT-ZACQAIPSSA-N 1 1 332.444 3.701 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000419373609 1018952316 /nfs/dbraw/zinc/95/23/16/1018952316.db2.gz OLWWMVHRXZQMFB-FDYHWXHSSA-N 1 1 330.388 3.682 20 5 EHBDMO C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000473507442 1019078024 /nfs/dbraw/zinc/07/80/24/1019078024.db2.gz LAARLNPUCTZRCF-LJQANCHMSA-N 1 1 348.406 3.636 20 5 EHBDMO CC[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000340686672 1019324368 /nfs/dbraw/zinc/32/43/68/1019324368.db2.gz IWHPMXGTRITDAI-NSHDSACASA-N 1 1 330.331 3.579 20 5 EHBDMO CC[C@H](NC(=O)CCn1cc[nH+]c1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000177788619 1019631198 /nfs/dbraw/zinc/63/11/98/1019631198.db2.gz KWRPXHJVCHBGSM-INIZCTEOSA-N 1 1 344.415 3.572 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(CC(F)(F)F)CC1 ZINC000182652537 1019733920 /nfs/dbraw/zinc/73/39/20/1019733920.db2.gz ZGMXNJAMTMAEMJ-ZDUSSCGKSA-N 1 1 345.365 3.534 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(CC(F)(F)F)CC1 ZINC000182652537 1019733933 /nfs/dbraw/zinc/73/39/33/1019733933.db2.gz ZGMXNJAMTMAEMJ-ZDUSSCGKSA-N 1 1 345.365 3.534 20 5 EHBDMO COc1ccc(CNc2cc[nH+]c3ccc(Cl)cc23)cc1[N+](=O)[O-] ZINC000513602045 1019866469 /nfs/dbraw/zinc/86/64/69/1019866469.db2.gz CCXJZVMZSQOZRP-UHFFFAOYSA-N 1 1 343.770 3.839 20 5 EHBDMO Cc1ncc([C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000602439162 1032889991 /nfs/dbraw/zinc/88/99/91/1032889991.db2.gz IGXXBXGPQQPUGD-CQSZACIVSA-N 1 1 328.416 3.973 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CC1 ZINC000602441514 1032890130 /nfs/dbraw/zinc/89/01/30/1032890130.db2.gz NXSXRWNLRVMXMH-NSHDSACASA-N 1 1 334.807 3.707 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CC1 ZINC000602441514 1032890145 /nfs/dbraw/zinc/89/01/45/1032890145.db2.gz NXSXRWNLRVMXMH-NSHDSACASA-N 1 1 334.807 3.707 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000513697456 1020463726 /nfs/dbraw/zinc/46/37/26/1020463726.db2.gz NRLVDZUUMPCFJR-SFHVURJKSA-N 1 1 342.443 3.978 20 5 EHBDMO Cc1csc(C[C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000933127125 1020631215 /nfs/dbraw/zinc/63/12/15/1020631215.db2.gz WDUPGOLZQIRAGZ-LBPRGKRZSA-N 1 1 335.404 3.563 20 5 EHBDMO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488557 1032919339 /nfs/dbraw/zinc/91/93/39/1032919339.db2.gz ZHKFHFQPDXPOKO-VXGBXAGGSA-N 1 1 336.823 3.606 20 5 EHBDMO O=C(CC[N@H+]1CC[C@H]1c1cccc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000610505057 1020861533 /nfs/dbraw/zinc/86/15/33/1020861533.db2.gz XLUBLBAQYOOJAF-INIZCTEOSA-N 1 1 343.358 3.510 20 5 EHBDMO COc1c(C)c[nH+]c(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000135235157 1020927280 /nfs/dbraw/zinc/92/72/80/1020927280.db2.gz FAJBSKIUBVFRBU-UHFFFAOYSA-N 1 1 341.411 3.780 20 5 EHBDMO Cc1ncc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000602545978 1032956829 /nfs/dbraw/zinc/95/68/29/1032956829.db2.gz UWCOLNYQCUNGOM-UHFFFAOYSA-N 1 1 331.319 3.668 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436044 1021147881 /nfs/dbraw/zinc/14/78/81/1021147881.db2.gz YAQLVGKIUURGKP-HOCLYGCPSA-N 1 1 336.395 3.953 20 5 EHBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000516478520 1021475086 /nfs/dbraw/zinc/47/50/86/1021475086.db2.gz KNLNCWWMIFGVOP-IBGZPJMESA-N 1 1 344.411 3.982 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CCCC[C@@H]1CC ZINC000518746227 1021506349 /nfs/dbraw/zinc/50/63/49/1021506349.db2.gz NFLUVCGVUBHOPI-HNNXBMFYSA-N 1 1 348.447 3.543 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CNCCC[N@@H+](C)C1CCCCC1 ZINC000509601217 1021546761 /nfs/dbraw/zinc/54/67/61/1021546761.db2.gz OGDPMSLDZRSQBT-UHFFFAOYSA-N 1 1 349.475 3.738 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037575 1021591915 /nfs/dbraw/zinc/59/19/15/1021591915.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 1 1 331.460 3.628 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccn(Cc2ccccc2)n1 ZINC000516877820 1021810953 /nfs/dbraw/zinc/81/09/53/1021810953.db2.gz NRBZJEYLATULSK-LJQANCHMSA-N 1 1 348.406 3.617 20 5 EHBDMO Cc1c(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000437503837 1021898346 /nfs/dbraw/zinc/89/83/46/1021898346.db2.gz FQNLBSJYZVCAHT-IBGZPJMESA-N 1 1 340.423 3.737 20 5 EHBDMO C[N@H+](Cc1c[nH]nc1-c1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC000437576407 1021961592 /nfs/dbraw/zinc/96/15/92/1021961592.db2.gz KEUYFICMTYWWSO-UHFFFAOYSA-N 1 1 328.397 3.678 20 5 EHBDMO C[N@@H+](Cc1c[nH]nc1-c1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC000437576407 1021961600 /nfs/dbraw/zinc/96/16/00/1021961600.db2.gz KEUYFICMTYWWSO-UHFFFAOYSA-N 1 1 328.397 3.678 20 5 EHBDMO COCCOc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000891624973 1022142167 /nfs/dbraw/zinc/14/21/67/1022142167.db2.gz JDNHRNZROBTHPG-UHFFFAOYSA-N 1 1 348.399 3.624 20 5 EHBDMO COCCOc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000891624973 1022142174 /nfs/dbraw/zinc/14/21/74/1022142174.db2.gz JDNHRNZROBTHPG-UHFFFAOYSA-N 1 1 348.399 3.624 20 5 EHBDMO COc1cc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000302157002 1022208307 /nfs/dbraw/zinc/20/83/07/1022208307.db2.gz FJQLFBDRRHYVJO-RHSMWYFYSA-N 1 1 341.411 3.536 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000550079252 1022361425 /nfs/dbraw/zinc/36/14/25/1022361425.db2.gz KSBMYMARPMGBNT-YOEHRIQHSA-N 1 1 345.443 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000780374014 1022400800 /nfs/dbraw/zinc/40/08/00/1022400800.db2.gz MHASYYGBWWBKKZ-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000780374014 1022400802 /nfs/dbraw/zinc/40/08/02/1022400802.db2.gz MHASYYGBWWBKKZ-AWEZNQCLSA-N 1 1 330.359 3.635 20 5 EHBDMO CC1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000782497607 1033054622 /nfs/dbraw/zinc/05/46/22/1033054622.db2.gz CMMTWCVMCWGEBK-UHFFFAOYSA-N 1 1 337.395 3.575 20 5 EHBDMO CC[C@H]1CCCCN1C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000140794748 1022529653 /nfs/dbraw/zinc/52/96/53/1022529653.db2.gz OGGZUESRXNGCOZ-KRWDZBQOSA-N 1 1 347.459 3.596 20 5 EHBDMO CC[C@H]1CCCCN1C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000140794748 1022529671 /nfs/dbraw/zinc/52/96/71/1022529671.db2.gz OGGZUESRXNGCOZ-KRWDZBQOSA-N 1 1 347.459 3.596 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000894636330 1022649196 /nfs/dbraw/zinc/64/91/96/1022649196.db2.gz YOTRZMJJQVRVSH-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000894636330 1022649203 /nfs/dbraw/zinc/64/92/03/1022649203.db2.gz YOTRZMJJQVRVSH-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCOC4)C3)o2)c1 ZINC000449688683 1033072366 /nfs/dbraw/zinc/07/23/66/1033072366.db2.gz WKOBRUBIWVMPCR-LJQANCHMSA-N 1 1 342.395 3.857 20 5 EHBDMO COc1c(O)ccc(C[NH+]2CC(c3ccc(Cl)cc3)C2)c1[N+](=O)[O-] ZINC000894743738 1022841035 /nfs/dbraw/zinc/84/10/35/1022841035.db2.gz WYFWZLDOJVKDGJ-UHFFFAOYSA-N 1 1 348.786 3.562 20 5 EHBDMO C[N@H+]1CCC2(CN(C(=O)c3c4ccccc4cc4ccccc43)C2)C1 ZINC001270376461 1022921384 /nfs/dbraw/zinc/92/13/84/1022921384.db2.gz GATRPJIEOHKRPS-UHFFFAOYSA-N 1 1 330.431 3.771 20 5 EHBDMO COc1ccc(OCC[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000441476441 1023096994 /nfs/dbraw/zinc/09/69/94/1023096994.db2.gz POUOFLFSBIRUEM-YCPHGPKFSA-N 1 1 334.416 3.635 20 5 EHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000127388249 1023147810 /nfs/dbraw/zinc/14/78/10/1023147810.db2.gz ZFYSHGAABDHQLO-CHWSQXEVSA-N 1 1 330.388 3.513 20 5 EHBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000458159335 1023605544 /nfs/dbraw/zinc/60/55/44/1023605544.db2.gz FBKWQFPWVABHDD-MRXNPFEDSA-N 1 1 347.462 3.850 20 5 EHBDMO CC(C)Sc1ccc([C@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC000602807477 1033180938 /nfs/dbraw/zinc/18/09/38/1033180938.db2.gz UXVSSVIRZSOZCU-LBPRGKRZSA-N 1 1 334.445 3.680 20 5 EHBDMO CCC(CC)C[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000514124544 1024154648 /nfs/dbraw/zinc/15/46/48/1024154648.db2.gz JYNLZRGXGCOEEC-UHFFFAOYSA-N 1 1 341.839 3.945 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000302012149 1024304728 /nfs/dbraw/zinc/30/47/28/1024304728.db2.gz ZFBPAWKQQFNWOL-IAGOWNOFSA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)c(F)c1 ZINC000302012149 1024304741 /nfs/dbraw/zinc/30/47/41/1024304741.db2.gz ZFBPAWKQQFNWOL-IAGOWNOFSA-N 1 1 333.338 3.730 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2cccc(C)c2C)c([N+](=O)[O-])cc1OC ZINC000430088444 1024327192 /nfs/dbraw/zinc/32/71/92/1024327192.db2.gz GYEYQLJIIFMHNT-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2C)c([N+](=O)[O-])cc1OC ZINC000430088444 1024327212 /nfs/dbraw/zinc/32/72/12/1024327212.db2.gz GYEYQLJIIFMHNT-UHFFFAOYSA-N 1 1 344.411 3.861 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842111 1033218432 /nfs/dbraw/zinc/21/84/32/1033218432.db2.gz QCBRTOIAYXFLBG-OAHLLOKOSA-N 1 1 342.399 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842111 1033218439 /nfs/dbraw/zinc/21/84/39/1033218439.db2.gz QCBRTOIAYXFLBG-OAHLLOKOSA-N 1 1 342.399 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c(C(F)F)c1 ZINC000895567677 1024623224 /nfs/dbraw/zinc/62/32/24/1024623224.db2.gz GQVFMDOQZNHBDC-KBPBESRZSA-N 1 1 343.399 3.524 20 5 EHBDMO C[N@@H+](Cc1ccccc1)[C@H](CNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220683 1024653550 /nfs/dbraw/zinc/65/35/50/1024653550.db2.gz UNIIWLDRCUUIBZ-QGZVFWFLSA-N 1 1 345.468 3.657 20 5 EHBDMO CN(Cc1ccccc1)[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220683 1024653561 /nfs/dbraw/zinc/65/35/61/1024653561.db2.gz UNIIWLDRCUUIBZ-QGZVFWFLSA-N 1 1 345.468 3.657 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cccc1[N+](=O)[O-] ZINC000602886873 1033236382 /nfs/dbraw/zinc/23/63/82/1033236382.db2.gz JPISQKBYXZBWTP-QGZVFWFLSA-N 1 1 348.406 3.836 20 5 EHBDMO Cc1cnc(CC[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000157524976 1024940454 /nfs/dbraw/zinc/94/04/54/1024940454.db2.gz POYKHBJNJZSODL-UHFFFAOYSA-N 1 1 325.821 3.688 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](CCO)c1ccc(Cl)c(F)c1 ZINC000602926763 1033256986 /nfs/dbraw/zinc/25/69/86/1033256986.db2.gz XLYZVBJIYKOMRQ-HNNXBMFYSA-N 1 1 338.766 3.601 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000185450541 1025093458 /nfs/dbraw/zinc/09/34/58/1025093458.db2.gz LPAFYJJYHHSVAS-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)no1 ZINC000511062912 1025119155 /nfs/dbraw/zinc/11/91/55/1025119155.db2.gz FOORELRWXGNFDG-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606590 1025455800 /nfs/dbraw/zinc/45/58/00/1025455800.db2.gz CLJFPMMCJQSLOL-BBRMVZONSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000544612149 1025830458 /nfs/dbraw/zinc/83/04/58/1025830458.db2.gz SOUZJQWYMFHWTP-IBGZPJMESA-N 1 1 328.412 3.676 20 5 EHBDMO CC(C)Oc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccn1 ZINC000338164350 1025940838 /nfs/dbraw/zinc/94/08/38/1025940838.db2.gz YLEDCRRDZWCJJN-UHFFFAOYSA-N 1 1 341.411 3.942 20 5 EHBDMO CC(C)Oc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccn1 ZINC000338164350 1025940849 /nfs/dbraw/zinc/94/08/49/1025940849.db2.gz YLEDCRRDZWCJJN-UHFFFAOYSA-N 1 1 341.411 3.942 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451412183 1025946213 /nfs/dbraw/zinc/94/62/13/1025946213.db2.gz FWFSNZZCDLBFFL-KSZLIROESA-N 1 1 348.443 3.507 20 5 EHBDMO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544354 1026091516 /nfs/dbraw/zinc/09/15/16/1026091516.db2.gz DYUHQBKSZYUJLL-IUODEOHRSA-N 1 1 342.399 3.796 20 5 EHBDMO C[C@H](c1nc(C2CC2)no1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544354 1026091531 /nfs/dbraw/zinc/09/15/31/1026091531.db2.gz DYUHQBKSZYUJLL-IUODEOHRSA-N 1 1 342.399 3.796 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCO[C@H]3CCCCO3)C2)cc1 ZINC000451550477 1026101316 /nfs/dbraw/zinc/10/13/16/1026101316.db2.gz RWDMXBSULQQXDV-MJGOQNOKSA-N 1 1 348.443 3.708 20 5 EHBDMO Cc1cnc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553129 1026103666 /nfs/dbraw/zinc/10/36/66/1026103666.db2.gz XKWYEGNAIJXXGW-HOCLYGCPSA-N 1 1 326.400 3.634 20 5 EHBDMO CC(C)Cc1noc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451565713 1026117365 /nfs/dbraw/zinc/11/73/65/1026117365.db2.gz LTFHDJZEHPDSAI-HNNXBMFYSA-N 1 1 344.415 3.556 20 5 EHBDMO CC(C)Cc1noc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451565713 1026117371 /nfs/dbraw/zinc/11/73/71/1026117371.db2.gz LTFHDJZEHPDSAI-HNNXBMFYSA-N 1 1 344.415 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCOCC(F)(F)F)C2CC2)cc1 ZINC000130043644 1026141866 /nfs/dbraw/zinc/14/18/66/1026141866.db2.gz WIFCCBIBZWKFRP-UHFFFAOYSA-N 1 1 332.322 3.528 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274985 1026425812 /nfs/dbraw/zinc/42/58/12/1026425812.db2.gz KPRFQBBYSYBIIB-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO COC[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452046658 1026456391 /nfs/dbraw/zinc/45/63/91/1026456391.db2.gz YOFWQGMDXUWGKY-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO COC[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452046658 1026456397 /nfs/dbraw/zinc/45/63/97/1026456397.db2.gz YOFWQGMDXUWGKY-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375799 1026541978 /nfs/dbraw/zinc/54/19/78/1026541978.db2.gz UYKRTHWMFDLMEE-INIZCTEOSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000531209312 1026688014 /nfs/dbraw/zinc/68/80/14/1026688014.db2.gz WASWVBNSVJZHDP-IBGZPJMESA-N 1 1 340.423 3.819 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531587376 1027076560 /nfs/dbraw/zinc/07/65/60/1027076560.db2.gz BLPDUFXNSJORRC-HNAYVOBHSA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000531587376 1027076569 /nfs/dbraw/zinc/07/65/69/1027076569.db2.gz BLPDUFXNSJORRC-HNAYVOBHSA-N 1 1 326.396 3.903 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(C)(c2cccc(Cl)c2)CC1 ZINC000366568976 1027439652 /nfs/dbraw/zinc/43/96/52/1027439652.db2.gz KTPNCXBBKUPEQF-UHFFFAOYSA-N 1 1 348.834 3.535 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495059 1028084785 /nfs/dbraw/zinc/08/47/85/1028084785.db2.gz NZIJVPZOMSCUAQ-QWHCGFSZSA-N 1 1 346.818 3.891 20 5 EHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648910 1028111513 /nfs/dbraw/zinc/11/15/13/1028111513.db2.gz OUZKRECSXAJAKA-XJKSGUPXSA-N 1 1 336.395 3.849 20 5 EHBDMO COc1cc(C[N@@H+](C)CC2(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000444683477 1028154862 /nfs/dbraw/zinc/15/48/62/1028154862.db2.gz HFIIYAUYXKWSSO-UHFFFAOYSA-N 1 1 326.396 3.767 20 5 EHBDMO COC(=O)c1cc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375318 1028196818 /nfs/dbraw/zinc/19/68/18/1028196818.db2.gz GVHMPKIVRJBYOK-MNOVXSKESA-N 1 1 332.356 3.695 20 5 EHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440538450 1028229509 /nfs/dbraw/zinc/22/95/09/1028229509.db2.gz LLSLSNQWINKLHA-ALKREAHSSA-N 1 1 330.428 3.764 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444764811 1028251459 /nfs/dbraw/zinc/25/14/59/1028251459.db2.gz CHERDLKYBCZWPJ-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899741 1029041247 /nfs/dbraw/zinc/04/12/47/1029041247.db2.gz LISZDSVWIXGMLD-HOCLYGCPSA-N 1 1 337.464 3.620 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]CC2(N(C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000504911514 1029053348 /nfs/dbraw/zinc/05/33/48/1029053348.db2.gz HOMWCUQRJSRJMQ-OAHLLOKOSA-N 1 1 349.475 3.909 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912013 1029054752 /nfs/dbraw/zinc/05/47/52/1029054752.db2.gz OVGQBILFCUNYPI-OAGGEKHMSA-N 1 1 349.475 3.907 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912013 1029054770 /nfs/dbraw/zinc/05/47/70/1029054770.db2.gz OVGQBILFCUNYPI-OAGGEKHMSA-N 1 1 349.475 3.907 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000504926265 1029072636 /nfs/dbraw/zinc/07/26/36/1029072636.db2.gz HEYVYOIKRBTDGY-BZUAXINKSA-N 1 1 349.500 3.682 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000504926265 1029072656 /nfs/dbraw/zinc/07/26/56/1029072656.db2.gz HEYVYOIKRBTDGY-BZUAXINKSA-N 1 1 349.500 3.682 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000228842866 1029141866 /nfs/dbraw/zinc/14/18/66/1029141866.db2.gz RPZZFRIKFQXCSR-VHSXEESVSA-N 1 1 330.215 3.940 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+]C2(c3ccccc3)CCOCC2)c(F)c1 ZINC000583255174 1029438149 /nfs/dbraw/zinc/43/81/49/1029438149.db2.gz PZRXBDIFGFENCN-UHFFFAOYSA-N 1 1 348.349 3.669 20 5 EHBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000533263856 1029562749 /nfs/dbraw/zinc/56/27/49/1029562749.db2.gz QQXVEJIYQZCIFR-OAHLLOKOSA-N 1 1 341.411 3.659 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@@H]1C(C)C ZINC000533296490 1029599479 /nfs/dbraw/zinc/59/94/79/1029599479.db2.gz BFNRIEZQDDQLSO-QGZVFWFLSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000441184012 1029876930 /nfs/dbraw/zinc/87/69/30/1029876930.db2.gz YMSXSAVTKKIQGS-KRWDZBQOSA-N 1 1 342.395 3.602 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000441223906 1030002064 /nfs/dbraw/zinc/00/20/64/1030002064.db2.gz ZBUSOUCQMSXNOL-INIZCTEOSA-N 1 1 334.416 3.637 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980951 1030129400 /nfs/dbraw/zinc/12/94/00/1030129400.db2.gz XVBMJJKQEKDPQY-TZMCWYRMSA-N 1 1 330.359 3.818 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000447666966 1030419645 /nfs/dbraw/zinc/41/96/45/1030419645.db2.gz CMKKKKPFLLXLFU-UHFFFAOYSA-N 1 1 347.802 3.999 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccc1)C[C@@H](C)O ZINC000527304334 1030768672 /nfs/dbraw/zinc/76/86/72/1030768672.db2.gz AQYOAMXUWBKYFF-ABPVARSCSA-N 1 1 340.423 3.881 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000249213483 1030831350 /nfs/dbraw/zinc/83/13/50/1030831350.db2.gz DFJGXVDATKCAFT-GWCFXTLKSA-N 1 1 338.458 3.608 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000537698511 1031139018 /nfs/dbraw/zinc/13/90/18/1031139018.db2.gz VUCLSPDYJCHPQR-LRDDRELGSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1F ZINC000340499831 1031305579 /nfs/dbraw/zinc/30/55/79/1031305579.db2.gz OFYQEVQYGWQYAV-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000477440639 1031568605 /nfs/dbraw/zinc/56/86/05/1031568605.db2.gz SSKAOLAFOYZNOW-QGZVFWFLSA-N 1 1 340.379 3.969 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](C)[C@@H]1C ZINC000475744892 1031790857 /nfs/dbraw/zinc/79/08/57/1031790857.db2.gz DFHCTBQZBXBXAU-NFAWXSAZSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950664 1032036824 /nfs/dbraw/zinc/03/68/24/1032036824.db2.gz HTEWZVLQVWMNJN-IRXDYDNUSA-N 1 1 333.476 3.922 20 5 EHBDMO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594522404 1033429388 /nfs/dbraw/zinc/42/93/88/1033429388.db2.gz LGXPWCOLLGVUPP-RNCGHPTOSA-N 1 1 328.343 3.833 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]CC2(N3CCCCC3)CCCCC2)c1 ZINC000061013320 1033432938 /nfs/dbraw/zinc/43/29/38/1033432938.db2.gz PWCNOILRSMJTCK-UHFFFAOYSA-N 1 1 331.460 3.873 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000595020487 1033612478 /nfs/dbraw/zinc/61/24/78/1033612478.db2.gz ZNLRWEJHLOSXKL-ZBEGNZNMSA-N 1 1 346.358 3.917 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973343 1033618741 /nfs/dbraw/zinc/61/87/41/1033618741.db2.gz WHVICIUZGFIXBE-CYBMUJFWSA-N 1 1 345.365 3.576 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1cccc(C[NH+](C)C)c1 ZINC000595003485 1033629051 /nfs/dbraw/zinc/62/90/51/1033629051.db2.gz HHZIVLCDHNWNRN-AWEZNQCLSA-N 1 1 343.427 3.516 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@@H](C)C2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595068079 1033644105 /nfs/dbraw/zinc/64/41/05/1033644105.db2.gz OENAGXLRBYZZQQ-UGSOOPFHSA-N 1 1 344.411 3.590 20 5 EHBDMO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595032143 1033653674 /nfs/dbraw/zinc/65/36/74/1033653674.db2.gz HZPYPHKDTFMYGS-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COCC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(C)o1 ZINC000595034169 1033655441 /nfs/dbraw/zinc/65/54/41/1033655441.db2.gz QCMBLXZADKBEAE-CZUORRHYSA-N 1 1 348.399 3.933 20 5 EHBDMO COc1ccccc1C1([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595047614 1033665110 /nfs/dbraw/zinc/66/51/10/1033665110.db2.gz VBFUFDJQZQUFLI-CYBMUJFWSA-N 1 1 342.395 3.952 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)cc1OC(F)F ZINC000599164757 1033780530 /nfs/dbraw/zinc/78/05/30/1033780530.db2.gz LTRBRXPCFGIXAE-ZDUSSCGKSA-N 1 1 341.358 3.625 20 5 EHBDMO CCC(=O)c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599164703 1033781056 /nfs/dbraw/zinc/78/10/56/1033781056.db2.gz KDAZBASUXXDAEY-OAHLLOKOSA-N 1 1 331.416 3.616 20 5 EHBDMO CCCC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000595415116 1033790099 /nfs/dbraw/zinc/79/00/99/1033790099.db2.gz MFRBMSSJWCEZNE-HNNXBMFYSA-N 1 1 333.388 3.921 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccnc1C(F)(F)F ZINC000599412636 1033925733 /nfs/dbraw/zinc/92/57/33/1033925733.db2.gz MAZCOBGRFOOPHF-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO Cc1cc([C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)ccc1F ZINC000491219600 1033958660 /nfs/dbraw/zinc/95/86/60/1033958660.db2.gz YWRRDSYXUZIHAB-IBGZPJMESA-N 1 1 344.386 3.658 20 5 EHBDMO Cc1cc([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCO2)ccc1F ZINC000491219600 1033958673 /nfs/dbraw/zinc/95/86/73/1033958673.db2.gz YWRRDSYXUZIHAB-IBGZPJMESA-N 1 1 344.386 3.658 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603837531 1033961990 /nfs/dbraw/zinc/96/19/90/1033961990.db2.gz PHFFMGJDQHARGS-CQSZACIVSA-N 1 1 330.384 3.675 20 5 EHBDMO C[C@H](c1ccccc1F)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000603840025 1033985482 /nfs/dbraw/zinc/98/54/82/1033985482.db2.gz OUNDRRSKRLELCO-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787963 1033999896 /nfs/dbraw/zinc/99/98/96/1033999896.db2.gz LAZXWPQISLFDEP-WMZOPIPTSA-N 1 1 348.443 3.775 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584499 1034026177 /nfs/dbraw/zinc/02/61/77/1034026177.db2.gz ADZICILGQCIYDR-ILXRZTDVSA-N 1 1 348.443 3.956 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCC3CC3)CC3CC3)n2)c1 ZINC000595871037 1034031241 /nfs/dbraw/zinc/03/12/41/1034031241.db2.gz KBRPBSBSOZJFIX-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1noc(CS[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020526 1034058621 /nfs/dbraw/zinc/05/86/21/1034058621.db2.gz LFBZDOVVEUTLMM-HNNXBMFYSA-N 1 1 347.440 3.789 20 5 EHBDMO COc1ccc([C@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1F ZINC000599679752 1034108018 /nfs/dbraw/zinc/10/80/18/1034108018.db2.gz OGVWQRBXDGADIA-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1F ZINC000599679752 1034108021 /nfs/dbraw/zinc/10/80/21/1034108021.db2.gz OGVWQRBXDGADIA-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000596308809 1034165601 /nfs/dbraw/zinc/16/56/01/1034165601.db2.gz VWEHPJJDYSRUHH-SNVBAGLBSA-N 1 1 346.353 3.541 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c2ccncc21 ZINC000596570704 1034293180 /nfs/dbraw/zinc/29/31/80/1034293180.db2.gz MVZYZOVLKBQQHG-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO COCC[N@H+](Cc1ccc(C)cc1C)Cc1ccccc1[N+](=O)[O-] ZINC000604493409 1034400214 /nfs/dbraw/zinc/40/02/14/1034400214.db2.gz NBHDEBMVAKBTCD-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1ccccc1[N+](=O)[O-] ZINC000604493409 1034400224 /nfs/dbraw/zinc/40/02/24/1034400224.db2.gz NBHDEBMVAKBTCD-UHFFFAOYSA-N 1 1 328.412 3.860 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254326 /nfs/dbraw/zinc/25/43/26/1035254326.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539066 1035669516 /nfs/dbraw/zinc/66/95/16/1035669516.db2.gz UYEOZADGXIKQGN-LBPRGKRZSA-N 1 1 336.413 3.737 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000443958073 1035999458 /nfs/dbraw/zinc/99/94/58/1035999458.db2.gz LNHWZFBNSZXQEK-KBPBESRZSA-N 1 1 348.447 3.596 20 5 EHBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987167 1036160137 /nfs/dbraw/zinc/16/01/37/1036160137.db2.gz ILYCMPHIXDWONU-LIRRHRJNSA-N 1 1 339.395 3.616 20 5 EHBDMO Cc1c(C[NH2+][C@H](c2cnn(C)c2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000376355122 1036257880 /nfs/dbraw/zinc/25/78/80/1036257880.db2.gz SURNHUCQXJCSNS-IBGZPJMESA-N 1 1 336.395 3.516 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000541391376 1036277381 /nfs/dbraw/zinc/27/73/81/1036277381.db2.gz VPTGDVXIINPCQN-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000589300215 1036330165 /nfs/dbraw/zinc/33/01/65/1036330165.db2.gz DZPLUVRBFZUSFE-WBAXXEDZSA-N 1 1 330.428 3.998 20 5 EHBDMO CCC(CC)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000165364656 1036433952 /nfs/dbraw/zinc/43/39/52/1036433952.db2.gz LLKSFYPOGJIODP-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO CC[N@H+](Cc1ccccc1C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495050 1036438167 /nfs/dbraw/zinc/43/81/67/1036438167.db2.gz PIJAOXZJEBKLHQ-UHFFFAOYSA-N 1 1 342.395 3.712 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495050 1036438179 /nfs/dbraw/zinc/43/81/79/1036438179.db2.gz PIJAOXZJEBKLHQ-UHFFFAOYSA-N 1 1 342.395 3.712 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000609133990 1036529092 /nfs/dbraw/zinc/52/90/92/1036529092.db2.gz VMDQIVFGXWYDPH-UHFFFAOYSA-N 1 1 326.396 3.860 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000541662201 1036547503 /nfs/dbraw/zinc/54/75/03/1036547503.db2.gz BSTLVVJZNYHZPZ-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000152411708 1036596737 /nfs/dbraw/zinc/59/67/37/1036596737.db2.gz DGGCNARREVOJIK-OAHLLOKOSA-N 1 1 349.475 3.940 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736839 1036694029 /nfs/dbraw/zinc/69/40/29/1036694029.db2.gz LTXPSCIYHXSGDB-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CCn1c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)nc2c1cccc2F ZINC000180459168 1036861553 /nfs/dbraw/zinc/86/15/53/1036861553.db2.gz CKCSWXNKKQBQKT-LBPRGKRZSA-N 1 1 342.374 3.954 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)co2)cc1 ZINC000089908693 1036936240 /nfs/dbraw/zinc/93/62/40/1036936240.db2.gz TUXGHSBGBSZVLJ-GASCZTMLSA-N 1 1 327.384 3.872 20 5 EHBDMO CC[N@H+](Cc1occc1C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000412028796 1036950098 /nfs/dbraw/zinc/95/00/98/1036950098.db2.gz SQNPHEZZYWMHTH-AWEZNQCLSA-N 1 1 345.399 3.654 20 5 EHBDMO CC[N@@H+](Cc1occc1C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000412028796 1036950117 /nfs/dbraw/zinc/95/01/17/1036950117.db2.gz SQNPHEZZYWMHTH-AWEZNQCLSA-N 1 1 345.399 3.654 20 5 EHBDMO O=[N+]([O-])c1cccc(N2CCN(c3cc[nH+]c4ccsc43)CC2)c1 ZINC000462787508 1037398847 /nfs/dbraw/zinc/39/88/47/1037398847.db2.gz KLQQPHGLJBRCSS-UHFFFAOYSA-N 1 1 340.408 3.531 20 5 EHBDMO C[C@@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@H+]1C1CC1 ZINC000177185115 1037410557 /nfs/dbraw/zinc/41/05/57/1037410557.db2.gz CRTWYUFDTRZXTO-ZBFHGGJFSA-N 1 1 345.446 3.743 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@@H](C)OC ZINC000462827490 1037430961 /nfs/dbraw/zinc/43/09/61/1037430961.db2.gz PSTDSGDXFSGPJV-CYBMUJFWSA-N 1 1 348.399 3.720 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000463009650 1037642879 /nfs/dbraw/zinc/64/28/79/1037642879.db2.gz LUUMUOXDEQYGGJ-HNNXBMFYSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CCC2)cs1 ZINC000592139216 1037856554 /nfs/dbraw/zinc/85/65/54/1037856554.db2.gz OLCVWMITWCDCMN-QGZVFWFLSA-N 1 1 346.452 3.820 20 5 EHBDMO COc1ccc([C@@H](C)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481618 1037993213 /nfs/dbraw/zinc/99/32/13/1037993213.db2.gz YEAPNJKMRJKBPT-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2ccc(C(F)F)cc2)CC1 ZINC000461386345 1038382984 /nfs/dbraw/zinc/38/29/84/1038382984.db2.gz LCEWTQGURCRCDW-UHFFFAOYSA-N 1 1 347.365 3.855 20 5 EHBDMO Cc1cccc([C@@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665180 1038500090 /nfs/dbraw/zinc/50/00/90/1038500090.db2.gz MXTWDYUMFMDDLD-ZBFHGGJFSA-N 1 1 326.400 3.546 20 5 EHBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1cccc2c1C[N@H+](C1CC1)C2 ZINC000378528762 1038702246 /nfs/dbraw/zinc/70/22/46/1038702246.db2.gz KSPRDEHUCYYKSF-IZZDOVSWSA-N 1 1 349.390 3.725 20 5 EHBDMO C[C@@H](C[NH+]1CCCCC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000237498419 1038745404 /nfs/dbraw/zinc/74/54/04/1038745404.db2.gz OBUVTBALGBXWEJ-HNNXBMFYSA-N 1 1 343.427 3.819 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432786703 1039187992 /nfs/dbraw/zinc/18/79/92/1039187992.db2.gz DOCUPYAYQPJKNN-NSHDSACASA-N 1 1 326.343 3.961 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000015377597 1039302225 /nfs/dbraw/zinc/30/22/25/1039302225.db2.gz WIKUAGQISFWWMG-XQQFMLRXSA-N 1 1 330.388 3.684 20 5 EHBDMO Cc1c(CN[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494830 1039483745 /nfs/dbraw/zinc/48/37/45/1039483745.db2.gz BEICKWFBVRKEGU-QFBILLFUSA-N 1 1 339.439 3.828 20 5 EHBDMO Cc1c(CN[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494830 1039483752 /nfs/dbraw/zinc/48/37/52/1039483752.db2.gz BEICKWFBVRKEGU-QFBILLFUSA-N 1 1 339.439 3.828 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000842167934 1039520080 /nfs/dbraw/zinc/52/00/80/1039520080.db2.gz YLWFPSLMXZTGCG-WISYIIOYSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000842167934 1039520097 /nfs/dbraw/zinc/52/00/97/1039520097.db2.gz YLWFPSLMXZTGCG-WISYIIOYSA-N 1 1 339.823 3.552 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000489093885 1039619343 /nfs/dbraw/zinc/61/93/43/1039619343.db2.gz HPBQPIAVJOVSPD-INIZCTEOSA-N 1 1 326.396 3.901 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1ccccc1 ZINC000489126225 1039637118 /nfs/dbraw/zinc/63/71/18/1039637118.db2.gz JWXQAHLTLWZDDL-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO COc1cccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192953296 1040158126 /nfs/dbraw/zinc/15/81/26/1040158126.db2.gz GVZBZLREKJGBJR-MRXNPFEDSA-N 1 1 341.411 3.537 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490034294 1040301134 /nfs/dbraw/zinc/30/11/34/1040301134.db2.gz VBXTYPPEPKBEFF-YOEHRIQHSA-N 1 1 326.396 3.981 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000490396813 1040527801 /nfs/dbraw/zinc/52/78/01/1040527801.db2.gz HFTQJGIORRKGSF-LJQANCHMSA-N 1 1 346.402 3.753 20 5 EHBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCCCC1 ZINC000029455063 1040625907 /nfs/dbraw/zinc/62/59/07/1040625907.db2.gz HCCUUKCAHYCUPH-UHFFFAOYSA-N 1 1 339.823 3.699 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Nc3ccc(F)cc3)CC2)c(F)c1 ZINC000491092719 1040915408 /nfs/dbraw/zinc/91/54/08/1040915408.db2.gz UAJMLOGPAKBCHZ-UHFFFAOYSA-N 1 1 347.365 3.950 20 5 EHBDMO CC(C)Cn1ccnc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433267115 1041180355 /nfs/dbraw/zinc/18/03/55/1041180355.db2.gz YCUDJMSWEYRXTL-QGZVFWFLSA-N 1 1 342.443 3.960 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000511668797 1041457536 /nfs/dbraw/zinc/45/75/36/1041457536.db2.gz VSILLLZNSGRWBA-NSDNCLLMSA-N 1 1 338.407 3.854 20 5 EHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875321 1041788918 /nfs/dbraw/zinc/78/89/18/1041788918.db2.gz NLRAZLQZLISFTF-GFCCVEGCSA-N 1 1 335.429 3.740 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000111176766 1042238492 /nfs/dbraw/zinc/23/84/92/1042238492.db2.gz UIXOZWUKQZRWHJ-HNNXBMFYSA-N 1 1 334.807 3.666 20 5 EHBDMO CC(C)[C@@H](CO)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000112659805 1042416783 /nfs/dbraw/zinc/41/67/83/1042416783.db2.gz KRYFRRSOJHCRTH-HXUWFJFHSA-N 1 1 342.439 3.656 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700804 1042419994 /nfs/dbraw/zinc/41/99/94/1042419994.db2.gz YFBZPXXNOAJOIW-LSDHHAIUSA-N 1 1 347.459 3.530 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2sccc2Br)cs1 ZINC000112838243 1042427623 /nfs/dbraw/zinc/42/76/23/1042427623.db2.gz NQEINGJXWBWHQG-UHFFFAOYSA-N 1 1 333.232 3.770 20 5 EHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820815 1042906684 /nfs/dbraw/zinc/90/66/84/1042906684.db2.gz WUSMMBICVPLTBQ-DLBZAZTESA-N 1 1 336.432 3.716 20 5 EHBDMO Cc1cc(C[C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC000279114931 1043373741 /nfs/dbraw/zinc/37/37/41/1043373741.db2.gz PMSDKPHVTNPSSR-APPDUMDISA-N 1 1 328.416 3.570 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068983 1127569696 /nfs/dbraw/zinc/56/96/96/1127569696.db2.gz UUHLSDBARMJYBS-SJORKVTESA-N 1 1 346.456 3.570 20 5 EHBDMO Cc1ccc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000765087375 1127572185 /nfs/dbraw/zinc/57/21/85/1127572185.db2.gz LEFXNLNZTZLSBD-CQSZACIVSA-N 1 1 331.441 3.848 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@@H+]1CCc2ccccc2C1 ZINC000301283646 1127729811 /nfs/dbraw/zinc/72/98/11/1127729811.db2.gz PLLCCRPPRQEKQR-LBPRGKRZSA-N 1 1 346.818 3.502 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@H+]1CCc2ccccc2C1 ZINC000301283646 1127729814 /nfs/dbraw/zinc/72/98/14/1127729814.db2.gz PLLCCRPPRQEKQR-LBPRGKRZSA-N 1 1 346.818 3.502 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347625208 1128151578 /nfs/dbraw/zinc/15/15/78/1128151578.db2.gz BJMNNAVQQMQAML-ZDUSSCGKSA-N 1 1 326.805 3.523 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347625206 1128151654 /nfs/dbraw/zinc/15/16/54/1128151654.db2.gz BJMNNAVQQMQAML-CYBMUJFWSA-N 1 1 326.805 3.523 20 5 EHBDMO Cc1cc(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n[nH]1 ZINC000273031458 1128434289 /nfs/dbraw/zinc/43/42/89/1128434289.db2.gz ULUQQYMTPBQBEA-CQSZACIVSA-N 1 1 328.416 3.875 20 5 EHBDMO CC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@H]1C ZINC001307703133 1128456237 /nfs/dbraw/zinc/45/62/37/1128456237.db2.gz OMQOOHXQGCZZCN-QWRGUYRKSA-N 1 1 327.222 3.978 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c1 ZINC000338701485 1128683394 /nfs/dbraw/zinc/68/33/94/1128683394.db2.gz PRMSJHHMCNOHRK-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO CC[N@@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C(C)C ZINC000110423258 1128785514 /nfs/dbraw/zinc/78/55/14/1128785514.db2.gz BTYUYWVERFUNHR-UHFFFAOYSA-N 1 1 335.451 3.848 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000109841419 1120127058 /nfs/dbraw/zinc/12/70/58/1120127058.db2.gz KBCYZTGSJDEXQM-HNNXBMFYSA-N 1 1 344.411 3.545 20 5 EHBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000171709262 1121480647 /nfs/dbraw/zinc/48/06/47/1121480647.db2.gz LGFPHKNOZCDBRK-HNNXBMFYSA-N 1 1 345.446 3.602 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000272722564 1121963666 /nfs/dbraw/zinc/96/36/66/1121963666.db2.gz XSTVDMBNNZSCNK-PMPSAXMXSA-N 1 1 331.460 3.898 20 5 EHBDMO CCOc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000154261758 1122455717 /nfs/dbraw/zinc/45/57/17/1122455717.db2.gz VWGSLVOFNHWMDG-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO CCOc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1 ZINC000154261758 1122455719 /nfs/dbraw/zinc/45/57/19/1122455719.db2.gz VWGSLVOFNHWMDG-UHFFFAOYSA-N 1 1 327.384 3.553 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301205684 1122530911 /nfs/dbraw/zinc/53/09/11/1122530911.db2.gz SJGMADBFODAHQL-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154366953 1122583513 /nfs/dbraw/zinc/58/35/13/1122583513.db2.gz JODXWICKXRABEQ-MJGOQNOKSA-N 1 1 328.412 3.581 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000497597276 1122601532 /nfs/dbraw/zinc/60/15/32/1122601532.db2.gz YPVBHMAVVKRCIU-ZDUSSCGKSA-N 1 1 346.818 3.526 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301788530 1129069982 /nfs/dbraw/zinc/06/99/82/1129069982.db2.gz PWIIBULWHPASRI-IUODEOHRSA-N 1 1 335.835 3.701 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[NH2+][C@H](CCc2ccccc2)C(F)F)cc1 ZINC000497812992 1122671309 /nfs/dbraw/zinc/67/13/09/1122671309.db2.gz PGTWVYUZDYJAGR-QGZVFWFLSA-N 1 1 334.366 3.993 20 5 EHBDMO CCC[N@@H+](CC1CCCCC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000918734622 1122900895 /nfs/dbraw/zinc/90/08/95/1122900895.db2.gz BUFIVRPMFBFQFJ-UHFFFAOYSA-N 1 1 347.415 3.753 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCc2ccccc21 ZINC000557049271 1123283713 /nfs/dbraw/zinc/28/37/13/1123283713.db2.gz WDVSFJYHZLJNLS-GOSISDBHSA-N 1 1 336.395 3.981 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916522 1123691869 /nfs/dbraw/zinc/69/18/69/1123691869.db2.gz WFJCXUNTEXNRFZ-AWEZNQCLSA-N 1 1 332.350 3.938 20 5 EHBDMO Cc1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[nH]n1 ZINC000610009910 1123712850 /nfs/dbraw/zinc/71/28/50/1123712850.db2.gz CFFWCBKRHDVDTF-UHFFFAOYSA-N 1 1 346.774 3.830 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301827773 1129144124 /nfs/dbraw/zinc/14/41/24/1129144124.db2.gz FUTNLCPLXOIZSC-WBVHZDCISA-N 1 1 333.338 3.730 20 5 EHBDMO Cc1c(C[NH2+]Cc2ncccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000616483562 1124004061 /nfs/dbraw/zinc/00/40/61/1124004061.db2.gz KXMMSAPSOGYXTK-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000181815950 1125047849 /nfs/dbraw/zinc/04/78/49/1125047849.db2.gz ZPQBEYNZGNZZCL-GFCCVEGCSA-N 1 1 346.358 3.680 20 5 EHBDMO CCc1oc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C(=O)OC ZINC000619844954 1125416107 /nfs/dbraw/zinc/41/61/07/1125416107.db2.gz DNAKQURQCSBQOS-LBPRGKRZSA-N 1 1 346.383 3.696 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@H+]1C1CC1 ZINC000301846025 1129191574 /nfs/dbraw/zinc/19/15/74/1129191574.db2.gz ALBPLEWMCWDQED-HIFRSBDPSA-N 1 1 338.411 3.694 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@@H]2CCCc3ccccc32)cc1 ZINC000531163523 1129404951 /nfs/dbraw/zinc/40/49/51/1129404951.db2.gz DNBWVWUVSBXZFN-HXUWFJFHSA-N 1 1 340.423 3.857 20 5 EHBDMO CC[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000117342445 1129434817 /nfs/dbraw/zinc/43/48/17/1129434817.db2.gz XSLIRELBMMPVBM-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000464690155 1129557888 /nfs/dbraw/zinc/55/78/88/1129557888.db2.gz VZYPBGXYAJZHJM-CYBMUJFWSA-N 1 1 342.436 3.850 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000154462685 1129560878 /nfs/dbraw/zinc/56/08/78/1129560878.db2.gz VCXAIWZCGCRJFX-QGZVFWFLSA-N 1 1 330.384 3.590 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccccc2)[C@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303986 1129583729 /nfs/dbraw/zinc/58/37/29/1129583729.db2.gz QOCXCOAJOWXQBT-OAHLLOKOSA-N 1 1 328.412 3.676 20 5 EHBDMO CSC[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093761645 1129601998 /nfs/dbraw/zinc/60/19/98/1129601998.db2.gz PPWBUBICIVDYLH-GFCCVEGCSA-N 1 1 332.372 3.524 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093761645 1129602000 /nfs/dbraw/zinc/60/20/00/1129602000.db2.gz PPWBUBICIVDYLH-GFCCVEGCSA-N 1 1 332.372 3.524 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000330447104 1129637717 /nfs/dbraw/zinc/63/77/17/1129637717.db2.gz HTDXEZHURAWAKY-INIZCTEOSA-N 1 1 348.443 3.631 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148175 1129853954 /nfs/dbraw/zinc/85/39/54/1129853954.db2.gz AQAATKKWPNKYRV-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000509159042 1129870752 /nfs/dbraw/zinc/87/07/52/1129870752.db2.gz YVMLOWMERMPHKF-HNNXBMFYSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC001307590580 1130099968 /nfs/dbraw/zinc/09/99/68/1130099968.db2.gz WDZVJQAAZWTGDU-MNOVXSKESA-N 1 1 327.222 3.835 20 5 EHBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000172373312 1130127578 /nfs/dbraw/zinc/12/75/78/1130127578.db2.gz ZPJBZRRQMPLJHW-UHFFFAOYSA-N 1 1 340.427 3.598 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172584150 1130146145 /nfs/dbraw/zinc/14/61/45/1130146145.db2.gz YAUJUKAOGVFYDM-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446251 1130208693 /nfs/dbraw/zinc/20/86/93/1130208693.db2.gz KZVOWUFJBFCTGU-NWDGAFQWSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446251 1130208697 /nfs/dbraw/zinc/20/86/97/1130208697.db2.gz KZVOWUFJBFCTGU-NWDGAFQWSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1ccc(F)cc1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094978 1130342498 /nfs/dbraw/zinc/34/24/98/1130342498.db2.gz AJWDMJSBDYDBJB-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1ccc(F)cc1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094978 1130342503 /nfs/dbraw/zinc/34/25/03/1130342503.db2.gz AJWDMJSBDYDBJB-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000042332505 1130383666 /nfs/dbraw/zinc/38/36/66/1130383666.db2.gz OHEDTZZSISOYDO-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000042332505 1130383671 /nfs/dbraw/zinc/38/36/71/1130383671.db2.gz OHEDTZZSISOYDO-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802478 1130413774 /nfs/dbraw/zinc/41/37/74/1130413774.db2.gz SUSAXAMKTUKPHK-OLZOCXBDSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3sccc3C1)CC2 ZINC001172905595 1131887846 /nfs/dbraw/zinc/88/78/46/1131887846.db2.gz SKLLJOKPGJYYOP-MRXNPFEDSA-N 1 1 328.437 3.962 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1Cc3ccc(F)cc3C1)CC2 ZINC001172915241 1131902529 /nfs/dbraw/zinc/90/25/29/1131902529.db2.gz MNTQDTWKOSHQLG-GOSISDBHSA-N 1 1 326.371 3.997 20 5 EHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381062 1131914024 /nfs/dbraw/zinc/91/40/24/1131914024.db2.gz TUJABFOPVRSLDP-HOCLYGCPSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[N@@H+](Cc1cccnc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187616 1131993596 /nfs/dbraw/zinc/99/35/96/1131993596.db2.gz AVXXDVUQUZQZDR-ZDUSSCGKSA-N 1 1 347.390 3.591 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC001173228359 1132007501 /nfs/dbraw/zinc/00/75/01/1132007501.db2.gz VJHBAQMLCJXIRD-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC001173230945 1132008741 /nfs/dbraw/zinc/00/87/41/1132008741.db2.gz GXZQIZWNHXLRFP-ZBFHGGJFSA-N 1 1 348.443 3.580 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@H]1C1CCCCC1 ZINC001173231060 1132009516 /nfs/dbraw/zinc/00/95/16/1132009516.db2.gz JGKGABKPWVFJSP-BEFAXECRSA-N 1 1 332.444 3.807 20 5 EHBDMO C[C@H](c1cccc(Br)c1)[N@@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057843 1132646452 /nfs/dbraw/zinc/64/64/52/1132646452.db2.gz XZYGCMJLHFNDNO-TYNCELHUSA-N 1 1 341.249 3.887 20 5 EHBDMO CC(C)CC[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758655 1133048577 /nfs/dbraw/zinc/04/85/77/1133048577.db2.gz DUXWZSMKXMYGAK-MRXNPFEDSA-N 1 1 343.431 3.711 20 5 EHBDMO COCC[C@H]1CCCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941487 1133073212 /nfs/dbraw/zinc/07/32/12/1133073212.db2.gz RWUSEZAKLCKDED-CYBMUJFWSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000773705258 1133095200 /nfs/dbraw/zinc/09/52/00/1133095200.db2.gz UQUJVVMDMQUHKX-UONOGXRCSA-N 1 1 338.835 3.887 20 5 EHBDMO COc1cc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000768197816 1133112762 /nfs/dbraw/zinc/11/27/62/1133112762.db2.gz XMKZDPBCYSYIIG-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000768197816 1133112766 /nfs/dbraw/zinc/11/27/66/1133112766.db2.gz XMKZDPBCYSYIIG-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cccc2cc(C[N@@H+]3CCc4c(cccc4[N+](=O)[O-])C3)oc21 ZINC000769426562 1133282063 /nfs/dbraw/zinc/28/20/63/1133282063.db2.gz RVVODIJBEGJYKL-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO COc1cccc2cc(C[N@H+]3CCc4c(cccc4[N+](=O)[O-])C3)oc21 ZINC000769426562 1133282070 /nfs/dbraw/zinc/28/20/70/1133282070.db2.gz RVVODIJBEGJYKL-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC001180229683 1133346394 /nfs/dbraw/zinc/34/63/94/1133346394.db2.gz QNMYCFNZWLZBAW-HXUWFJFHSA-N 1 1 340.423 3.959 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC001180229683 1133346399 /nfs/dbraw/zinc/34/63/99/1133346399.db2.gz QNMYCFNZWLZBAW-HXUWFJFHSA-N 1 1 340.423 3.959 20 5 EHBDMO C[N@H+](Cc1ccc(O)cc1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001181515297 1133500957 /nfs/dbraw/zinc/50/09/57/1133500957.db2.gz RRXCUWYNTGJHMF-UHFFFAOYSA-N 1 1 340.301 3.951 20 5 EHBDMO C[N@@H+](Cc1ccc(O)cc1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001181515297 1133500961 /nfs/dbraw/zinc/50/09/61/1133500961.db2.gz RRXCUWYNTGJHMF-UHFFFAOYSA-N 1 1 340.301 3.951 20 5 EHBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126335 1133810889 /nfs/dbraw/zinc/81/08/89/1133810889.db2.gz PLEBESVGBBUXCQ-CVAIRZPRSA-N 1 1 340.423 3.815 20 5 EHBDMO C[C@@H](OC(=O)[C@H]1CCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877268 1133915368 /nfs/dbraw/zinc/91/53/68/1133915368.db2.gz CDKQUPUZLPHLKS-CXAGYDPISA-N 1 1 332.400 3.606 20 5 EHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)C(C)C ZINC001185202973 1134050043 /nfs/dbraw/zinc/05/00/43/1134050043.db2.gz AEDMNLRVWJRXET-UHFFFAOYSA-N 1 1 346.406 3.938 20 5 EHBDMO CC(C)(CO)[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000788004137 1134063551 /nfs/dbraw/zinc/06/35/51/1134063551.db2.gz LLLYZHGELNSGEK-QGZVFWFLSA-N 1 1 332.375 3.583 20 5 EHBDMO CCOc1cc(NCC[N@@H+](CC)CCC(F)(F)F)ccc1[N+](=O)[O-] ZINC001186089108 1134168615 /nfs/dbraw/zinc/16/86/15/1134168615.db2.gz MUUVDMSPAHMVKM-UHFFFAOYSA-N 1 1 349.353 3.680 20 5 EHBDMO C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)C1 ZINC000746958448 1134488906 /nfs/dbraw/zinc/48/89/06/1134488906.db2.gz LFEJIXNRYOMMPH-KRWDZBQOSA-N 1 1 331.803 3.741 20 5 EHBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)C1 ZINC000746958448 1134488910 /nfs/dbraw/zinc/48/89/10/1134488910.db2.gz LFEJIXNRYOMMPH-KRWDZBQOSA-N 1 1 331.803 3.741 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606103 1134582948 /nfs/dbraw/zinc/58/29/48/1134582948.db2.gz QMDFJUOFNRJTQX-FXAWDEMLSA-N 1 1 340.423 3.735 20 5 EHBDMO CCCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC001190588769 1134723236 /nfs/dbraw/zinc/72/32/36/1134723236.db2.gz DUWGOTYWFCQKFE-CQSZACIVSA-N 1 1 334.420 3.864 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326684 1134748723 /nfs/dbraw/zinc/74/87/23/1134748723.db2.gz BOOOAQJSJARJMU-QWHCGFSZSA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC001170334319 1134751836 /nfs/dbraw/zinc/75/18/36/1134751836.db2.gz CAOBFZNSMDAYQN-LBPRGKRZSA-N 1 1 332.425 3.654 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCOC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170353158 1134753921 /nfs/dbraw/zinc/75/39/21/1134753921.db2.gz WWRKEEXHVTYJEA-HNNXBMFYSA-N 1 1 348.443 3.570 20 5 EHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191039250 1134782138 /nfs/dbraw/zinc/78/21/38/1134782138.db2.gz NTZNQKRCEIBVHP-IBGZPJMESA-N 1 1 326.396 3.983 20 5 EHBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1OC ZINC000792877164 1134810502 /nfs/dbraw/zinc/81/05/02/1134810502.db2.gz QCPZKBHJOASQTN-OAHLLOKOSA-N 1 1 345.355 3.753 20 5 EHBDMO C[N@H+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC001191307056 1134845033 /nfs/dbraw/zinc/84/50/33/1134845033.db2.gz UJGQXEFDNZBRBE-UHFFFAOYSA-N 1 1 337.851 3.699 20 5 EHBDMO CC(C)CCC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001191610675 1134896582 /nfs/dbraw/zinc/89/65/82/1134896582.db2.gz PFEICECMTGCRID-UHFFFAOYSA-N 1 1 333.432 3.682 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789194 1134922946 /nfs/dbraw/zinc/92/29/46/1134922946.db2.gz GKABKYFLPKOGBC-PBHICJAKSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@]1(CNc2ccc(N)cc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000804684317 1135168507 /nfs/dbraw/zinc/16/85/07/1135168507.db2.gz ZACZVWLSURGYDV-LJQANCHMSA-N 1 1 340.427 3.501 20 5 EHBDMO COCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC001193974788 1135208373 /nfs/dbraw/zinc/20/83/73/1135208373.db2.gz CKHAOLVFLRTEFN-DOMZBBRYSA-N 1 1 326.824 3.885 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC001170535866 1135577115 /nfs/dbraw/zinc/57/71/15/1135577115.db2.gz IRTNWEXBWNMDTO-CQSZACIVSA-N 1 1 330.359 3.602 20 5 EHBDMO Cc1ccc(C[C@]2(C)CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC001196595264 1135582035 /nfs/dbraw/zinc/58/20/35/1135582035.db2.gz RILZXLKFOXSNPH-IBGZPJMESA-N 1 1 325.412 3.895 20 5 EHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761675 1135729606 /nfs/dbraw/zinc/72/96/06/1135729606.db2.gz QHDLGQJFXNWVHT-RTBURBONSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921396 1135751027 /nfs/dbraw/zinc/75/10/27/1135751027.db2.gz SGZUWGYNFUVWLU-AWEZNQCLSA-N 1 1 331.441 3.814 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000775892106 1135857786 /nfs/dbraw/zinc/85/77/86/1135857786.db2.gz RARCPSHSRJONMA-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000775892106 1135857789 /nfs/dbraw/zinc/85/77/89/1135857789.db2.gz RARCPSHSRJONMA-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO C[N@@H+](CCc1cccc(NCc2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC001201734671 1136062418 /nfs/dbraw/zinc/06/24/18/1136062418.db2.gz MOBTWEHPRCFIIZ-UHFFFAOYSA-N 1 1 325.412 3.844 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000811494086 1136093545 /nfs/dbraw/zinc/09/35/45/1136093545.db2.gz POHJAOKTJKEQRT-UHFFFAOYSA-N 1 1 332.400 3.538 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000811474261 1136095715 /nfs/dbraw/zinc/09/57/15/1136095715.db2.gz GVEMAUQYCPUOCB-UHFFFAOYSA-N 1 1 326.183 3.895 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000776279661 1136134621 /nfs/dbraw/zinc/13/46/21/1136134621.db2.gz XDXHXWVNBADCLK-LJQANCHMSA-N 1 1 342.370 3.557 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1cccnc1N1CCCC1 ZINC000850352666 1136239584 /nfs/dbraw/zinc/23/95/84/1136239584.db2.gz DLMKBRWKWHCBET-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO CC(C)[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000812861318 1136266360 /nfs/dbraw/zinc/26/63/60/1136266360.db2.gz PPHBEFDTYNHKSZ-GFCCVEGCSA-N 1 1 333.215 3.901 20 5 EHBDMO CC(C)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000812861318 1136266363 /nfs/dbraw/zinc/26/63/63/1136266363.db2.gz PPHBEFDTYNHKSZ-GFCCVEGCSA-N 1 1 333.215 3.901 20 5 EHBDMO CC(C)[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCOC1 ZINC000812861319 1136266498 /nfs/dbraw/zinc/26/64/98/1136266498.db2.gz PPHBEFDTYNHKSZ-LBPRGKRZSA-N 1 1 333.215 3.901 20 5 EHBDMO CC(C)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCOC1 ZINC000812861319 1136266503 /nfs/dbraw/zinc/26/65/03/1136266503.db2.gz PPHBEFDTYNHKSZ-LBPRGKRZSA-N 1 1 333.215 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814226411 1136425515 /nfs/dbraw/zinc/42/55/15/1136425515.db2.gz WNGPKDSMEKMOQO-MRXNPFEDSA-N 1 1 336.395 3.782 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000776586829 1136448834 /nfs/dbraw/zinc/44/88/34/1136448834.db2.gz ISDGNUZBTPJYCA-VQTJNVASSA-N 1 1 338.407 3.780 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597660 1136459652 /nfs/dbraw/zinc/45/96/52/1136459652.db2.gz JRQSRFKYPXMKRF-QHRIQVFBSA-N 1 1 344.386 3.775 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666336 1136491989 /nfs/dbraw/zinc/49/19/89/1136491989.db2.gz GMGJIIKVNURMBM-MAUKXSAKSA-N 1 1 346.814 3.771 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815600328 1136616932 /nfs/dbraw/zinc/61/69/32/1136616932.db2.gz QNULMCVIYTVRNR-GFCCVEGCSA-N 1 1 344.415 3.600 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815573201 1136617926 /nfs/dbraw/zinc/61/79/26/1136617926.db2.gz BIMRBSVVCUSEPM-LBPRGKRZSA-N 1 1 338.367 3.683 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000817365633 1136803586 /nfs/dbraw/zinc/80/35/86/1136803586.db2.gz RDKXCAAJFSCGOV-NSHDSACASA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000817365633 1136803590 /nfs/dbraw/zinc/80/35/90/1136803590.db2.gz RDKXCAAJFSCGOV-NSHDSACASA-N 1 1 342.321 3.566 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)nc1 ZINC000858013537 1136930873 /nfs/dbraw/zinc/93/08/73/1136930873.db2.gz SJWWQCDCZAIJCR-CQSZACIVSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)nc1 ZINC000858013537 1136930876 /nfs/dbraw/zinc/93/08/76/1136930876.db2.gz SJWWQCDCZAIJCR-CQSZACIVSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035861 1136934516 /nfs/dbraw/zinc/93/45/16/1136934516.db2.gz LVVHUJVNYVJDLT-LSDHHAIUSA-N 1 1 327.384 3.513 20 5 EHBDMO COc1ccc([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C2CC2)cn1 ZINC000858341961 1136959800 /nfs/dbraw/zinc/95/98/00/1136959800.db2.gz IHFUOUULVWQTMZ-KRWDZBQOSA-N 1 1 347.802 3.893 20 5 EHBDMO C[C@]1(CO)C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@@]1(C)CO ZINC000862518963 1137147733 /nfs/dbraw/zinc/14/77/33/1137147733.db2.gz MZHDJWCAPIQRKZ-ZRZAMGCNSA-N 1 1 349.474 3.806 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1Cl ZINC000824696254 1137148693 /nfs/dbraw/zinc/14/86/93/1137148693.db2.gz JHCMHNHIVMOSIB-LXZKKBNFSA-N 1 1 338.835 3.764 20 5 EHBDMO Cc1nc(F)ccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824820972 1137153703 /nfs/dbraw/zinc/15/37/03/1137153703.db2.gz RSALAEKRXPIWSW-INIZCTEOSA-N 1 1 329.375 3.817 20 5 EHBDMO COC[C@]1(CO)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000825158615 1137168332 /nfs/dbraw/zinc/16/83/32/1137168332.db2.gz SJFWREVGVCQZDS-JOCHJYFZSA-N 1 1 335.447 3.824 20 5 EHBDMO CC[N@H+](CCOc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1F ZINC001171354283 1137456841 /nfs/dbraw/zinc/45/68/41/1137456841.db2.gz QDWBZTFIGMKPBK-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1F ZINC001171354283 1137456842 /nfs/dbraw/zinc/45/68/42/1137456842.db2.gz QDWBZTFIGMKPBK-UHFFFAOYSA-N 1 1 332.375 3.943 20 5 EHBDMO COc1ccc(C[N@H+]2CCc3ccccc3C2(C)C)cc1[N+](=O)[O-] ZINC001171416968 1137476645 /nfs/dbraw/zinc/47/66/45/1137476645.db2.gz JODYEPTTYSIASN-UHFFFAOYSA-N 1 1 326.396 3.897 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171804856 1137513542 /nfs/dbraw/zinc/51/35/42/1137513542.db2.gz JMGFYLVOCLVSPE-GDBMZVCRSA-N 1 1 345.443 3.824 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC[C@@H]1C=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000872107693 1137571467 /nfs/dbraw/zinc/57/14/67/1137571467.db2.gz QYEDLAMGXLZEBR-QAPCUYQASA-N 1 1 340.427 3.754 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000877819662 1137691429 /nfs/dbraw/zinc/69/14/29/1137691429.db2.gz HHQPLHCOQRCQSX-RZXPCSSPSA-N 1 1 344.333 3.651 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000877819662 1137691430 /nfs/dbraw/zinc/69/14/30/1137691430.db2.gz HHQPLHCOQRCQSX-RZXPCSSPSA-N 1 1 344.333 3.651 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC12CCC2 ZINC000878337484 1137711335 /nfs/dbraw/zinc/71/13/35/1137711335.db2.gz LGVSXYQMCGHMBB-CYBMUJFWSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc4c(o3)CCCC4)C2)cc1 ZINC000878677838 1137724785 /nfs/dbraw/zinc/72/47/85/1137724785.db2.gz DXLKPWSDONYLSH-OAHLLOKOSA-N 1 1 341.411 3.841 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4c(o3)CCCC4)C2)cc1 ZINC000878677838 1137724786 /nfs/dbraw/zinc/72/47/86/1137724786.db2.gz DXLKPWSDONYLSH-OAHLLOKOSA-N 1 1 341.411 3.841 20 5 EHBDMO Cc1csc([C@H]2CC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)n1 ZINC000880011190 1137765441 /nfs/dbraw/zinc/76/54/41/1137765441.db2.gz IPENCFUGZLSFIT-JTQLQIEISA-N 1 1 339.367 3.627 20 5 EHBDMO Cc1csc([C@H]2CC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)n1 ZINC000880011190 1137765442 /nfs/dbraw/zinc/76/54/42/1137765442.db2.gz IPENCFUGZLSFIT-JTQLQIEISA-N 1 1 339.367 3.627 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000880030612 1137765975 /nfs/dbraw/zinc/76/59/75/1137765975.db2.gz VIDVTROCJCJJQN-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000880030612 1137765976 /nfs/dbraw/zinc/76/59/76/1137765976.db2.gz VIDVTROCJCJJQN-ZDUSSCGKSA-N 1 1 339.395 3.673 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901928 1137925159 /nfs/dbraw/zinc/92/51/59/1137925159.db2.gz JRXSICFUKJONQJ-IIZUFCTNSA-N 1 1 332.444 3.917 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)c1ccc(F)cc1F)C1CC1 ZINC000135234812 1137964726 /nfs/dbraw/zinc/96/47/26/1137964726.db2.gz YGKULXUPXZRHQF-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1ccc(F)cc1F)C1CC1 ZINC000135234812 1137964727 /nfs/dbraw/zinc/96/47/27/1137964727.db2.gz YGKULXUPXZRHQF-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n[nH]1 ZINC000282961655 1138089494 /nfs/dbraw/zinc/08/94/94/1138089494.db2.gz HXHIAQCPNJMODN-CYBMUJFWSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n[nH]1 ZINC000282961655 1138089496 /nfs/dbraw/zinc/08/94/96/1138089496.db2.gz HXHIAQCPNJMODN-CYBMUJFWSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)[nH]n1 ZINC000282961655 1138089498 /nfs/dbraw/zinc/08/94/98/1138089498.db2.gz HXHIAQCPNJMODN-CYBMUJFWSA-N 1 1 334.807 3.659 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)[nH]n1 ZINC000282961655 1138089500 /nfs/dbraw/zinc/08/95/00/1138089500.db2.gz HXHIAQCPNJMODN-CYBMUJFWSA-N 1 1 334.807 3.659 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c1 ZINC000075864319 1138129132 /nfs/dbraw/zinc/12/91/32/1138129132.db2.gz IGBQYBOENWCBDO-SFHVURJKSA-N 1 1 326.396 3.634 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241019 /nfs/dbraw/zinc/24/10/19/1138241019.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000122419296 1138258038 /nfs/dbraw/zinc/25/80/38/1138258038.db2.gz HENTUDPNXYKWHI-VIFPVBQESA-N 1 1 340.301 3.872 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCCOC1 ZINC000174146209 1139402281 /nfs/dbraw/zinc/40/22/81/1139402281.db2.gz STWSBAGUZAOVGJ-HNNXBMFYSA-N 1 1 337.419 3.805 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000179479052 1139759462 /nfs/dbraw/zinc/75/94/62/1139759462.db2.gz CWWQBZLBWFHOBN-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000179479052 1139759465 /nfs/dbraw/zinc/75/94/65/1139759465.db2.gz CWWQBZLBWFHOBN-WBMJQRKESA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000183928857 1140066588 /nfs/dbraw/zinc/06/65/88/1140066588.db2.gz CXRAMNPHGDCVDV-SNVBAGLBSA-N 1 1 325.821 3.940 20 5 EHBDMO Cc1cccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000266460983 1140690620 /nfs/dbraw/zinc/69/06/20/1140690620.db2.gz MDFKWKYDMGROIL-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000268849017 1141008348 /nfs/dbraw/zinc/00/83/48/1141008348.db2.gz ORHQYZXQLNJPMM-CJNGLKHVSA-N 1 1 343.431 3.715 20 5 EHBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137754 1141507216 /nfs/dbraw/zinc/50/72/16/1141507216.db2.gz GBVYMPDFSRTHBX-WCQYABFASA-N 1 1 346.349 3.739 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1ccsc1 ZINC000348672562 1141564944 /nfs/dbraw/zinc/56/49/44/1141564944.db2.gz LVEPUMLMDBDXQI-UHFFFAOYSA-N 1 1 342.424 3.721 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430208122 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ZINC000602838731 1033199128 /nfs/dbraw/zinc/19/91/28/1033199128.db2.gz BPCPRJVHMYXZSY-SFHVURJKSA-N 1 1 340.427 3.717 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641874 1024301031 /nfs/dbraw/zinc/30/10/31/1024301031.db2.gz MRWWXEVIYQOYGL-KBPBESRZSA-N 1 1 333.432 3.600 20 5 EHBDMO COc1cc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000430096150 1024359967 /nfs/dbraw/zinc/35/99/67/1024359967.db2.gz FVEJGJUOHASEJX-QGZVFWFLSA-N 1 1 334.416 3.623 20 5 EHBDMO COc1cc(C[N@H+]2CC3(CCC3)[C@H]2C(C)C)c([N+](=O)[O-])cc1OC ZINC000430096150 1024359986 /nfs/dbraw/zinc/35/99/86/1024359986.db2.gz FVEJGJUOHASEJX-QGZVFWFLSA-N 1 1 334.416 3.623 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H](c3cccnc3)C2)c(F)c1 ZINC000602852165 1033209558 /nfs/dbraw/zinc/20/95/58/1033209558.db2.gz DDMPIKMHUIVTIV-ZDUSSCGKSA-N 1 1 333.338 3.648 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H](c3cccnc3)C2)c(F)c1 ZINC000602852165 1033209569 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CCc1ccc([C@H](N[C@@H]2CC[C@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513803 1028490040 /nfs/dbraw/zinc/49/00/40/1028490040.db2.gz RNQSIBIAACHOPK-ZBQZNYHESA-N 1 1 343.427 3.557 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ncccc2F)CC1 ZINC000278030701 1028601353 /nfs/dbraw/zinc/60/13/53/1028601353.db2.gz BJLQCMXMZSXFEH-CYBMUJFWSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000324831817 1028692746 /nfs/dbraw/zinc/69/27/46/1028692746.db2.gz CGGCNELQSNNSOE-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC1CCCCC1 ZINC000532755501 1028799545 /nfs/dbraw/zinc/79/95/45/1028799545.db2.gz LHSPHZJLBHEIMY-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO COCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000508546392 1029227486 /nfs/dbraw/zinc/22/74/86/1029227486.db2.gz SFKNDULKOOCFFT-HNNXBMFYSA-N 1 1 344.411 3.813 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1OC(F)F ZINC000583215961 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CKZSZEGSMLFVAR-HNNXBMFYSA-N 1 1 330.384 3.853 20 5 EHBDMO COC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000537626883 1029931649 /nfs/dbraw/zinc/93/16/49/1029931649.db2.gz HKLCSOQNMWRGGP-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868871 1029945289 /nfs/dbraw/zinc/94/52/89/1029945289.db2.gz NZYANAJHMQPGEZ-INIZCTEOSA-N 1 1 348.443 3.581 20 5 EHBDMO Cc1nc(C[C@@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514439 1030110494 /nfs/dbraw/zinc/11/04/94/1030110494.db2.gz BWLNLPPWYBNUAD-HIFRSBDPSA-N 1 1 344.415 3.610 20 5 EHBDMO Cc1cnc(CC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 ZINC000828021166 1030197402 /nfs/dbraw/zinc/19/74/02/1030197402.db2.gz MLHLEGYUBQQWID-UHFFFAOYSA-N 1 1 333.819 3.935 20 5 EHBDMO Cc1cnc(CC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 ZINC000828021166 1030197410 /nfs/dbraw/zinc/19/74/10/1030197410.db2.gz MLHLEGYUBQQWID-UHFFFAOYSA-N 1 1 333.819 3.935 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587025 1030321871 /nfs/dbraw/zinc/32/18/71/1030321871.db2.gz PWWBJURSHFAEKY-UZLBHIALSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587025 1030321889 /nfs/dbraw/zinc/32/18/89/1030321889.db2.gz PWWBJURSHFAEKY-UZLBHIALSA-N 1 1 345.487 3.930 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@H+]1C1CC1 ZINC000583666505 1030394144 /nfs/dbraw/zinc/39/41/44/1030394144.db2.gz BXUPSIHINWMCBK-TZMCWYRMSA-N 1 1 333.432 3.809 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1C[C@H](C)O ZINC000447836902 1030527298 /nfs/dbraw/zinc/52/72/98/1030527298.db2.gz YOVHCEZXVBRMQT-HOCLYGCPSA-N 1 1 336.432 3.507 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607422 1030750033 /nfs/dbraw/zinc/75/00/33/1030750033.db2.gz OSCIMSKGPUCKGO-SWLSCSKDSA-N 1 1 330.388 3.655 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCC[C@@H]1O ZINC000537687568 1030981291 /nfs/dbraw/zinc/98/12/91/1030981291.db2.gz HYTDQOLQYIBJPM-YOEHRIQHSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000483126647 1030987595 /nfs/dbraw/zinc/98/75/95/1030987595.db2.gz VMJOASXJSAFZSE-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483254979 1031066944 /nfs/dbraw/zinc/06/69/44/1031066944.db2.gz IWTQSZFLWAFKHE-KBPBESRZSA-N 1 1 333.432 3.680 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)o1 ZINC000551826595 1031698380 /nfs/dbraw/zinc/69/83/80/1031698380.db2.gz NTAARYCJMYRPON-PKOBYXMFSA-N 1 1 342.395 3.998 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C[N@H+](C)C(C)C)CC1 ZINC000536652118 1032036736 /nfs/dbraw/zinc/03/67/36/1032036736.db2.gz LPPJBVOOBCNHEU-UHFFFAOYSA-N 1 1 349.475 3.546 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000536652118 1032036755 /nfs/dbraw/zinc/03/67/55/1032036755.db2.gz LPPJBVOOBCNHEU-UHFFFAOYSA-N 1 1 349.475 3.546 20 5 EHBDMO CC(=O)c1ccc(NCCCC[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000076795347 1033329428 /nfs/dbraw/zinc/32/94/28/1033329428.db2.gz FNCRYHGHMMUQMJ-AWEZNQCLSA-N 1 1 333.432 3.864 20 5 EHBDMO Cc1nn(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292789 1033555358 /nfs/dbraw/zinc/55/53/58/1033555358.db2.gz NEMYBXOUWMBCEA-WBVHZDCISA-N 1 1 346.456 3.570 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000595020484 1033611612 /nfs/dbraw/zinc/61/16/12/1033611612.db2.gz ZNLRWEJHLOSXKL-BDJLRTHQSA-N 1 1 346.358 3.917 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000595019583 1033612158 /nfs/dbraw/zinc/61/21/58/1033612158.db2.gz RSSQLDVRUKJGCA-QWHCGFSZSA-N 1 1 332.404 3.793 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@H](C)C2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595068076 1033643929 /nfs/dbraw/zinc/64/39/29/1033643929.db2.gz OENAGXLRBYZZQQ-ACJLOTCBSA-N 1 1 344.411 3.590 20 5 EHBDMO CCCCn1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)n1 ZINC000595029196 1033650329 /nfs/dbraw/zinc/65/03/29/1033650329.db2.gz WXZAZTINBQOCGB-AWEZNQCLSA-N 1 1 346.431 3.759 20 5 EHBDMO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000174282476 1033878497 /nfs/dbraw/zinc/87/84/97/1033878497.db2.gz RYFIPTSNMVECOC-GOSISDBHSA-N 1 1 332.375 3.598 20 5 EHBDMO CCCC[N@H+](C)CC1CCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000603857056 1033980759 /nfs/dbraw/zinc/98/07/59/1033980759.db2.gz PHMHRLXLLVSBDY-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000603857056 1033980766 /nfs/dbraw/zinc/98/07/66/1033980766.db2.gz PHMHRLXLLVSBDY-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855098 1033980991 /nfs/dbraw/zinc/98/09/91/1033980991.db2.gz CSSSROPQTXFHNY-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603855098 1033980998 /nfs/dbraw/zinc/98/09/98/1033980998.db2.gz CSSSROPQTXFHNY-GFCCVEGCSA-N 1 1 336.338 3.945 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000179315121 1034107926 /nfs/dbraw/zinc/10/79/26/1034107926.db2.gz FDCAZVVLSZZXRC-UHFFFAOYSA-N 1 1 326.356 3.518 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000179315121 1034107933 /nfs/dbraw/zinc/10/79/33/1034107933.db2.gz FDCAZVVLSZZXRC-UHFFFAOYSA-N 1 1 326.356 3.518 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596168668 1034115548 /nfs/dbraw/zinc/11/55/48/1034115548.db2.gz CHRRYPNPUHPVBC-UHFFFAOYSA-N 1 1 342.321 3.645 20 5 EHBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596478484 1034254065 /nfs/dbraw/zinc/25/40/65/1034254065.db2.gz NXAQIWDHYXDOJG-OAHLLOKOSA-N 1 1 331.416 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@](O)(C4CC4)C3)o2)cc1 ZINC000597205084 1034607642 /nfs/dbraw/zinc/60/76/42/1034607642.db2.gz LHWKUHZPPGUWMQ-LJQANCHMSA-N 1 1 342.395 3.592 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000597247775 1034640703 /nfs/dbraw/zinc/64/07/03/1034640703.db2.gz CBFNWRAAJGSJRZ-QCHNEIPXSA-N 1 1 328.412 3.501 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(CC(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000450689011 1034691672 /nfs/dbraw/zinc/69/16/72/1034691672.db2.gz XKSIPNYNSVUVRD-LLVKDONJSA-N 1 1 342.321 3.513 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[NH+]2Cc3ccccc3C2)c(OC(F)F)c1 ZINC000612779218 1035219174 /nfs/dbraw/zinc/21/91/74/1035219174.db2.gz ZVEPCXFFVYBBSW-UHFFFAOYSA-N 1 1 349.337 3.624 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(Cl)ccc2[N+](=O)[O-])cn1 ZINC000376105546 1035274189 /nfs/dbraw/zinc/27/41/89/1035274189.db2.gz ZLMWTZDZLYWDBY-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000580843410 1035458655 /nfs/dbraw/zinc/45/86/55/1035458655.db2.gz DIPBJWCERLQGNQ-ZDUSSCGKSA-N 1 1 337.301 3.786 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c2ncccc12 ZINC000594596672 1035737890 /nfs/dbraw/zinc/73/78/90/1035737890.db2.gz BAYAFLHWZJROQO-WMLDXEAASA-N 1 1 326.400 3.572 20 5 EHBDMO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120123494 1036393765 /nfs/dbraw/zinc/39/37/65/1036393765.db2.gz APSJKHFVNMHLIA-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120123494 1036393778 /nfs/dbraw/zinc/39/37/78/1036393778.db2.gz APSJKHFVNMHLIA-ZDUSSCGKSA-N 1 1 345.374 3.583 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000026224939 1036397528 /nfs/dbraw/zinc/39/75/28/1036397528.db2.gz XHGAXMNCMMUPIP-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)C1CCCCC1 ZINC000491197729 1036398561 /nfs/dbraw/zinc/39/85/61/1036398561.db2.gz XNBLZKZVVGPMMU-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000535375717 1036416300 /nfs/dbraw/zinc/41/63/00/1036416300.db2.gz XAKGACSZGAXOAT-INIZCTEOSA-N 1 1 332.787 3.902 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000589494486 1036436262 /nfs/dbraw/zinc/43/62/62/1036436262.db2.gz QZASANKMNITPDT-GOSISDBHSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000589494486 1036436273 /nfs/dbraw/zinc/43/62/73/1036436273.db2.gz QZASANKMNITPDT-GOSISDBHSA-N 1 1 340.379 3.501 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000589521243 1036491955 /nfs/dbraw/zinc/49/19/55/1036491955.db2.gz OEWWMJBZFRXCBE-UHFFFAOYSA-N 1 1 338.407 3.959 20 5 EHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000589521243 1036491964 /nfs/dbraw/zinc/49/19/64/1036491964.db2.gz OEWWMJBZFRXCBE-UHFFFAOYSA-N 1 1 338.407 3.959 20 5 EHBDMO CCC[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541699419 1036567539 /nfs/dbraw/zinc/56/75/39/1036567539.db2.gz FSNVZSQDKAVUAP-LBPRGKRZSA-N 1 1 339.823 3.841 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541699419 1036567554 /nfs/dbraw/zinc/56/75/54/1036567554.db2.gz FSNVZSQDKAVUAP-LBPRGKRZSA-N 1 1 339.823 3.841 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000464781906 1036778058 /nfs/dbraw/zinc/77/80/58/1036778058.db2.gz WTFMTTYNPMRUFN-SFHVURJKSA-N 1 1 333.432 3.744 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H]3Cc3ccccc3)c2c1 ZINC000026235877 1036844056 /nfs/dbraw/zinc/84/40/56/1036844056.db2.gz OBRXLFOKULTMLD-KRWDZBQOSA-N 1 1 336.395 3.609 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(Cl)cc1 ZINC000007266168 1037023226 /nfs/dbraw/zinc/02/32/26/1037023226.db2.gz XPNAAZZVALNCBV-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000007266168 1037023242 /nfs/dbraw/zinc/02/32/42/1037023242.db2.gz XPNAAZZVALNCBV-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO COCC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761511989 1037083862 /nfs/dbraw/zinc/08/38/62/1037083862.db2.gz ZKFYSDAKCVTCTK-UHFFFAOYSA-N 1 1 334.803 3.897 20 5 EHBDMO COc1ccc2oc(C[N@@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2c1 ZINC000539830295 1037254892 /nfs/dbraw/zinc/25/48/92/1037254892.db2.gz YUJIDWYXLIXJPH-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO COc1ccc2oc(C[N@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2c1 ZINC000539830295 1037254903 /nfs/dbraw/zinc/25/49/03/1037254903.db2.gz YUJIDWYXLIXJPH-UHFFFAOYSA-N 1 1 338.363 3.908 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318609 1037283931 /nfs/dbraw/zinc/28/39/31/1037283931.db2.gz VGVLMWBJMVZROP-QGZVFWFLSA-N 1 1 326.396 3.901 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532470206 1037414062 /nfs/dbraw/zinc/41/40/62/1037414062.db2.gz CFUNJGIUYAJXOM-QANKJYHBSA-N 1 1 345.443 3.742 20 5 EHBDMO CN(C)C(C)(C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491365647 1037422246 /nfs/dbraw/zinc/42/22/46/1037422246.db2.gz FIRDUYWBWCQLHS-GOSISDBHSA-N 1 1 327.428 3.614 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053809 1037531580 /nfs/dbraw/zinc/53/15/80/1037531580.db2.gz FQUKDQQPUXBILH-ZOBUZTSGSA-N 1 1 347.459 3.673 20 5 EHBDMO O=[N+]([O-])c1ncccc1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000591827504 1037639424 /nfs/dbraw/zinc/63/94/24/1037639424.db2.gz QHVBNVTWFAGDFM-OAHLLOKOSA-N 1 1 329.425 3.747 20 5 EHBDMO COc1ccc(C[N@H+](Cc2ccc(C)nc2)CC2CC2)cc1[N+](=O)[O-] ZINC000592145479 1037866369 /nfs/dbraw/zinc/86/63/69/1037866369.db2.gz RWNSVYZSRMAIKV-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)C ZINC000463360801 1038072843 /nfs/dbraw/zinc/07/28/43/1038072843.db2.gz WRGOAQKKWWMWHA-UHFFFAOYSA-N 1 1 327.812 3.555 20 5 EHBDMO Cc1cc(NCC2=CC[N@@H+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461943109 1038689370 /nfs/dbraw/zinc/68/93/70/1038689370.db2.gz QRMLUDVDFACBQE-UHFFFAOYSA-N 1 1 329.322 3.596 20 5 EHBDMO COc1cc(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185524 1038723417 /nfs/dbraw/zinc/72/34/17/1038723417.db2.gz DYBSKHLKUGOSBA-PBHICJAKSA-N 1 1 341.411 3.851 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000552293348 1039164240 /nfs/dbraw/zinc/16/42/40/1039164240.db2.gz YZTYMNPUWAZWHW-VZEGMYIASA-N 1 1 340.423 3.534 20 5 EHBDMO CCOCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000500706722 1039234601 /nfs/dbraw/zinc/23/46/01/1039234601.db2.gz BUKRJHYPWHWCGK-UHFFFAOYSA-N 1 1 348.374 3.995 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574441 1039264087 /nfs/dbraw/zinc/26/40/87/1039264087.db2.gz YGFBWZCWWISFPM-INIZCTEOSA-N 1 1 344.386 3.807 20 5 EHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549465150 1039478983 /nfs/dbraw/zinc/47/89/83/1039478983.db2.gz HXGAKJISGZAREM-NSHDSACASA-N 1 1 343.349 3.818 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440165 1039547296 /nfs/dbraw/zinc/54/72/96/1039547296.db2.gz AIJXJZIAWXBZLI-UONOGXRCSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489100651 1039623679 /nfs/dbraw/zinc/62/36/79/1039623679.db2.gz GISJMASOARRXLT-HNNXBMFYSA-N 1 1 330.359 3.732 20 5 EHBDMO CCCN1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320296 1039676529 /nfs/dbraw/zinc/67/65/29/1039676529.db2.gz JIBMJNZTKZKUDY-LJQANCHMSA-N 1 1 331.460 3.826 20 5 EHBDMO C[C@@H]1C[C@H]([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c2nccn21 ZINC000417347369 1039711486 /nfs/dbraw/zinc/71/14/86/1039711486.db2.gz HAQHCGVBQVHKQZ-DQYPLSBCSA-N 1 1 326.400 3.854 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000428731543 1040117863 /nfs/dbraw/zinc/11/78/63/1040117863.db2.gz YLQDEJMMVNEEAL-JKSUJKDBSA-N 1 1 340.370 3.859 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(C2)CCc2ccccc2O3)c(F)c1 ZINC000573528169 1040154331 /nfs/dbraw/zinc/15/43/31/1040154331.db2.gz WCUVNLTVOXNVFZ-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)c(F)c1 ZINC000573528169 1040154332 /nfs/dbraw/zinc/15/43/32/1040154332.db2.gz WCUVNLTVOXNVFZ-IBGZPJMESA-N 1 1 342.370 3.704 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCO)CC2CC2)s1 ZINC000092506005 1040333928 /nfs/dbraw/zinc/33/39/28/1040333928.db2.gz IIAQSYNUADOLKF-UHFFFAOYSA-N 1 1 332.425 3.528 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000490355377 1040523324 /nfs/dbraw/zinc/52/33/24/1040523324.db2.gz RVLZOBDLRYCXMO-LIRRHRJNSA-N 1 1 326.396 3.902 20 5 EHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051137 1040563792 /nfs/dbraw/zinc/56/37/92/1040563792.db2.gz GLUQZTUZOLYFQO-CXAGYDPISA-N 1 1 328.416 3.616 20 5 EHBDMO CCn1c2ccccc2nc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080347318 1040981867 /nfs/dbraw/zinc/98/18/67/1040981867.db2.gz IVDAFAKPFSJGGH-UHFFFAOYSA-N 1 1 338.411 3.989 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2[nH]c(=O)oc2c1 ZINC000586793465 1041027341 /nfs/dbraw/zinc/02/73/41/1041027341.db2.gz GKNHXGRGVASKNL-SECBINFHSA-N 1 1 347.758 3.946 20 5 EHBDMO COCCc1cc[nH+]c(NC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000512865640 1041115249 /nfs/dbraw/zinc/11/52/49/1041115249.db2.gz VCYWLRXWUZGRQD-UVTDQMKNSA-N 1 1 327.384 3.694 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC[C@@H](C)C1 ZINC000481604705 1041145968 /nfs/dbraw/zinc/14/59/68/1041145968.db2.gz ZYHVPOVZUUZLIJ-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@@H](C)C1 ZINC000481604705 1041145974 /nfs/dbraw/zinc/14/59/74/1041145974.db2.gz ZYHVPOVZUUZLIJ-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874913 1041788101 /nfs/dbraw/zinc/78/81/01/1041788101.db2.gz MKILCEHEACYJLG-GFCCVEGCSA-N 1 1 335.429 3.740 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CCO)C3)s2)cc1 ZINC000093105935 1041877092 /nfs/dbraw/zinc/87/70/92/1041877092.db2.gz ZFBPJZMPFYIXGD-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO CCC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC1CC1 ZINC000045003984 1042022214 /nfs/dbraw/zinc/02/22/14/1042022214.db2.gz CTQFQNWCHZPCPN-UHFFFAOYSA-N 1 1 344.358 3.827 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112077765 1042333934 /nfs/dbraw/zinc/33/39/34/1042333934.db2.gz HJGAIVBZNOQZSU-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820817 1042906737 /nfs/dbraw/zinc/90/67/37/1042906737.db2.gz WUSMMBICVPLTBQ-IRXDYDNUSA-N 1 1 336.432 3.716 20 5 EHBDMO CSC1CC[NH+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000305945747 1042962493 /nfs/dbraw/zinc/96/24/93/1042962493.db2.gz HOCKZAXXZDWMHA-UHFFFAOYSA-N 1 1 345.262 3.685 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2cn3ccccc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000279042281 1043236324 /nfs/dbraw/zinc/23/63/24/1043236324.db2.gz JMLLBMCBKRIWES-QGZVFWFLSA-N 1 1 336.395 3.755 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)c2C1 ZINC000344263714 1043552998 /nfs/dbraw/zinc/55/29/98/1043552998.db2.gz QXACPNMXXLKPEE-UHFFFAOYSA-N 1 1 343.358 3.712 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)c2C1 ZINC000344263714 1043553001 /nfs/dbraw/zinc/55/30/01/1043553001.db2.gz QXACPNMXXLKPEE-UHFFFAOYSA-N 1 1 343.358 3.712 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccc(F)cn3)o2)cc1 ZINC000344904853 1044666277 /nfs/dbraw/zinc/66/62/77/1044666277.db2.gz LZFFYMGFEHVKSX-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO CCc1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083136982 1127207844 /nfs/dbraw/zinc/20/78/44/1127207844.db2.gz YPELSAXXJBDTMR-UHFFFAOYSA-N 1 1 325.368 3.930 20 5 EHBDMO CCc1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083136982 1127207849 /nfs/dbraw/zinc/20/78/49/1127207849.db2.gz YPELSAXXJBDTMR-UHFFFAOYSA-N 1 1 325.368 3.930 20 5 EHBDMO Cc1nn(C[N@H+](C)C[C@@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965543 1127559897 /nfs/dbraw/zinc/55/98/97/1127559897.db2.gz YBPJLEBKLLPBNC-CQSZACIVSA-N 1 1 338.411 3.946 20 5 EHBDMO C[N@@H+](CCCNc1ncc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000301290964 1127735054 /nfs/dbraw/zinc/73/50/54/1127735054.db2.gz UHOCXJJVGJJZGJ-UHFFFAOYSA-N 1 1 326.828 3.710 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301286494 1127731705 /nfs/dbraw/zinc/73/17/05/1127731705.db2.gz ROJDZOQVEJPZPH-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208568 1128186347 /nfs/dbraw/zinc/18/63/47/1128186347.db2.gz GQPYBDRGGXIQSZ-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO CC(=O)c1cc(NC[C@H]2CCCC[N@@H+]2CC(C)C)ccc1[N+](=O)[O-] ZINC000553506519 1128458124 /nfs/dbraw/zinc/45/81/24/1128458124.db2.gz CQGUTUMOCDJUQP-MRXNPFEDSA-N 1 1 333.432 3.720 20 5 EHBDMO C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000301554964 1128496509 /nfs/dbraw/zinc/49/65/09/1128496509.db2.gz ICXPBAWNVXSAHO-KOLCDFICSA-N 1 1 329.322 3.651 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548944 /nfs/dbraw/zinc/54/89/44/1128548944.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 1 1 345.487 3.990 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NCc2cc(C)[nH+]c(N3CCCC3)c2)c1 ZINC000338727193 1128770307 /nfs/dbraw/zinc/77/03/07/1128770307.db2.gz YVXJWXOWEOQMCL-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO CCc1ccc([C@H](CO)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000542912647 1128831743 /nfs/dbraw/zinc/83/17/43/1128831743.db2.gz OVCIIVKJZHWIFO-INIZCTEOSA-N 1 1 334.803 3.634 20 5 EHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000301075499 1121358314 /nfs/dbraw/zinc/35/83/14/1121358314.db2.gz FCUUQZBLNYAFTN-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233775 1121822794 /nfs/dbraw/zinc/82/27/94/1121822794.db2.gz JAZOUAPASOPKGF-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233775 1121822801 /nfs/dbraw/zinc/82/28/01/1121822801.db2.gz JAZOUAPASOPKGF-LJQANCHMSA-N 1 1 342.395 3.567 20 5 EHBDMO CC(C)OC(=O)C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000272786596 1122231793 /nfs/dbraw/zinc/23/17/93/1122231793.db2.gz BJVMIPBFAKIBHG-OAHLLOKOSA-N 1 1 348.424 3.829 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007613997 1122409914 /nfs/dbraw/zinc/40/99/14/1122409914.db2.gz HIMGCWOFBIBWTC-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007613997 1122409918 /nfs/dbraw/zinc/40/99/18/1122409918.db2.gz HIMGCWOFBIBWTC-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000917074672 1122471324 /nfs/dbraw/zinc/47/13/24/1122471324.db2.gz CIKUGRYSBWFKRU-UHFFFAOYSA-N 1 1 349.774 3.831 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000917074672 1122471331 /nfs/dbraw/zinc/47/13/31/1122471331.db2.gz CIKUGRYSBWFKRU-UHFFFAOYSA-N 1 1 349.774 3.831 20 5 EHBDMO Cc1ccc(N2CCC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000917089896 1122487873 /nfs/dbraw/zinc/48/78/73/1122487873.db2.gz PSFPJARDPAGWDN-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000917089896 1122487876 /nfs/dbraw/zinc/48/78/76/1122487876.db2.gz PSFPJARDPAGWDN-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180422 1122545399 /nfs/dbraw/zinc/54/53/99/1122545399.db2.gz SOFIZULJYJDBPI-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180422 1122545402 /nfs/dbraw/zinc/54/54/02/1122545402.db2.gz SOFIZULJYJDBPI-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1F ZINC000917830525 1122694415 /nfs/dbraw/zinc/69/44/15/1122694415.db2.gz HYAQYKGJLWEELP-UHFFFAOYSA-N 1 1 348.374 3.643 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1 ZINC000609916192 1123691860 /nfs/dbraw/zinc/69/18/60/1123691860.db2.gz DQYYQERBFMYTON-MRXNPFEDSA-N 1 1 344.386 3.677 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000610079930 1123726841 /nfs/dbraw/zinc/72/68/41/1123726841.db2.gz CVBLOWIHJLFZGK-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000610079930 1123726843 /nfs/dbraw/zinc/72/68/43/1123726843.db2.gz CVBLOWIHJLFZGK-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249647 1123754021 /nfs/dbraw/zinc/75/40/21/1123754021.db2.gz CTPDUXWRMYUOHR-CABCVRRESA-N 1 1 335.423 3.825 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000446843446 1125334939 /nfs/dbraw/zinc/33/49/39/1125334939.db2.gz NNLUWKOSCRDPHK-JMPLCFMRSA-N 1 1 340.427 3.611 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070392 1129420739 /nfs/dbraw/zinc/42/07/39/1129420739.db2.gz YJQWGTIAHPTTAD-ZDUSSCGKSA-N 1 1 331.372 3.518 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884131 1129547945 /nfs/dbraw/zinc/54/79/45/1129547945.db2.gz RAWDOSCMDNCLJR-DOMZBBRYSA-N 1 1 326.824 3.764 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155214143 1129619539 /nfs/dbraw/zinc/61/95/39/1129619539.db2.gz HNVBDBSFRRNCRH-QGZVFWFLSA-N 1 1 326.396 3.635 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000391464442 1129668291 /nfs/dbraw/zinc/66/82/91/1129668291.db2.gz ZDSQZFTUUYPUFJ-INMHGKMJSA-N 1 1 338.835 3.764 20 5 EHBDMO CCCn1c2ccccc2nc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000392969669 1129733332 /nfs/dbraw/zinc/73/33/32/1129733332.db2.gz FIDFEEFLXVZPNE-UHFFFAOYSA-N 1 1 338.411 3.953 20 5 EHBDMO CC(=O)c1ccc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044414 1129765201 /nfs/dbraw/zinc/76/52/01/1129765201.db2.gz JUNXAXLRHUVHRM-BBRMVZONSA-N 1 1 345.443 3.862 20 5 EHBDMO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302051575 1129765756 /nfs/dbraw/zinc/76/57/56/1129765756.db2.gz OCOCNFJNRACJEQ-VXGBXAGGSA-N 1 1 338.839 3.708 20 5 EHBDMO Cc1cnc(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)s1 ZINC000282438707 1129822660 /nfs/dbraw/zinc/82/26/60/1129822660.db2.gz HYYZQQZPWFSLPD-UHFFFAOYSA-N 1 1 335.404 3.878 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4[nH]cnc4c3)C2)cc1 ZINC000556165307 1129835366 /nfs/dbraw/zinc/83/53/66/1129835366.db2.gz MGRSVIYHPIHTCP-MRXNPFEDSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccc4nc[nH]c4c3)C2)cc1 ZINC000556165307 1129835372 /nfs/dbraw/zinc/83/53/72/1129835372.db2.gz MGRSVIYHPIHTCP-MRXNPFEDSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4nc[nH]c4c3)C2)cc1 ZINC000556165307 1129835376 /nfs/dbraw/zinc/83/53/76/1129835376.db2.gz MGRSVIYHPIHTCP-MRXNPFEDSA-N 1 1 336.395 3.851 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000227695585 1129917809 /nfs/dbraw/zinc/91/78/09/1129917809.db2.gz WJPWEVOCOHKVPV-IJLUTSLNSA-N 1 1 339.823 3.553 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H](c4ccccc4F)C3)c2c1 ZINC000730455257 1130712440 /nfs/dbraw/zinc/71/24/40/1130712440.db2.gz RPIUAEUZGJZKGY-CQSZACIVSA-N 1 1 340.358 3.531 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000347948963 1131101563 /nfs/dbraw/zinc/10/15/63/1131101563.db2.gz AFVXGANCYUBYLS-AWEZNQCLSA-N 1 1 336.823 3.839 20 5 EHBDMO COc1ccccc1C[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908357 1131887670 /nfs/dbraw/zinc/88/76/70/1131887670.db2.gz CGTKGFPCPUMYKD-GOSISDBHSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](C(F)(F)F)C1)CC2 ZINC001172914275 1131902925 /nfs/dbraw/zinc/90/29/25/1131902925.db2.gz GFDYQZACDTXDLG-ZIAGYGMSSA-N 1 1 328.334 3.726 20 5 EHBDMO CC(C)N1CC[C@@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909653 1131917152 /nfs/dbraw/zinc/91/71/52/1131917152.db2.gz UTFRZSUOMSHIGI-XFQXTVEOSA-N 1 1 345.487 3.551 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2Cc3ccccc3C2)c1F ZINC001173181052 1131992465 /nfs/dbraw/zinc/99/24/65/1131992465.db2.gz BCVFMYNTLFARAA-GFCCVEGCSA-N 1 1 330.359 3.689 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2ccsc2)c1F ZINC001173195171 1131995356 /nfs/dbraw/zinc/99/53/56/1131995356.db2.gz CSZNIQRMHFHAIG-NSHDSACASA-N 1 1 338.404 3.867 20 5 EHBDMO CCCCN1CCC([N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238745 1132028047 /nfs/dbraw/zinc/02/80/47/1132028047.db2.gz XFENHIRWJCVSFV-MRXNPFEDSA-N 1 1 333.476 3.722 20 5 EHBDMO CCCCN1CCC([N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238745 1132028054 /nfs/dbraw/zinc/02/80/54/1132028054.db2.gz XFENHIRWJCVSFV-MRXNPFEDSA-N 1 1 333.476 3.722 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1CCCCCCC1 ZINC000744392952 1132083222 /nfs/dbraw/zinc/08/32/22/1132083222.db2.gz GZYUPXBDHBCUPN-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO CCC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)C ZINC000746145348 1132384553 /nfs/dbraw/zinc/38/45/53/1132384553.db2.gz KNSRGDPULINYFK-UHFFFAOYSA-N 1 1 327.812 3.555 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CC(C)(C)CC(C)(C)C1 ZINC001169006100 1132630586 /nfs/dbraw/zinc/63/05/86/1132630586.db2.gz YFMIEVIQKYANTA-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040150 1132638305 /nfs/dbraw/zinc/63/83/05/1132638305.db2.gz YHTQTDVZJKYHRM-FRFSOERESA-N 1 1 338.835 3.629 20 5 EHBDMO CC[N@@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169045712 1132640986 /nfs/dbraw/zinc/64/09/86/1132640986.db2.gz JTISPAKFDIDFTR-HIFRSBDPSA-N 1 1 330.350 3.973 20 5 EHBDMO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055407 1132644366 /nfs/dbraw/zinc/64/43/66/1132644366.db2.gz PXDFNMORLFYEOR-SLEUVZQESA-N 1 1 341.249 3.887 20 5 EHBDMO CC[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001169495405 1132771182 /nfs/dbraw/zinc/77/11/82/1132771182.db2.gz RGIBIXISCNJULE-WDEREUQCSA-N 1 1 327.222 3.978 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc(C(F)F)nc2)c1 ZINC001178176267 1133138935 /nfs/dbraw/zinc/13/89/35/1133138935.db2.gz IRSKVQNRXWJJAZ-UHFFFAOYSA-N 1 1 327.718 3.871 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000746671973 1133990575 /nfs/dbraw/zinc/99/05/75/1133990575.db2.gz CYRYNVPJZPODHK-IUODEOHRSA-N 1 1 325.840 3.553 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1CCCC[C@@H]1C ZINC001184856781 1133999597 /nfs/dbraw/zinc/99/95/97/1133999597.db2.gz LQXLJTGQOXGAQO-WDEREUQCSA-N 1 1 346.353 3.683 20 5 EHBDMO CC1(C)CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCS1 ZINC000788376550 1134118851 /nfs/dbraw/zinc/11/88/51/1134118851.db2.gz MIBWTEWYXRGQAZ-UHFFFAOYSA-N 1 1 346.456 3.633 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1F ZINC000788479664 1134130136 /nfs/dbraw/zinc/13/01/36/1134130136.db2.gz ZLXQAMVHWAKAGX-KRWDZBQOSA-N 1 1 344.386 3.915 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479727 1134130595 /nfs/dbraw/zinc/13/05/95/1134130595.db2.gz AAOQNCBNVAVBAF-NVXWUHKLSA-N 1 1 349.450 3.820 20 5 EHBDMO C[N@H+]1CCCC[C@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187044812 1134287532 /nfs/dbraw/zinc/28/75/32/1134287532.db2.gz POWXGAXBWIUNRQ-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187044813 1134287596 /nfs/dbraw/zinc/28/75/96/1134287596.db2.gz POWXGAXBWIUNRQ-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347886 1134759376 /nfs/dbraw/zinc/75/93/76/1134759376.db2.gz SUJBEQDEYXABRP-ZDUSSCGKSA-N 1 1 332.375 3.806 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170351624 1134760570 /nfs/dbraw/zinc/76/05/70/1134760570.db2.gz GMDKTUSCAZPJBM-LLVKDONJSA-N 1 1 328.359 3.512 20 5 EHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001191201917 1134814646 /nfs/dbraw/zinc/81/46/46/1134814646.db2.gz CGIGKFCTQOBPFV-CYBMUJFWSA-N 1 1 327.222 3.978 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 ZINC001191184187 1134821153 /nfs/dbraw/zinc/82/11/53/1134821153.db2.gz VEFYAGDIAVMLPU-HNAYVOBHSA-N 1 1 342.443 3.881 20 5 EHBDMO COCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC001193974790 1135208741 /nfs/dbraw/zinc/20/87/41/1135208741.db2.gz CKHAOLVFLRTEFN-SWLSCSKDSA-N 1 1 326.824 3.885 20 5 EHBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834342 1135332847 /nfs/dbraw/zinc/33/28/47/1135332847.db2.gz FWOAMEDKWYVDSD-MSOLQXFVSA-N 1 1 344.411 3.720 20 5 EHBDMO Cc1c(C[N@H+]2C[C@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250332 1135398975 /nfs/dbraw/zinc/39/89/75/1135398975.db2.gz MBUCTEKVNBDKTA-CJNGLKHVSA-N 1 1 348.443 3.703 20 5 EHBDMO Cc1c(C[NH2+][C@H](C)c2nccn2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000806616988 1135471491 /nfs/dbraw/zinc/47/14/91/1135471491.db2.gz OIUXPYQGGYXBMZ-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO O=C(CC[N@H+]1CCCC2(CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001196038399 1135511140 /nfs/dbraw/zinc/51/11/40/1135511140.db2.gz ADRCFSDIRFWWRX-UHFFFAOYSA-N 1 1 345.443 3.970 20 5 EHBDMO C[N@@H+](Cc1cc2ccccc2o1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000747466813 1135631469 /nfs/dbraw/zinc/63/14/69/1135631469.db2.gz HLYPHQAROVZLGI-UHFFFAOYSA-N 1 1 336.351 3.780 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000747466813 1135631473 /nfs/dbraw/zinc/63/14/73/1135631473.db2.gz HLYPHQAROVZLGI-UHFFFAOYSA-N 1 1 336.351 3.780 20 5 EHBDMO COC(=O)CC[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468856 1135693656 /nfs/dbraw/zinc/69/36/56/1135693656.db2.gz OMFCEDPZEFFEGA-HUUCEWRRSA-N 1 1 334.416 3.629 20 5 EHBDMO Cc1ccccc1[C@H](CO)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197818703 1135743382 /nfs/dbraw/zinc/74/33/82/1135743382.db2.gz NDEATSTYYLVCSW-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197818703 1135743386 /nfs/dbraw/zinc/74/33/86/1135743386.db2.gz NDEATSTYYLVCSW-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO CC[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCCC1 ZINC000811474160 1136095770 /nfs/dbraw/zinc/09/57/70/1136095770.db2.gz VUOGYMVOCWTTCX-ZDUSSCGKSA-N 1 1 346.258 3.866 20 5 EHBDMO Cc1ncsc1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811478971 1136097094 /nfs/dbraw/zinc/09/70/94/1136097094.db2.gz UJUGMYQGBZHWQR-UHFFFAOYSA-N 1 1 332.212 3.956 20 5 EHBDMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276665 1136130784 /nfs/dbraw/zinc/13/07/84/1136130784.db2.gz IRXVKSUNGNNAQF-PMACEKPBSA-N 1 1 340.423 3.884 20 5 EHBDMO CC[N@H+](Cc1cccc(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277924 1136130854 /nfs/dbraw/zinc/13/08/54/1136130854.db2.gz QVGNDOKYQUYEKI-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279702 1136134778 /nfs/dbraw/zinc/13/47/78/1136134778.db2.gz XENNFJNEXIYUNE-ROUUACIJSA-N 1 1 330.359 3.604 20 5 EHBDMO C[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000813174477 1136298127 /nfs/dbraw/zinc/29/81/27/1136298127.db2.gz UIUIFUSVDCQGLD-KSSFIOAISA-N 1 1 346.427 3.539 20 5 EHBDMO C[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000813174477 1136298129 /nfs/dbraw/zinc/29/81/29/1136298129.db2.gz UIUIFUSVDCQGLD-KSSFIOAISA-N 1 1 346.427 3.539 20 5 EHBDMO Cc1ccc(C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1C ZINC000776584684 1136442361 /nfs/dbraw/zinc/44/23/61/1136442361.db2.gz ORUNKPLGJWDNEY-FQEVSTJZSA-N 1 1 340.423 3.910 20 5 EHBDMO CC(C)[N@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580024 1136444951 /nfs/dbraw/zinc/44/49/51/1136444951.db2.gz QPEQVZPXECSFCO-GOSISDBHSA-N 1 1 332.375 3.678 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@H](CC(F)(F)F)C3)c2c1 ZINC000817365551 1136803362 /nfs/dbraw/zinc/80/33/62/1136803362.db2.gz OYWPHSYHEMERMB-NSHDSACASA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H](CC(F)(F)F)C3)c2c1 ZINC000817365551 1136803366 /nfs/dbraw/zinc/80/33/66/1136803366.db2.gz OYWPHSYHEMERMB-NSHDSACASA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858013480 1136930633 /nfs/dbraw/zinc/93/06/33/1136930633.db2.gz CYIMXRYHFJUGAR-QGZVFWFLSA-N 1 1 339.395 3.521 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035860 1136934507 /nfs/dbraw/zinc/93/45/07/1136934507.db2.gz LVVHUJVNYVJDLT-HUUCEWRRSA-N 1 1 327.384 3.513 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)CNc2ccc([NH+]3CCCCC3)cc2)c1 ZINC000819393032 1136935402 /nfs/dbraw/zinc/93/54/02/1136935402.db2.gz JNQPKCMQFSVVOO-LJQANCHMSA-N 1 1 341.411 3.731 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820670576 1137000310 /nfs/dbraw/zinc/00/03/10/1137000310.db2.gz RFEFBIPEOMDFIZ-NSHDSACASA-N 1 1 329.803 3.555 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CCSC3)C2)cc1Cl ZINC000825215480 1137169135 /nfs/dbraw/zinc/16/91/35/1137169135.db2.gz PLGIOYFMQGWUKH-HNNXBMFYSA-N 1 1 326.849 3.967 20 5 EHBDMO O=c1[nH]c2c(cc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CCCC2 ZINC000865878816 1137318404 /nfs/dbraw/zinc/31/84/04/1137318404.db2.gz BNLZUFWXFYAEEX-UHFFFAOYSA-N 1 1 347.802 3.517 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171227663 1137353992 /nfs/dbraw/zinc/35/39/92/1137353992.db2.gz ANIDFVWVHQMOPH-AWEZNQCLSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171805315 1137513398 /nfs/dbraw/zinc/51/33/98/1137513398.db2.gz RLTKFOMMLZUHES-INIZCTEOSA-N 1 1 345.443 3.744 20 5 EHBDMO C[C@H](NC[C@@H](c1cccs1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017572 1137564745 /nfs/dbraw/zinc/56/47/45/1137564745.db2.gz CJEZCOYSCCEICF-FZMZJTMJSA-N 1 1 337.420 3.749 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccnc(N2CCCC2)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020209 1137565064 /nfs/dbraw/zinc/56/50/64/1137565064.db2.gz FHWXYNHJCSHMRH-CYBMUJFWSA-N 1 1 344.390 3.580 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000872047684 1137567719 /nfs/dbraw/zinc/56/77/19/1137567719.db2.gz COJRLOYNOCUDQC-QMTHXVAHSA-N 1 1 332.429 3.768 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1nccnc1C ZINC000872130591 1137573168 /nfs/dbraw/zinc/57/31/68/1137573168.db2.gz JJYSPIPFTJLSJZ-PWSUYJOCSA-N 1 1 332.429 3.827 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@H](C3CC3)C2)o1 ZINC000878323657 1137710975 /nfs/dbraw/zinc/71/09/75/1137710975.db2.gz BASXXAOKQGVUTE-NSHDSACASA-N 1 1 348.790 3.530 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCCC3(CCCC3)C2)o1 ZINC000878480409 1137717559 /nfs/dbraw/zinc/71/75/59/1137717559.db2.gz CMRAAKCISNKZJI-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(C3CCC3)CC2)o1 ZINC000878914696 1137731963 /nfs/dbraw/zinc/73/19/63/1137731963.db2.gz HRYVEIOKJQHJQT-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878995707 1137734726 /nfs/dbraw/zinc/73/47/26/1137734726.db2.gz UXGCDPWXOYHXDY-QWHCGFSZSA-N 1 1 330.388 3.798 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000127647379 1137744286 /nfs/dbraw/zinc/74/42/86/1137744286.db2.gz YPKBDQCXWQOYMG-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879688730 1137755370 /nfs/dbraw/zinc/75/53/70/1137755370.db2.gz CSCUYTHNNQNJOS-KSSFIOAISA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879688730 1137755371 /nfs/dbraw/zinc/75/53/71/1137755371.db2.gz CSCUYTHNNQNJOS-KSSFIOAISA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880100290 1137768101 /nfs/dbraw/zinc/76/81/01/1137768101.db2.gz YUCHMMIMFZFENE-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO C[N@@H+](Cc1ccccc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000129270523 1137816171 /nfs/dbraw/zinc/81/61/71/1137816171.db2.gz PZQMLDXSTVIWCY-UHFFFAOYSA-N 1 1 335.201 3.989 20 5 EHBDMO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@H]1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883376758 1137858053 /nfs/dbraw/zinc/85/80/53/1137858053.db2.gz SJGFSBXFASNPQY-BKGUAONASA-N 1 1 329.375 3.853 20 5 EHBDMO C[C@H]([NH2+][C@@H]1c2ccccc2CC[C@@H]1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883376759 1137858120 /nfs/dbraw/zinc/85/81/20/1137858120.db2.gz SJGFSBXFASNPQY-GEWABHDNSA-N 1 1 329.375 3.853 20 5 EHBDMO CN(C)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865592 1137889778 /nfs/dbraw/zinc/88/97/78/1137889778.db2.gz QQTBWHXXMDYZOK-QGZVFWFLSA-N 1 1 333.819 3.641 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000331687777 1137917215 /nfs/dbraw/zinc/91/72/15/1137917215.db2.gz XNBDLGJLYAQZSF-MRXNPFEDSA-N 1 1 342.443 3.963 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000331687777 1137917216 /nfs/dbraw/zinc/91/72/16/1137917216.db2.gz XNBDLGJLYAQZSF-MRXNPFEDSA-N 1 1 342.443 3.963 20 5 EHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432287 1137930162 /nfs/dbraw/zinc/93/01/62/1137930162.db2.gz GGIQPPGTYDMNQX-HNNXBMFYSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802706 1137960888 /nfs/dbraw/zinc/96/08/88/1137960888.db2.gz CWZZOVNBHGBCGR-HKUYNNGSSA-N 1 1 344.386 3.822 20 5 EHBDMO COc1cccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC(C)C)c1 ZINC000885971012 1138029508 /nfs/dbraw/zinc/02/95/08/1138029508.db2.gz NFWXQLXBECYYTF-UHFFFAOYSA-N 1 1 329.400 3.657 20 5 EHBDMO COc1cccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])CC(C)C)c1 ZINC000885971012 1138029510 /nfs/dbraw/zinc/02/95/10/1138029510.db2.gz NFWXQLXBECYYTF-UHFFFAOYSA-N 1 1 329.400 3.657 20 5 EHBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930116 1138044307 /nfs/dbraw/zinc/04/43/07/1138044307.db2.gz RYHYJPWCHHMWNE-CVEARBPZSA-N 1 1 332.425 3.699 20 5 EHBDMO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122750 1138048916 /nfs/dbraw/zinc/04/89/16/1138048916.db2.gz JOANPULIIDJUGO-GUYCJALGSA-N 1 1 327.384 3.582 20 5 EHBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000886122750 1138048919 /nfs/dbraw/zinc/04/89/19/1138048919.db2.gz JOANPULIIDJUGO-GUYCJALGSA-N 1 1 327.384 3.582 20 5 EHBDMO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000091413234 1138219358 /nfs/dbraw/zinc/21/93/58/1138219358.db2.gz SUQSJWCHIWQBAE-PIGZYNQJSA-N 1 1 336.338 3.911 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300682 1138467948 /nfs/dbraw/zinc/46/79/48/1138467948.db2.gz VLPWEPZQMFZOPV-AWEZNQCLSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607134 1139144815 /nfs/dbraw/zinc/14/48/15/1139144815.db2.gz YQPOBXYELWYWTR-HOTGVXAUSA-N 1 1 349.475 3.765 20 5 EHBDMO CCCO[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177064670 1139595172 /nfs/dbraw/zinc/59/51/72/1139595172.db2.gz IQOLHRSGUBKRQP-AWEZNQCLSA-N 1 1 333.388 3.517 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1O ZINC000182747627 1139989786 /nfs/dbraw/zinc/98/97/86/1139989786.db2.gz JMRRIISHKBMBTK-ZDUSSCGKSA-N 1 1 330.384 3.810 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cnn(C(C)C)c1C ZINC000191266430 1140449579 /nfs/dbraw/zinc/44/95/79/1140449579.db2.gz QEGYUEGPDWSVJX-GFCCVEGCSA-N 1 1 332.404 3.540 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000266914339 1140737348 /nfs/dbraw/zinc/73/73/48/1140737348.db2.gz MLGBLSZBZRTKIX-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO CCOc1ccccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000268847088 1141006567 /nfs/dbraw/zinc/00/65/67/1141006567.db2.gz GKZFNMPVFZHSCM-ZDUSSCGKSA-N 1 1 330.384 3.853 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC000339167646 1141516185 /nfs/dbraw/zinc/51/61/85/1141516185.db2.gz AFPZMBLWDFEXFY-OAHLLOKOSA-N 1 1 344.333 3.616 20 5 EHBDMO CCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000348676187 1141565802 /nfs/dbraw/zinc/56/58/02/1141565802.db2.gz SGBRIOBZLJEWII-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349059077 1141630943 /nfs/dbraw/zinc/63/09/43/1141630943.db2.gz BFCNHDZQEILWAF-FOWTUZBSSA-N 1 1 341.411 3.542 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000052244792 214122548 /nfs/dbraw/zinc/12/25/48/214122548.db2.gz OPIZTFNMWWDMJT-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@H](OC2CCCC2)C(F)(F)F)cs1 ZINC000594969031 1033577294 /nfs/dbraw/zinc/57/72/94/1033577294.db2.gz UZVWSUZJZCIZPT-NSHDSACASA-N 1 1 338.351 3.636 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000536673377 1032106410 /nfs/dbraw/zinc/10/64/10/1032106410.db2.gz PWXPNCUEQLHYEE-CQSZACIVSA-N 1 1 344.411 3.762 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCc3cn[nH]c3C2)c2ccccc2)c1 ZINC000359895407 1015910313 /nfs/dbraw/zinc/91/03/13/1015910313.db2.gz GWIYINRSQQWNND-YLJYHZDGSA-N 1 1 348.406 3.554 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246944342 1016192899 /nfs/dbraw/zinc/19/28/99/1016192899.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246944342 1016192902 /nfs/dbraw/zinc/19/29/02/1016192902.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246944342 1016192905 /nfs/dbraw/zinc/19/29/05/1016192905.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 1 1 329.444 3.605 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247033843 1016336657 /nfs/dbraw/zinc/33/66/57/1016336657.db2.gz MLYVLIAIEDFPKY-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc([S@@](C)=O)cc1 ZINC000247033843 1016336665 /nfs/dbraw/zinc/33/66/65/1016336665.db2.gz MLYVLIAIEDFPKY-ZAMGYDSWSA-N 1 1 332.425 3.525 20 5 EHBDMO COC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000538281148 1032269161 /nfs/dbraw/zinc/26/91/61/1032269161.db2.gz YHZGRJILQCQTPQ-HNNXBMFYSA-N 1 1 338.766 3.865 20 5 EHBDMO CC(C)n1nccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449501590 1032682597 /nfs/dbraw/zinc/68/25/97/1032682597.db2.gz QCDRCNXWEFFFIL-INIZCTEOSA-N 1 1 328.416 3.752 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000177242542 1017602370 /nfs/dbraw/zinc/60/23/70/1017602370.db2.gz SJLTUPUEZRNPAJ-SNVBAGLBSA-N 1 1 344.358 3.825 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000574200717 1032738662 /nfs/dbraw/zinc/73/86/62/1032738662.db2.gz DWIHXFTUGXXKOY-FLIBITNWSA-N 1 1 325.412 3.806 20 5 EHBDMO C[C@H](N[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997944 1018934179 /nfs/dbraw/zinc/93/41/79/1018934179.db2.gz CRGBNLRVOJOOIM-JTDSTZFVSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997944 1018934189 /nfs/dbraw/zinc/93/41/89/1018934189.db2.gz CRGBNLRVOJOOIM-JTDSTZFVSA-N 1 1 339.439 3.908 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000050231546 1019364192 /nfs/dbraw/zinc/36/41/92/1019364192.db2.gz ALOQIYDKRFAQBE-GOSISDBHSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000050231546 1019364206 /nfs/dbraw/zinc/36/42/06/1019364206.db2.gz ALOQIYDKRFAQBE-GOSISDBHSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)c2ncccc12 ZINC000433809158 1019636086 /nfs/dbraw/zinc/63/60/86/1019636086.db2.gz IEMMBBMKPRKZGA-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO C[C@@H]([NH3+])C[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439051 1032844271 /nfs/dbraw/zinc/84/42/71/1032844271.db2.gz YTLRXHSYSYLSJH-MNOVXSKESA-N 1 1 337.807 3.724 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000182970068 1019860523 /nfs/dbraw/zinc/86/05/23/1019860523.db2.gz QJIXSGDGBJIGTC-HZPDHXFCSA-N 1 1 342.443 3.652 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169795 1020498884 /nfs/dbraw/zinc/49/88/84/1020498884.db2.gz MGICBUAQHOGBFX-GUYCJALGSA-N 1 1 328.416 3.515 20 5 EHBDMO Cc1cc(C)c(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c(C)c1 ZINC000602524219 1032936471 /nfs/dbraw/zinc/93/64/71/1032936471.db2.gz LLJNZISCBLYUKP-UHFFFAOYSA-N 1 1 325.368 3.951 20 5 EHBDMO CCC(CC)[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518432820 1021179060 /nfs/dbraw/zinc/17/90/60/1021179060.db2.gz GJSIDGDOXUAXOK-UHFFFAOYSA-N 1 1 327.812 3.697 20 5 EHBDMO COC(=O)c1oc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1C ZINC000602744068 1021232372 /nfs/dbraw/zinc/23/23/72/1021232372.db2.gz ODDJGBVHJATGMH-UHFFFAOYSA-N 1 1 346.383 3.696 20 5 EHBDMO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC1CCCCC1 ZINC000507581758 1021373245 /nfs/dbraw/zinc/37/32/45/1021373245.db2.gz DFNGUCRWTACRFN-UHFFFAOYSA-N 1 1 333.432 3.826 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2ccccc2n1 ZINC000337702346 1021879172 /nfs/dbraw/zinc/87/91/72/1021879172.db2.gz GEMFBDFJSPFAOB-UHFFFAOYSA-N 1 1 337.379 3.832 20 5 EHBDMO CC1CCC([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000045913742 1021916526 /nfs/dbraw/zinc/91/65/26/1021916526.db2.gz NZDBADUSZIFBMJ-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000441172292 1022031225 /nfs/dbraw/zinc/03/12/25/1022031225.db2.gz AEXLDJZZTUAUDF-CPFIRTDXSA-N 1 1 340.427 3.786 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000441172292 1022031241 /nfs/dbraw/zinc/03/12/41/1022031241.db2.gz AEXLDJZZTUAUDF-CPFIRTDXSA-N 1 1 340.427 3.786 20 5 EHBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602672659 1033052669 /nfs/dbraw/zinc/05/26/69/1033052669.db2.gz ZTGIEJXEMAOPMQ-OAHLLOKOSA-N 1 1 346.349 3.598 20 5 EHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226127 1022586943 /nfs/dbraw/zinc/58/69/43/1022586943.db2.gz WFRQDXZGIGODBT-CHWSQXEVSA-N 1 1 342.436 3.849 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000438563096 1022792673 /nfs/dbraw/zinc/79/26/73/1022792673.db2.gz SAFXHYSZZXACHI-DOJUMQAQSA-N 1 1 340.427 3.749 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932539 1033087195 /nfs/dbraw/zinc/08/71/95/1033087195.db2.gz FDHXMDMTPRCGKJ-IBGZPJMESA-N 1 1 342.395 3.819 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507233861 1023206937 /nfs/dbraw/zinc/20/69/37/1023206937.db2.gz PPZXYOSDYYOSFS-IFXJQAMLSA-N 1 1 326.396 3.902 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494864 1023352049 /nfs/dbraw/zinc/35/20/49/1023352049.db2.gz HIZJUVAOCIPLJF-WDEREUQCSA-N 1 1 327.812 3.553 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000610782705 1023509172 /nfs/dbraw/zinc/50/91/72/1023509172.db2.gz MXAFNUIRASCQEW-UHFFFAOYSA-N 1 1 343.214 3.539 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000610782705 1023509177 /nfs/dbraw/zinc/50/91/77/1023509177.db2.gz MXAFNUIRASCQEW-UHFFFAOYSA-N 1 1 343.214 3.539 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1OC(C)C ZINC000610800058 1023693756 /nfs/dbraw/zinc/69/37/56/1023693756.db2.gz QXPVJOLSECWULG-AWEZNQCLSA-N 1 1 329.400 3.936 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000176270071 1023949165 /nfs/dbraw/zinc/94/91/65/1023949165.db2.gz MSIRLEVTEFGLMH-IBGZPJMESA-N 1 1 348.406 3.591 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000610995094 1024007377 /nfs/dbraw/zinc/00/73/77/1024007377.db2.gz FCJGPPOMGGVECT-UHFFFAOYSA-N 1 1 325.412 3.825 20 5 EHBDMO CC(C)[N@H+]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000514186232 1024205679 /nfs/dbraw/zinc/20/56/79/1024205679.db2.gz IKOQZSVYYUQYPC-UHFFFAOYSA-N 1 1 331.338 3.534 20 5 EHBDMO Cc1noc([C@H]2CCC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)n1 ZINC000091832829 1024387869 /nfs/dbraw/zinc/38/78/69/1024387869.db2.gz AXDSJGADBYJSJJ-HNNXBMFYSA-N 1 1 344.415 3.789 20 5 EHBDMO CCOc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccc1O ZINC000346304441 1024629848 /nfs/dbraw/zinc/62/98/48/1024629848.db2.gz BTPMNVCQSOJPOY-UHFFFAOYSA-N 1 1 336.775 3.642 20 5 EHBDMO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383927372 1024634600 /nfs/dbraw/zinc/63/46/00/1024634600.db2.gz RZLKOBUNVLYCMS-DOTOQJQBSA-N 1 1 325.412 3.917 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)c1cncs1 ZINC000934197032 1024667552 /nfs/dbraw/zinc/66/75/52/1024667552.db2.gz YJTOTNRTHQTQEN-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602887555 1033236087 /nfs/dbraw/zinc/23/60/87/1033236087.db2.gz NUJDRFXTUXIEIC-QGZVFWFLSA-N 1 1 348.406 3.570 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(OC)c1 ZINC000505667851 1024819290 /nfs/dbraw/zinc/81/92/90/1024819290.db2.gz WMHVKMVMSADHFN-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(OC)c1 ZINC000505667851 1024819306 /nfs/dbraw/zinc/81/93/06/1024819306.db2.gz WMHVKMVMSADHFN-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001168403615 1033252461 /nfs/dbraw/zinc/25/24/61/1033252461.db2.gz OKKXDRKYBTXSNA-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO CC[C@H](C)c1nnc([C@@H](C)[NH2+]CC=Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000277436412 1025095507 /nfs/dbraw/zinc/09/55/07/1025095507.db2.gz NZZYEAJBZJLFKI-BPDPDCLSSA-N 1 1 329.404 3.590 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2ccc(F)cc2[nH]1 ZINC000515332110 1025174002 /nfs/dbraw/zinc/17/40/02/1025174002.db2.gz QIJUVEFJMUUOBB-UHFFFAOYSA-N 1 1 327.359 3.890 20 5 EHBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175844 1025248397 /nfs/dbraw/zinc/24/83/97/1025248397.db2.gz YWGYTLLQRQNCTP-QGZVFWFLSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175844 1025248405 /nfs/dbraw/zinc/24/84/05/1025248405.db2.gz YWGYTLLQRQNCTP-QGZVFWFLSA-N 1 1 343.427 3.819 20 5 EHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467886 1025465978 /nfs/dbraw/zinc/46/59/78/1025465978.db2.gz OHVOOXVKXRUJFQ-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(=O)c1ccc(NC[C@@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000023386313 1025994641 /nfs/dbraw/zinc/99/46/41/1025994641.db2.gz AYIFDILOIOMQJT-KRWDZBQOSA-N 1 1 343.383 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550472376 1026067688 /nfs/dbraw/zinc/06/76/88/1026067688.db2.gz SPQGDSLZJLSXKB-SFHVURJKSA-N 1 1 346.814 3.864 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000550472376 1026067703 /nfs/dbraw/zinc/06/77/03/1026067703.db2.gz SPQGDSLZJLSXKB-SFHVURJKSA-N 1 1 346.814 3.864 20 5 EHBDMO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542846 1026088917 /nfs/dbraw/zinc/08/89/17/1026088917.db2.gz AJYGJHLIPRTLGI-RISCZKNCSA-N 1 1 332.429 3.695 20 5 EHBDMO Cc1nnc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542846 1026088933 /nfs/dbraw/zinc/08/89/33/1026088933.db2.gz AJYGJHLIPRTLGI-RISCZKNCSA-N 1 1 332.429 3.695 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000478437790 1026102525 /nfs/dbraw/zinc/10/25/25/1026102525.db2.gz VLSJQJOLNSZNLF-UHFFFAOYSA-N 1 1 348.406 3.734 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cn2cc(Cl)ccc2n1 ZINC000511123753 1026245389 /nfs/dbraw/zinc/24/53/89/1026245389.db2.gz RJPBBAYNEKMDRJ-UHFFFAOYSA-N 1 1 344.802 3.570 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611609565 1026316281 /nfs/dbraw/zinc/31/62/81/1026316281.db2.gz PBHDAEGPLBDCEK-CYBMUJFWSA-N 1 1 328.359 3.922 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](OC(F)F)C2)cc1[N+](=O)[O-] ZINC000611609565 1026316295 /nfs/dbraw/zinc/31/62/95/1026316295.db2.gz PBHDAEGPLBDCEK-CYBMUJFWSA-N 1 1 328.359 3.922 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000451834712 1026316308 /nfs/dbraw/zinc/31/63/08/1026316308.db2.gz JFGFLKXGDSFPQK-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000451834712 1026316320 /nfs/dbraw/zinc/31/63/20/1026316320.db2.gz JFGFLKXGDSFPQK-KRWDZBQOSA-N 1 1 328.368 3.794 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475287495 1026443067 /nfs/dbraw/zinc/44/30/67/1026443067.db2.gz VIJBSSWDMPGSAZ-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475287496 1026443336 /nfs/dbraw/zinc/44/33/36/1026443336.db2.gz VIJBSSWDMPGSAZ-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)(C)C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067675 1026460878 /nfs/dbraw/zinc/46/08/78/1026460878.db2.gz ANXGCSRRGIAFLO-CYBMUJFWSA-N 1 1 344.415 3.903 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025945846 1026504534 /nfs/dbraw/zinc/50/45/34/1026504534.db2.gz VOIFXFJOWYRHRJ-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025945846 1026504543 /nfs/dbraw/zinc/50/45/43/1026504543.db2.gz VOIFXFJOWYRHRJ-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000511156700 1026560980 /nfs/dbraw/zinc/56/09/80/1026560980.db2.gz ACZBOZVJDITGQB-MRXNPFEDSA-N 1 1 347.462 3.850 20 5 EHBDMO CCC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480080371 1026982545 /nfs/dbraw/zinc/98/25/45/1026982545.db2.gz GFGLCKFGCAXABE-HNNXBMFYSA-N 1 1 347.459 3.967 20 5 EHBDMO CCOc1cccc(N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000545864984 1027111392 /nfs/dbraw/zinc/11/13/92/1027111392.db2.gz NKILQSKNTQUALL-UHFFFAOYSA-N 1 1 335.448 3.550 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)C(C)C ZINC000028842940 1027119290 /nfs/dbraw/zinc/11/92/90/1027119290.db2.gz ZCGUZEKFTSHFNU-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000187800853 1027273456 /nfs/dbraw/zinc/27/34/56/1027273456.db2.gz KLZABSOQGHUWGG-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO Cc1cnc(NCc2ccccc2C[N@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000078631105 1028036745 /nfs/dbraw/zinc/03/67/45/1028036745.db2.gz WDUPQJUMWRBXGU-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2cc(C)ccc21 ZINC000178728710 1028376625 /nfs/dbraw/zinc/37/66/25/1028376625.db2.gz FQFWLMZOEJLYAQ-QGZVFWFLSA-N 1 1 342.395 3.915 20 5 EHBDMO C[C@H](N[C@H]1CC[NH2+]C[C@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398883 1028413259 /nfs/dbraw/zinc/41/32/59/1028413259.db2.gz PDHVOOPINYJCKS-IPYPFGDCSA-N 1 1 345.468 3.972 20 5 EHBDMO CC[C@@H](NC[C@H]1[NH2+]CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437954 1028446760 /nfs/dbraw/zinc/44/67/60/1028446760.db2.gz URCVDPDIFXEXQY-RTBURBONSA-N 1 1 325.412 3.523 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC000523701851 1028557008 /nfs/dbraw/zinc/55/70/08/1028557008.db2.gz NCVLGUZIKZMKKG-IBGZPJMESA-N 1 1 328.387 3.984 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCSC[C@H]1c1ccccc1 ZINC000523791358 1028628040 /nfs/dbraw/zinc/62/80/40/1028628040.db2.gz XZNZEHVJVSGBEC-KRWDZBQOSA-N 1 1 344.436 3.764 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000532737526 1028775116 /nfs/dbraw/zinc/77/51/16/1028775116.db2.gz ZGYPVPAJNHYASL-SFHVURJKSA-N 1 1 342.370 3.971 20 5 EHBDMO Cc1ccccc1[C@@H](C)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532930527 1029056951 /nfs/dbraw/zinc/05/69/51/1029056951.db2.gz WWQACEZVUNBBBS-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccccc1[C@@H](C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532930527 1029056968 /nfs/dbraw/zinc/05/69/68/1029056968.db2.gz WWQACEZVUNBBBS-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925023 1029109328 /nfs/dbraw/zinc/10/93/28/1029109328.db2.gz RSHIXXWFPALGIU-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925023 1029109333 /nfs/dbraw/zinc/10/93/33/1029109333.db2.gz RSHIXXWFPALGIU-SMDDNHRTSA-N 1 1 332.322 3.699 20 5 EHBDMO CCC(CC)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000533268646 1029568626 /nfs/dbraw/zinc/56/86/26/1029568626.db2.gz PGMIZDORFIMXJP-UHFFFAOYSA-N 1 1 339.823 3.840 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000533290614 1029583930 /nfs/dbraw/zinc/58/39/30/1029583930.db2.gz LVBLZEGHPBBNCO-MRXNPFEDSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)[C@@H]1C=C[C@@H](CO)C1 ZINC000347387819 1029719305 /nfs/dbraw/zinc/71/93/05/1029719305.db2.gz ZOXCAMRCBVLWBC-GDBMZVCRSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)[C@@H]1C=C[C@@H](CO)C1 ZINC000347387819 1029719310 /nfs/dbraw/zinc/71/93/10/1029719310.db2.gz ZOXCAMRCBVLWBC-GDBMZVCRSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@H]2/C=C\c2ccccc2)n1 ZINC000441173633 1029866958 /nfs/dbraw/zinc/86/69/58/1029866958.db2.gz CNLLEDBNAKUUBN-LENZSSGSSA-N 1 1 340.427 3.749 20 5 EHBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000531867875 1029942905 /nfs/dbraw/zinc/94/29/05/1029942905.db2.gz KBHBWSGKDKQNPI-HNNXBMFYSA-N 1 1 334.416 3.539 20 5 EHBDMO CC(C)Cn1ccnc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898445 1030008911 /nfs/dbraw/zinc/00/89/11/1030008911.db2.gz YFZLYMITNQCCMA-QGZVFWFLSA-N 1 1 328.416 3.615 20 5 EHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980950 1030127398 /nfs/dbraw/zinc/12/73/98/1030127398.db2.gz XVBMJJKQEKDPQY-OCCSQVGLSA-N 1 1 330.359 3.818 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000453356605 1030149979 /nfs/dbraw/zinc/14/99/79/1030149979.db2.gz MZEFSHRLABMCFP-NSHDSACASA-N 1 1 331.372 3.710 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327133 1030265810 /nfs/dbraw/zinc/26/58/10/1030265810.db2.gz XWTWASJTLPYNLB-KBXCAEBGSA-N 1 1 342.443 3.823 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000520411929 1030489692 /nfs/dbraw/zinc/48/96/92/1030489692.db2.gz NCYPJICVJWBJOH-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO C[N@H+](CC[C@@H]1CCCO1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000343451372 1030949336 /nfs/dbraw/zinc/94/93/36/1030949336.db2.gz YFUZRRHQAVYFRY-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000343451372 1030949353 /nfs/dbraw/zinc/94/93/53/1030949353.db2.gz YFUZRRHQAVYFRY-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000278590486 1031543059 /nfs/dbraw/zinc/54/30/59/1031543059.db2.gz DLQJFDXNJJWHFS-UHFFFAOYSA-N 1 1 340.427 3.820 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728739 1031663230 /nfs/dbraw/zinc/66/32/30/1031663230.db2.gz CPDQPXJSTPIIGJ-AGIUHOORSA-N 1 1 330.388 3.511 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000052906484 1032003057 /nfs/dbraw/zinc/00/30/57/1032003057.db2.gz CKMDWAGLQUGZSE-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000052906484 1032003065 /nfs/dbraw/zinc/00/30/65/1032003065.db2.gz CKMDWAGLQUGZSE-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603054322 1033329677 /nfs/dbraw/zinc/32/96/77/1033329677.db2.gz IJXHOYSNPPILOL-LBPRGKRZSA-N 1 1 332.404 3.759 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1 ZINC000063481923 1033388907 /nfs/dbraw/zinc/38/89/07/1033388907.db2.gz YFKNSWPLSWDHFC-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)cc1OC ZINC000598972733 1033621820 /nfs/dbraw/zinc/62/18/20/1033621820.db2.gz DLZFSRJIFGGJMF-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO CCOc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(F)cc1OC ZINC000598977937 1033626461 /nfs/dbraw/zinc/62/64/61/1033626461.db2.gz QOOJHXDZJYPGEQ-UHFFFAOYSA-N 1 1 348.374 3.739 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994761 1033647806 /nfs/dbraw/zinc/64/78/06/1033647806.db2.gz RGFDQAPAFNDOIE-HNNXBMFYSA-N 1 1 343.427 3.676 20 5 EHBDMO COCC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccco1 ZINC000595035081 1033655370 /nfs/dbraw/zinc/65/53/70/1033655370.db2.gz URPHZHKVRKGDJZ-IUODEOHRSA-N 1 1 334.372 3.625 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599035739 1033663980 /nfs/dbraw/zinc/66/39/80/1033663980.db2.gz NDHSKZNZGQIULZ-AWEZNQCLSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327733 1033727963 /nfs/dbraw/zinc/72/79/63/1033727963.db2.gz RHQZDZMLUCNZRI-JKSUJKDBSA-N 1 1 329.400 3.968 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c2ccncc21 ZINC000599164780 1033780856 /nfs/dbraw/zinc/78/08/56/1033780856.db2.gz MJYXGYLMZZXPDS-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO C[N@@H+](CCc1nsc2ccccc21)CCc1ccccc1[N+](=O)[O-] ZINC000595485117 1033809330 /nfs/dbraw/zinc/80/93/30/1033809330.db2.gz RTCNLOAHSIHIOW-UHFFFAOYSA-N 1 1 341.436 3.922 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000595502893 1033834696 /nfs/dbraw/zinc/83/46/96/1033834696.db2.gz XDMPCGDITXZYKJ-MRXNPFEDSA-N 1 1 341.411 3.638 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC2CC2)cn1 ZINC000595562433 1033843218 /nfs/dbraw/zinc/84/32/18/1033843218.db2.gz KWARKYPUBNPUMS-UHFFFAOYSA-N 1 1 329.375 3.850 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC2CC2)cn1 ZINC000595562433 1033843228 /nfs/dbraw/zinc/84/32/28/1033843228.db2.gz KWARKYPUBNPUMS-UHFFFAOYSA-N 1 1 329.375 3.850 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545133 1033856132 /nfs/dbraw/zinc/85/61/32/1033856132.db2.gz ONLPOFYETGAMMF-HNNXBMFYSA-N 1 1 327.384 3.661 20 5 EHBDMO CC(C)C[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)N(C)C ZINC000608835786 1033907651 /nfs/dbraw/zinc/90/76/51/1033907651.db2.gz QNRLKZIUBMCGNZ-OAHLLOKOSA-N 1 1 345.443 3.921 20 5 EHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000603868003 1033994002 /nfs/dbraw/zinc/99/40/02/1033994002.db2.gz IHOVFOOKEXZFQA-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC([C@H]4CCCCO4)CC3)nc2c1 ZINC000595787482 1033998277 /nfs/dbraw/zinc/99/82/77/1033998277.db2.gz JDTBABATGBUFCS-MRXNPFEDSA-N 1 1 345.399 3.517 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1 ZINC000595788259 1033999468 /nfs/dbraw/zinc/99/94/68/1033999468.db2.gz HOEYLHIGZDOHEK-VQIMIIECSA-N 1 1 348.443 3.645 20 5 EHBDMO O=C(C[N@H+]1CCC[C@@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896348 1034003153 /nfs/dbraw/zinc/00/31/53/1034003153.db2.gz OOMSGTDZLFPLKM-MRXNPFEDSA-N 1 1 331.416 3.578 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC4(CCCC4)C3)o2)cc1 ZINC000537616743 1034166625 /nfs/dbraw/zinc/16/66/25/1034166625.db2.gz XJOZDWGEGGFESW-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC4(CCCC4)C3)o2)cc1 ZINC000537616743 1034166632 /nfs/dbraw/zinc/16/66/32/1034166632.db2.gz XJOZDWGEGGFESW-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450381272 1034214563 /nfs/dbraw/zinc/21/45/63/1034214563.db2.gz ULDKJSBLZKZNHY-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000604435951 1034380115 /nfs/dbraw/zinc/38/01/15/1034380115.db2.gz OHAMOWXAWCUCHW-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484500 1034387887 /nfs/dbraw/zinc/38/78/87/1034387887.db2.gz XTIZHPBZDJBEGL-MRXNPFEDSA-N 1 1 328.368 3.516 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000604484462 1034388325 /nfs/dbraw/zinc/38/83/25/1034388325.db2.gz PMMTYFLFIMXJLW-MRXNPFEDSA-N 1 1 328.368 3.646 20 5 EHBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000604492766 1034400347 /nfs/dbraw/zinc/40/03/47/1034400347.db2.gz UEDLPQUXILUXMG-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000604492766 1034400354 /nfs/dbraw/zinc/40/03/54/1034400354.db2.gz UEDLPQUXILUXMG-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000054349128 1034405512 /nfs/dbraw/zinc/40/55/12/1034405512.db2.gz UHHYAFLGDGRLMO-ZDUSSCGKSA-N 1 1 348.447 3.535 20 5 EHBDMO C[C@H](c1ccccc1)[C@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600318 1034551443 /nfs/dbraw/zinc/55/14/43/1034551443.db2.gz NGSUKYRUVHZTSN-FOIQADDNSA-N 1 1 340.423 3.724 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)s1 ZINC000597231201 1034612865 /nfs/dbraw/zinc/61/28/65/1034612865.db2.gz OHBOIKSYPMEDCS-KGLIPLIRSA-N 1 1 344.436 3.792 20 5 EHBDMO C[C@@H](NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000601931591 1034828236 /nfs/dbraw/zinc/82/82/36/1034828236.db2.gz BAZBIDPVUNPTMO-QLFBSQMISA-N 1 1 341.411 3.511 20 5 EHBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425156 1034847550 /nfs/dbraw/zinc/84/75/50/1034847550.db2.gz FQUKDQQPUXBILH-ZMSDIMECSA-N 1 1 347.459 3.673 20 5 EHBDMO COc1cc(C[N@H+]2CCSC3(CCC3)CC2)c([N+](=O)[O-])cc1F ZINC000411877755 1035065423 /nfs/dbraw/zinc/06/54/23/1035065423.db2.gz UBOAPWBSPMUQOB-UHFFFAOYSA-N 1 1 340.420 3.604 20 5 EHBDMO CC(C)(C)c1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452592 1035127838 /nfs/dbraw/zinc/12/78/38/1035127838.db2.gz YMMNZCBSAZQKRF-GOSISDBHSA-N 1 1 342.443 3.926 20 5 EHBDMO COc1cc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000180065983 1035348482 /nfs/dbraw/zinc/34/84/82/1035348482.db2.gz VVUCCIYMEFYASC-HXUWFJFHSA-N 1 1 349.390 3.878 20 5 EHBDMO Cc1c(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cnn1C ZINC000581766147 1035565420 /nfs/dbraw/zinc/56/54/20/1035565420.db2.gz JIOAZSPHOMMMNI-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO Cc1c(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cnn1C ZINC000581766147 1035565425 /nfs/dbraw/zinc/56/54/25/1035565425.db2.gz JIOAZSPHOMMMNI-UHFFFAOYSA-N 1 1 340.383 3.529 20 5 EHBDMO CCCC[N@@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000045003889 1035601828 /nfs/dbraw/zinc/60/18/28/1035601828.db2.gz RDAKHUAQZOWKKP-UHFFFAOYSA-N 1 1 332.347 3.827 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[N@H+](C)C(C)C ZINC000582247923 1035720733 /nfs/dbraw/zinc/72/07/33/1035720733.db2.gz UQKFBVMCOFIKME-LSDHHAIUSA-N 1 1 339.505 3.784 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[N@@H+](C)C(C)C ZINC000582247923 1035720745 /nfs/dbraw/zinc/72/07/45/1035720745.db2.gz UQKFBVMCOFIKME-LSDHHAIUSA-N 1 1 339.505 3.784 20 5 EHBDMO CC[C@H](C)[N@@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047258 1035956118 /nfs/dbraw/zinc/95/61/18/1035956118.db2.gz YTZPWSOFVASMBX-SMDDNHRTSA-N 1 1 333.354 3.518 20 5 EHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1c(Cl)cncc1[N+](=O)[O-] ZINC000589108497 1036254976 /nfs/dbraw/zinc/25/49/76/1036254976.db2.gz UPIQGGXLQGUHDZ-UHFFFAOYSA-N 1 1 348.834 3.517 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000464677511 1036651353 /nfs/dbraw/zinc/65/13/53/1036651353.db2.gz AJIDQUASADDTLB-OAHLLOKOSA-N 1 1 330.359 3.560 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000464677511 1036651357 /nfs/dbraw/zinc/65/13/57/1036651357.db2.gz AJIDQUASADDTLB-OAHLLOKOSA-N 1 1 330.359 3.560 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677556 1036651776 /nfs/dbraw/zinc/65/17/76/1036651776.db2.gz LXLOIXRXELUVMC-INIZCTEOSA-N 1 1 344.386 3.732 20 5 EHBDMO CO[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000590173532 1036799667 /nfs/dbraw/zinc/79/96/67/1036799667.db2.gz ZRGHVRUSLXARKY-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169331 1036880819 /nfs/dbraw/zinc/88/08/19/1036880819.db2.gz VLZICBROBABZKZ-ACJLOTCBSA-N 1 1 349.406 3.575 20 5 EHBDMO C[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000443655145 1036978252 /nfs/dbraw/zinc/97/82/52/1036978252.db2.gz NZJROEVXRGGKDT-RYUDHWBXSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000443655145 1036978267 /nfs/dbraw/zinc/97/82/67/1036978267.db2.gz NZJROEVXRGGKDT-RYUDHWBXSA-N 1 1 339.823 3.555 20 5 EHBDMO Cc1sc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1C ZINC000271763069 1037168511 /nfs/dbraw/zinc/16/85/11/1037168511.db2.gz PFZLKVJGCXFFEI-LBPRGKRZSA-N 1 1 347.440 3.871 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000760866757 1037539366 /nfs/dbraw/zinc/53/93/66/1037539366.db2.gz HKZRVCONUFLGHD-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000491667726 1037626064 /nfs/dbraw/zinc/62/60/64/1037626064.db2.gz LRYZGDJTHCYKGE-MRXNPFEDSA-N 1 1 347.440 3.999 20 5 EHBDMO CC[C@]1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000443849836 1037768812 /nfs/dbraw/zinc/76/88/12/1037768812.db2.gz FCAVBEOPDXGLGB-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000443849836 1037768830 /nfs/dbraw/zinc/76/88/30/1037768830.db2.gz FCAVBEOPDXGLGB-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)CC1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000760921149 1037791975 /nfs/dbraw/zinc/79/19/75/1037791975.db2.gz PMVPOIRGCXNEKU-UHFFFAOYSA-N 1 1 344.415 3.903 20 5 EHBDMO Cc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592145636 1037871670 /nfs/dbraw/zinc/87/16/70/1037871670.db2.gz XHUCXDAWIJUJFY-UHFFFAOYSA-N 1 1 341.411 3.589 20 5 EHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1O ZINC000290560828 1037904313 /nfs/dbraw/zinc/90/43/13/1037904313.db2.gz DOAKMCYLKZMDEU-JTQLQIEISA-N 1 1 336.775 3.813 20 5 EHBDMO Cc1cc(Nc2cccc(C[NH+]3CCOCC3)c2)c(F)cc1[N+](=O)[O-] ZINC000461778099 1038605276 /nfs/dbraw/zinc/60/52/76/1038605276.db2.gz HCNLEBIVAYMALA-UHFFFAOYSA-N 1 1 345.374 3.618 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccncc1F ZINC000339172386 1038617410 /nfs/dbraw/zinc/61/74/10/1038617410.db2.gz QXHUGOYAOPWXNH-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO CC(C)(C)c1ccc(NC(=O)[C@H]2CCCc3[nH+]ccn32)cc1[N+](=O)[O-] ZINC000488348771 1039109304 /nfs/dbraw/zinc/10/93/04/1039109304.db2.gz OFVPRFWFPBCVCC-CQSZACIVSA-N 1 1 342.399 3.605 20 5 EHBDMO C[C@H](C[C@H](C)[NH3+])NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593643 1039351464 /nfs/dbraw/zinc/35/14/64/1039351464.db2.gz KIRTVSKWOUTVJY-QWHCGFSZSA-N 1 1 347.390 3.742 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000728918107 1039392173 /nfs/dbraw/zinc/39/21/73/1039392173.db2.gz JEJBMXZAZXGMCD-OALUTQOASA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@H](c1ccc(F)cc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000015443190 1039552427 /nfs/dbraw/zinc/55/24/27/1039552427.db2.gz GLMOHBBFDCXVQN-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1C ZINC000489251773 1039775189 /nfs/dbraw/zinc/77/51/89/1039775189.db2.gz CXZPGDWEMKUKDS-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000489603314 1040100741 /nfs/dbraw/zinc/10/07/41/1040100741.db2.gz HQFRXIFJCQQZDA-CQSZACIVSA-N 1 1 326.396 3.765 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(SCC[N@H+](C)Cc2ccccc2)n1 ZINC000432925593 1040193877 /nfs/dbraw/zinc/19/38/77/1040193877.db2.gz AEVFMLPJPRRXKE-UHFFFAOYSA-N 1 1 331.441 3.831 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000092626566 1040464336 /nfs/dbraw/zinc/46/43/36/1040464336.db2.gz FWZRHNPMWZMTKO-AWEZNQCLSA-N 1 1 328.416 3.675 20 5 EHBDMO CCC1CCC([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000500138438 1040587476 /nfs/dbraw/zinc/58/74/76/1040587476.db2.gz LOMGWEKOXGSXQG-UHFFFAOYSA-N 1 1 333.432 3.824 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccc(F)c2cccnc12 ZINC000029724627 1040881229 /nfs/dbraw/zinc/88/12/29/1040881229.db2.gz DWKGVHXESQLNAV-UHFFFAOYSA-N 1 1 325.343 3.914 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccc(F)c2cccnc12 ZINC000029724627 1040881240 /nfs/dbraw/zinc/88/12/40/1040881240.db2.gz DWKGVHXESQLNAV-UHFFFAOYSA-N 1 1 325.343 3.914 20 5 EHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC000491137929 1040924007 /nfs/dbraw/zinc/92/40/07/1040924007.db2.gz HASDKCMUYLTTFG-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccccc2)n1 ZINC000571107639 1041187114 /nfs/dbraw/zinc/18/71/14/1041187114.db2.gz RLYMUEKCVTUKKH-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccccc2)n1 ZINC000571107639 1041187123 /nfs/dbraw/zinc/18/71/23/1041187123.db2.gz RLYMUEKCVTUKKH-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCNC(=O)OC(C)(C)C ZINC000125250871 1041926956 /nfs/dbraw/zinc/92/69/56/1041926956.db2.gz SDXROIZQEORKOM-CYBMUJFWSA-N 1 1 337.420 3.502 20 5 EHBDMO CC(C)c1ccccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001167779542 1042146388 /nfs/dbraw/zinc/14/63/88/1042146388.db2.gz UYNRDIASYROEFN-INIZCTEOSA-N 1 1 340.427 3.800 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C(C)(C)c1ccccc1 ZINC000585754308 1043024463 /nfs/dbraw/zinc/02/44/63/1043024463.db2.gz GZZZJWSYEQZHHP-UHFFFAOYSA-N 1 1 341.411 3.709 20 5 EHBDMO CC[C@@]1(C)CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344220439 1043454706 /nfs/dbraw/zinc/45/47/06/1043454706.db2.gz QPMWGMOFQPASDK-PXAZEXFGSA-N 1 1 330.388 3.828 20 5 EHBDMO C[N@@H+](CC1CCCCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898364 1043614449 /nfs/dbraw/zinc/61/44/49/1043614449.db2.gz UFBJNLZAODNWRL-UHFFFAOYSA-N 1 1 328.416 3.928 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259846 1044430459 /nfs/dbraw/zinc/43/04/59/1044430459.db2.gz LSLACFRFNZNJRL-CQSZACIVSA-N 1 1 339.395 3.759 20 5 EHBDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259846 1044430465 /nfs/dbraw/zinc/43/04/65/1044430465.db2.gz LSLACFRFNZNJRL-CQSZACIVSA-N 1 1 339.395 3.759 20 5 EHBDMO NC(=[NH+]OCc1c(F)cccc1[N+](=O)[O-])C12CC3CC(CC(C3)C1)C2 ZINC000728910531 1044668754 /nfs/dbraw/zinc/66/87/54/1044668754.db2.gz NSTNZWUVTYYKKQ-UHFFFAOYSA-N 1 1 347.390 3.949 20 5 EHBDMO CCCCN1CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192772048 1126936673 /nfs/dbraw/zinc/93/66/73/1126936673.db2.gz OFRADJYBFMMUOV-IBGZPJMESA-N 1 1 331.460 3.826 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000282220538 1128097508 /nfs/dbraw/zinc/09/75/08/1128097508.db2.gz HYNJQAUBNSDKQW-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H]1C[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000301580724 1128499690 /nfs/dbraw/zinc/49/96/90/1128499690.db2.gz SHSZWXCDCQVXLW-BETUJISGSA-N 1 1 341.839 3.550 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000542704094 1128547592 /nfs/dbraw/zinc/54/75/92/1128547592.db2.gz RRCCQHGRBXKUFV-IBGZPJMESA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000542704094 1128547595 /nfs/dbraw/zinc/54/75/95/1128547595.db2.gz RRCCQHGRBXKUFV-IBGZPJMESA-N 1 1 326.396 3.651 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549035 /nfs/dbraw/zinc/54/90/35/1128549035.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 1 1 345.487 3.990 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc(OC)c1 ZINC000542703601 1128549102 /nfs/dbraw/zinc/54/91/02/1128549102.db2.gz RRIJQILZEWHCRI-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc(C[N@@H+]2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000123120548 1128609589 /nfs/dbraw/zinc/60/95/89/1128609589.db2.gz PPABTBCBVMJTSZ-AOOOYVTPSA-N 1 1 330.331 3.578 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000198098227 1128640224 /nfs/dbraw/zinc/64/02/24/1128640224.db2.gz MYZGHFZOGBLKPN-ZDUSSCGKSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000198098227 1128640225 /nfs/dbraw/zinc/64/02/25/1128640225.db2.gz MYZGHFZOGBLKPN-ZDUSSCGKSA-N 1 1 345.374 3.674 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488974695 1128899472 /nfs/dbraw/zinc/89/94/72/1128899472.db2.gz IVNBWIURMNDNRF-BBRMVZONSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488974695 1128899478 /nfs/dbraw/zinc/89/94/78/1128899478.db2.gz IVNBWIURMNDNRF-BBRMVZONSA-N 1 1 345.374 3.733 20 5 EHBDMO CCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000198629584 1128965684 /nfs/dbraw/zinc/96/56/84/1128965684.db2.gz LTCRAGWJWBKXFA-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000303542974 1121159386 /nfs/dbraw/zinc/15/93/86/1121159386.db2.gz YVSGSYCDTFLVIQ-KRWDZBQOSA-N 1 1 347.462 3.992 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000302268877 1121939912 /nfs/dbraw/zinc/93/99/12/1121939912.db2.gz GPNOAGSTHSFZQL-HZMBPMFUSA-N 1 1 344.242 3.822 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cnc1NCCC[N@H+]1CCc2ccccc2C1 ZINC000301747782 1129025865 /nfs/dbraw/zinc/02/58/65/1129025865.db2.gz RIGRANGFCFUIAR-UHFFFAOYSA-N 1 1 346.818 3.504 20 5 EHBDMO CC(=O)c1ccc(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301196423 1122423186 /nfs/dbraw/zinc/42/31/86/1122423186.db2.gz UJRMMZNPQIPSAW-ZDUSSCGKSA-N 1 1 333.432 3.720 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000917088273 1122485611 /nfs/dbraw/zinc/48/56/11/1122485611.db2.gz HMZUDKFEBFXUPC-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccco2)C1 ZINC000154388991 1122600753 /nfs/dbraw/zinc/60/07/53/1122600753.db2.gz CFMTUOYSLNUCSV-COXVUDFISA-N 1 1 330.384 3.694 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000255314090 1129068417 /nfs/dbraw/zinc/06/84/17/1129068417.db2.gz ZZZQJZDQMSEYMZ-BHSUKZTGSA-N 1 1 342.395 3.882 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](Cc1ccco1)C[C@@H]1CCCO1 ZINC000255314090 1129068422 /nfs/dbraw/zinc/06/84/22/1129068422.db2.gz ZZZQJZDQMSEYMZ-BHSUKZTGSA-N 1 1 342.395 3.882 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000498893749 1123100533 /nfs/dbraw/zinc/10/05/33/1123100533.db2.gz JUNCCWDALTUWAO-UHFFFAOYSA-N 1 1 342.395 3.591 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569435 1125363842 /nfs/dbraw/zinc/36/38/42/1125363842.db2.gz CKBYRUPCGACMKL-AXUOBQJMSA-N 1 1 332.444 3.746 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)c2C1 ZINC000066514476 1129179781 /nfs/dbraw/zinc/17/97/81/1129179781.db2.gz YQUGNOPWRCWXKB-UHFFFAOYSA-N 1 1 345.424 3.943 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)c2C1 ZINC000066514476 1129179783 /nfs/dbraw/zinc/17/97/83/1129179783.db2.gz YQUGNOPWRCWXKB-UHFFFAOYSA-N 1 1 345.424 3.943 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181738 1129316449 /nfs/dbraw/zinc/31/64/49/1129316449.db2.gz IYXZSELUSQFTLB-GJZGRUSLSA-N 1 1 331.416 3.518 20 5 EHBDMO Cc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000301984761 1129485995 /nfs/dbraw/zinc/48/59/95/1129485995.db2.gz CESWSVCZGTUIDE-ZDUSSCGKSA-N 1 1 337.383 3.559 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000466489443 1129489542 /nfs/dbraw/zinc/48/95/42/1129489542.db2.gz RKCFGWGKLKNRHH-HNNXBMFYSA-N 1 1 333.432 3.744 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000092436353 1129546059 /nfs/dbraw/zinc/54/60/59/1129546059.db2.gz ZZZQJZDQMSEYMZ-NTSMAEHXSA-N 1 1 342.395 3.882 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000092436353 1129546062 /nfs/dbraw/zinc/54/60/62/1129546062.db2.gz ZZZQJZDQMSEYMZ-NTSMAEHXSA-N 1 1 342.395 3.882 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092485400 1129548546 /nfs/dbraw/zinc/54/85/46/1129548546.db2.gz OHBGQELCUQLXGE-KSSFIOAISA-N 1 1 340.427 3.760 20 5 EHBDMO Cc1nccn1CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396906 1129555224 /nfs/dbraw/zinc/55/52/24/1129555224.db2.gz RORQOZUDQNTDPX-UHFFFAOYSA-N 1 1 328.416 3.545 20 5 EHBDMO C[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955484 1129593674 /nfs/dbraw/zinc/59/36/74/1129593674.db2.gz YJLYJYGKEMUJSL-ZUZCIYMTSA-N 1 1 338.766 3.772 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000154947174 1129600964 /nfs/dbraw/zinc/60/09/64/1129600964.db2.gz UUBVJQWKFHQRGD-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000735871622 1131384795 /nfs/dbraw/zinc/38/47/95/1131384795.db2.gz LZFDXLUIUBBTLI-IBGZPJMESA-N 1 1 346.402 3.753 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]4(CCOC4)C3)s2)cc1 ZINC000093820048 1129604821 /nfs/dbraw/zinc/60/48/21/1129604821.db2.gz FJYDYGYNCSNHLK-SFHVURJKSA-N 1 1 344.436 3.936 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)s1 ZINC000093820300 1129604885 /nfs/dbraw/zinc/60/48/85/1129604885.db2.gz VVBIOZISVNKEJQ-GOSISDBHSA-N 1 1 344.436 3.936 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])s1 ZINC000390940174 1129642920 /nfs/dbraw/zinc/64/29/20/1129642920.db2.gz PETXPJUQODYMFF-AWEZNQCLSA-N 1 1 346.456 3.764 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000391839306 1129687815 /nfs/dbraw/zinc/68/78/15/1129687815.db2.gz LSXIRMWTRAIZTQ-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO CC(=O)c1ccc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044417 1129765318 /nfs/dbraw/zinc/76/53/18/1129765318.db2.gz JUNXAXLRHUVHRM-CZUORRHYSA-N 1 1 345.443 3.862 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc(Cl)cc1 ZINC000031005034 1129937068 /nfs/dbraw/zinc/93/70/68/1129937068.db2.gz ZAXBVPVONXIUDM-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000031005034 1129937071 /nfs/dbraw/zinc/93/70/71/1129937071.db2.gz ZAXBVPVONXIUDM-LBPRGKRZSA-N 1 1 347.802 3.707 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000175147157 1130409429 /nfs/dbraw/zinc/40/94/29/1130409429.db2.gz WVUSJPJYJAZACI-CYBMUJFWSA-N 1 1 347.440 3.830 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(C(F)(F)F)cn1 ZINC000282571308 1131101367 /nfs/dbraw/zinc/10/13/67/1131101367.db2.gz ZOHGPSIFDRLIGO-UHFFFAOYSA-N 1 1 339.317 3.683 20 5 EHBDMO Cc1nn(C[N@@H+](C)CC(C)(C)c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742171988 1131692421 /nfs/dbraw/zinc/69/24/21/1131692421.db2.gz RWSYFAHSKVTVHX-UHFFFAOYSA-N 1 1 330.432 3.584 20 5 EHBDMO Cc1nn(C[N@H+](C)CC(C)(C)c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742171988 1131692424 /nfs/dbraw/zinc/69/24/24/1131692424.db2.gz RWSYFAHSKVTVHX-UHFFFAOYSA-N 1 1 330.432 3.584 20 5 EHBDMO CCC[N@H+](CCCN(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914063 1131902510 /nfs/dbraw/zinc/90/25/10/1131902510.db2.gz YSDCBOREFJZZCY-SFHVURJKSA-N 1 1 333.476 3.506 20 5 EHBDMO CCC[N@@H+](CCCN(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914063 1131902516 /nfs/dbraw/zinc/90/25/16/1131902516.db2.gz YSDCBOREFJZZCY-SFHVURJKSA-N 1 1 333.476 3.506 20 5 EHBDMO Cc1cc([C@@H]2CCC[N@H+]2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910417 1131916512 /nfs/dbraw/zinc/91/65/12/1131916512.db2.gz ZFIDFAGNRXRWQF-LPHOPBHVSA-N 1 1 341.411 3.976 20 5 EHBDMO CCC[C@@]1(C)CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000743407399 1131917529 /nfs/dbraw/zinc/91/75/29/1131917529.db2.gz SDAYMELTBKNEBL-SFHVURJKSA-N 1 1 343.431 3.713 20 5 EHBDMO CCC[C@@]1(C)CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000743407399 1131917532 /nfs/dbraw/zinc/91/75/32/1131917532.db2.gz SDAYMELTBKNEBL-SFHVURJKSA-N 1 1 343.431 3.713 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2Cc3ccccc3C2)c1F ZINC001173181055 1131992072 /nfs/dbraw/zinc/99/20/72/1131992072.db2.gz BCVFMYNTLFARAA-LBPRGKRZSA-N 1 1 330.359 3.689 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCCCC2)[C@@H](C)C1 ZINC001173237121 1132025943 /nfs/dbraw/zinc/02/59/43/1132025943.db2.gz HXYIFULWVDTYFY-IRXDYDNUSA-N 1 1 345.487 3.865 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCC[C@H](C)CC1 ZINC000745170673 1132212389 /nfs/dbraw/zinc/21/23/89/1132212389.db2.gz ISKIINHBHZQPBE-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCC[C@H](C)CC1 ZINC000745170673 1132212394 /nfs/dbraw/zinc/21/23/94/1132212394.db2.gz ISKIINHBHZQPBE-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO CC1(F)CC[NH+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001175026025 1132524166 /nfs/dbraw/zinc/52/41/66/1132524166.db2.gz WHDBIFROVCMLSN-UHFFFAOYSA-N 1 1 331.185 3.681 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025939 1132640785 /nfs/dbraw/zinc/64/07/85/1132640785.db2.gz KCLKROIDROIISD-XNRPHZJLSA-N 1 1 342.361 3.940 20 5 EHBDMO Cc1cccc([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001169197577 1132688836 /nfs/dbraw/zinc/68/88/36/1132688836.db2.gz OOQPNRATFPIKCZ-QGZVFWFLSA-N 1 1 326.396 3.772 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000804352047 1132981516 /nfs/dbraw/zinc/98/15/16/1132981516.db2.gz NLRDJWMYEDSYIL-ZDUSSCGKSA-N 1 1 336.392 3.570 20 5 EHBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758652 1133048712 /nfs/dbraw/zinc/04/87/12/1133048712.db2.gz DUXWZSMKXMYGAK-INIZCTEOSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[N@H+]1CCC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541962 1133079677 /nfs/dbraw/zinc/07/96/77/1133079677.db2.gz GYRNHKJGWYSPAE-OAHLLOKOSA-N 1 1 343.427 3.676 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1Cl ZINC000773700943 1133089713 /nfs/dbraw/zinc/08/97/13/1133089713.db2.gz LGFDFAWLESGVEF-DZGCQCFKSA-N 1 1 338.835 3.887 20 5 EHBDMO CO[C@H](C)C(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001181457853 1133489943 /nfs/dbraw/zinc/48/99/43/1133489943.db2.gz LVNMECLGDQCZAC-CYBMUJFWSA-N 1 1 337.423 3.736 20 5 EHBDMO C[N@@H+](CCSCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC001189215681 1134559637 /nfs/dbraw/zinc/55/96/37/1134559637.db2.gz PRSZNVWCPKWEGJ-UHFFFAOYSA-N 1 1 346.452 3.839 20 5 EHBDMO Cc1ccc([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604443 1134582229 /nfs/dbraw/zinc/58/22/29/1134582229.db2.gz JPRXSFICEPHISE-FXAWDEMLSA-N 1 1 340.423 3.735 20 5 EHBDMO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCCC2(F)F)c([N+](=O)[O-])c1 ZINC001170305812 1134740088 /nfs/dbraw/zinc/74/00/88/1134740088.db2.gz QERXGBVDCCXFGI-IAQYHMDHSA-N 1 1 328.359 3.702 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170344336 1134758605 /nfs/dbraw/zinc/75/86/05/1134758605.db2.gz ANQYNCPAECPRFN-AWEZNQCLSA-N 1 1 346.402 3.848 20 5 EHBDMO COc1ccc2c(c1)C[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170347613 1134759416 /nfs/dbraw/zinc/75/94/16/1134759416.db2.gz SFOKPKZMKBUCKZ-ZDUSSCGKSA-N 1 1 342.395 3.559 20 5 EHBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170347613 1134759421 /nfs/dbraw/zinc/75/94/21/1134759421.db2.gz SFOKPKZMKBUCKZ-ZDUSSCGKSA-N 1 1 342.395 3.559 20 5 EHBDMO O=[N+]([O-])CC[N@@H+](Cc1ccccc1OC(F)(F)F)C1CCCC1 ZINC001190912549 1134769010 /nfs/dbraw/zinc/76/90/10/1134769010.db2.gz FBZCNRFBJFRMJK-UHFFFAOYSA-N 1 1 332.322 3.607 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001191214070 1134819275 /nfs/dbraw/zinc/81/92/75/1134819275.db2.gz MAZLJVQMBFBLOU-ZWKOTPCHSA-N 1 1 342.443 3.676 20 5 EHBDMO CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC001191529102 1134880190 /nfs/dbraw/zinc/88/01/90/1134880190.db2.gz ABXGOGSCRRRGMN-HNNXBMFYSA-N 1 1 331.441 3.887 20 5 EHBDMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC001191529102 1134880194 /nfs/dbraw/zinc/88/01/94/1134880194.db2.gz ABXGOGSCRRRGMN-HNNXBMFYSA-N 1 1 331.441 3.887 20 5 EHBDMO COC(=O)c1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1Cl ZINC001192672502 1135043647 /nfs/dbraw/zinc/04/36/47/1135043647.db2.gz HYPIMXFZOVKSQE-NSHDSACASA-N 1 1 348.786 3.886 20 5 EHBDMO Nc1ccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000804386697 1135051842 /nfs/dbraw/zinc/05/18/42/1135051842.db2.gz HFXUPWYHSHQWTH-INIZCTEOSA-N 1 1 340.427 3.501 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC001193954718 1135205868 /nfs/dbraw/zinc/20/58/68/1135205868.db2.gz LDUBLLPGWHSNBP-SCTDSRPQSA-N 1 1 332.444 3.809 20 5 EHBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@H](C)C1 ZINC001194714601 1135311470 /nfs/dbraw/zinc/31/14/70/1135311470.db2.gz IWFYJJRIKUUNMX-WMLDXEAASA-N 1 1 347.459 3.875 20 5 EHBDMO C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001195809866 1135474127 /nfs/dbraw/zinc/47/41/27/1135474127.db2.gz OSVACOKPYYDYOE-HNNXBMFYSA-N 1 1 326.396 3.635 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613092 1135589539 /nfs/dbraw/zinc/58/95/39/1135589539.db2.gz HTUWVHRXYYYZRL-RDFMZFSFSA-N 1 1 332.400 3.560 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000807926237 1135591381 /nfs/dbraw/zinc/59/13/81/1135591381.db2.gz FYNXIYYKJSFAIB-AWEZNQCLSA-N 1 1 333.432 3.864 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001197256213 1135666721 /nfs/dbraw/zinc/66/67/21/1135666721.db2.gz OSWLZZRJLMRRFY-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001197256213 1135666726 /nfs/dbraw/zinc/66/67/26/1135666726.db2.gz OSWLZZRJLMRRFY-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](C3CC3)C2)ccc1Br ZINC000808777067 1135734909 /nfs/dbraw/zinc/73/49/09/1135734909.db2.gz VKTCAMFYLOHOTH-ZDUSSCGKSA-N 1 1 339.233 3.979 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](C3CC3)C2)ccc1Br ZINC000808777067 1135734913 /nfs/dbraw/zinc/73/49/13/1135734913.db2.gz VKTCAMFYLOHOTH-ZDUSSCGKSA-N 1 1 339.233 3.979 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@]2(CCOC2)C1 ZINC000809954054 1135905845 /nfs/dbraw/zinc/90/58/45/1135905845.db2.gz PGCBDYCCMHRLDM-CQSZACIVSA-N 1 1 331.199 3.514 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@]2(CCOC2)C1 ZINC000809954054 1135905847 /nfs/dbraw/zinc/90/58/47/1135905847.db2.gz PGCBDYCCMHRLDM-CQSZACIVSA-N 1 1 331.199 3.514 20 5 EHBDMO CC[C@@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809985753 1135909261 /nfs/dbraw/zinc/90/92/61/1135909261.db2.gz RAHWCURMDMQDHK-AWEZNQCLSA-N 1 1 333.215 3.639 20 5 EHBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809985753 1135909263 /nfs/dbraw/zinc/90/92/63/1135909263.db2.gz RAHWCURMDMQDHK-AWEZNQCLSA-N 1 1 333.215 3.639 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1 ZINC000811454434 1136089110 /nfs/dbraw/zinc/08/91/10/1136089110.db2.gz KVDPKXFRVAURAC-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1 ZINC000811454434 1136089114 /nfs/dbraw/zinc/08/91/14/1136089114.db2.gz KVDPKXFRVAURAC-CYBMUJFWSA-N 1 1 340.379 3.501 20 5 EHBDMO C[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000811484364 1136092074 /nfs/dbraw/zinc/09/20/74/1136092074.db2.gz VJUBXPBZFORUOO-BXKDBHETSA-N 1 1 344.242 3.616 20 5 EHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484364 1136092077 /nfs/dbraw/zinc/09/20/77/1136092077.db2.gz VJUBXPBZFORUOO-BXKDBHETSA-N 1 1 344.242 3.616 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275762 1136130195 /nfs/dbraw/zinc/13/01/95/1136130195.db2.gz HPFAIAFKYMBXLO-LJQANCHMSA-N 1 1 328.412 3.583 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2CCc2ccccc2)cc1 ZINC000776279057 1136133645 /nfs/dbraw/zinc/13/36/45/1136133645.db2.gz WYKOBLSYIXTKMK-QUCCMNQESA-N 1 1 340.423 3.725 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000850470596 1136265638 /nfs/dbraw/zinc/26/56/38/1136265638.db2.gz FGQSLAJAQBMUIX-RYUDHWBXSA-N 1 1 345.355 3.923 20 5 EHBDMO Cn1c2cc(F)ccc2[nH+]c1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000814258347 1136428359 /nfs/dbraw/zinc/42/83/59/1136428359.db2.gz DPESKGGLLJBJQI-UHFFFAOYSA-N 1 1 334.738 3.886 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591398 1136453435 /nfs/dbraw/zinc/45/34/35/1136453435.db2.gz MECOHKIAHSLRCG-QZTJIDSGSA-N 1 1 326.396 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cc1 ZINC000852427128 1136455343 /nfs/dbraw/zinc/45/53/43/1136455343.db2.gz STCNJWMFCBFGOL-WMZOPIPTSA-N 1 1 342.395 3.839 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](Cc2ccccc2F)CC2CC2)c1 ZINC000852563280 1136466719 /nfs/dbraw/zinc/46/67/19/1136466719.db2.gz BEEPYDBKLBOSJR-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000814667696 1136492231 /nfs/dbraw/zinc/49/22/31/1136492231.db2.gz VDVXLLXOYROSNY-YJBOKZPZSA-N 1 1 346.814 3.771 20 5 EHBDMO Cc1ccc2c(c1)C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C2 ZINC000815185512 1136563843 /nfs/dbraw/zinc/56/38/43/1136563843.db2.gz ILCMZTIFDIOSAL-IBGZPJMESA-N 1 1 340.423 3.774 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H](CCO)CC1 ZINC000817296723 1136794282 /nfs/dbraw/zinc/79/42/82/1136794282.db2.gz KFOQKEBOGMDXPF-LLVKDONJSA-N 1 1 347.242 3.886 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H](CCO)CC1 ZINC000817296723 1136794284 /nfs/dbraw/zinc/79/42/84/1136794284.db2.gz KFOQKEBOGMDXPF-LLVKDONJSA-N 1 1 347.242 3.886 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859586368 1137021342 /nfs/dbraw/zinc/02/13/42/1137021342.db2.gz NNUFMVNEJLHNMS-DNVCBOLYSA-N 1 1 326.396 3.639 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1C ZINC001143769969 1137197188 /nfs/dbraw/zinc/19/71/88/1137197188.db2.gz NDDZUHAKRWRAQT-UHFFFAOYSA-N 1 1 347.459 3.548 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N[C@@H]1CCn2cc[nH+]c2C1 ZINC000865689264 1137304627 /nfs/dbraw/zinc/30/46/27/1137304627.db2.gz YOBJBAFKOAMVGD-MRVPVSSYSA-N 1 1 327.171 3.525 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171804858 1137513545 /nfs/dbraw/zinc/51/35/45/1137513545.db2.gz JMGFYLVOCLVSPE-HOCLYGCPSA-N 1 1 345.443 3.824 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC000888572061 1137541450 /nfs/dbraw/zinc/54/14/50/1137541450.db2.gz GBNZRFIKQQJTBF-UHFFFAOYSA-N 1 1 340.383 3.541 20 5 EHBDMO COCCOc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872024064 1137565585 /nfs/dbraw/zinc/56/55/85/1137565585.db2.gz XZPSMJBDCQAKRM-ZDUSSCGKSA-N 1 1 348.374 3.610 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CO)c1ccsc1 ZINC000872064030 1137569207 /nfs/dbraw/zinc/56/92/07/1137569207.db2.gz VKWXWMRIEWGDGM-QMTHXVAHSA-N 1 1 338.454 3.762 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ncccc1N(C)C ZINC000872073138 1137569721 /nfs/dbraw/zinc/56/97/21/1137569721.db2.gz NERALDZNYKHUQC-LBPRGKRZSA-N 1 1 346.456 3.629 20 5 EHBDMO C[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086667 1137570549 /nfs/dbraw/zinc/57/05/49/1137570549.db2.gz BNHWWAMYWLCMDV-ZFWWWQNUSA-N 1 1 335.423 3.507 20 5 EHBDMO Cc1nccnc1[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000872133488 1137573434 /nfs/dbraw/zinc/57/34/34/1137573434.db2.gz NDVKYUNUMYPWHM-BLLLJJGKSA-N 1 1 326.400 3.766 20 5 EHBDMO O=[N+]([O-])c1cnn(C2CC(Nc3ccc([NH+]4CCCCC4)cc3)C2)c1 ZINC000876819656 1137662529 /nfs/dbraw/zinc/66/25/29/1137662529.db2.gz KVQKJRUZXXCRGJ-UHFFFAOYSA-N 1 1 341.415 3.597 20 5 EHBDMO CCn1nc(C)c(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000877663373 1137684853 /nfs/dbraw/zinc/68/48/53/1137684853.db2.gz BAWKSCYVRGMQID-UHFFFAOYSA-N 1 1 336.823 3.713 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1C ZINC000877663373 1137684854 /nfs/dbraw/zinc/68/48/54/1137684854.db2.gz BAWKSCYVRGMQID-UHFFFAOYSA-N 1 1 336.823 3.713 20 5 EHBDMO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1CCCCC1 ZINC000877898854 1137694717 /nfs/dbraw/zinc/69/47/17/1137694717.db2.gz GSLNGQXBMHXSSE-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878152395 1137704719 /nfs/dbraw/zinc/70/47/19/1137704719.db2.gz BBFVUDSLVTYKHE-CYBMUJFWSA-N 1 1 330.388 3.513 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@@H](C3CCCC3)C2)o1 ZINC000878720967 1137726106 /nfs/dbraw/zinc/72/61/06/1137726106.db2.gz RMORJGIZDKGSFJ-CQSZACIVSA-N 1 1 342.399 3.657 20 5 EHBDMO C=C/C=C\CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000878754801 1137727096 /nfs/dbraw/zinc/72/70/96/1137727096.db2.gz BRCFUCVGUDYOFR-BSWVIFLNSA-N 1 1 330.428 3.833 20 5 EHBDMO CC(C)(O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000879628030 1137752824 /nfs/dbraw/zinc/75/28/24/1137752824.db2.gz AALFGEUUWKNAKW-UHFFFAOYSA-N 1 1 346.349 3.597 20 5 EHBDMO CCC[C@H](C)CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000883257589 1137850915 /nfs/dbraw/zinc/85/09/15/1137850915.db2.gz GDLJUUALKIRHIV-WMLDXEAASA-N 1 1 330.432 3.834 20 5 EHBDMO CC[C@H](c1ccncc1)[N@H+](CC)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000131471149 1137853752 /nfs/dbraw/zinc/85/37/52/1137853752.db2.gz AZLRNLSRTKSAHE-QGZVFWFLSA-N 1 1 339.399 3.770 20 5 EHBDMO CC[C@H](c1ccncc1)[N@@H+](CC)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000131471149 1137853753 /nfs/dbraw/zinc/85/37/53/1137853753.db2.gz AZLRNLSRTKSAHE-QGZVFWFLSA-N 1 1 339.399 3.770 20 5 EHBDMO CC[C@H](C)[N@@H+](C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333603 1137912780 /nfs/dbraw/zinc/91/27/80/1137912780.db2.gz KNANKBYVHHSSBI-ZDUSSCGKSA-N 1 1 348.472 3.538 20 5 EHBDMO CCC[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000121060819 1137954811 /nfs/dbraw/zinc/95/48/11/1137954811.db2.gz SPULUNFNDVKWCE-ZDUSSCGKSA-N 1 1 330.388 3.657 20 5 EHBDMO C[N@H+](Cc1csc2ccccc12)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940716 1138044315 /nfs/dbraw/zinc/04/43/15/1138044315.db2.gz DUHZAHACEOHTIE-QGZVFWFLSA-N 1 1 342.420 3.975 20 5 EHBDMO COCCSc1ccc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886109288 1138047500 /nfs/dbraw/zinc/04/75/00/1138047500.db2.gz GXKASRGUUYUALY-CYBMUJFWSA-N 1 1 347.440 3.579 20 5 EHBDMO CCOCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886301160 1138065943 /nfs/dbraw/zinc/06/59/43/1138065943.db2.gz YJHVLDGTKULPLF-SFHVURJKSA-N 1 1 341.411 3.516 20 5 EHBDMO CCOCC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886301160 1138065944 /nfs/dbraw/zinc/06/59/44/1138065944.db2.gz YJHVLDGTKULPLF-SFHVURJKSA-N 1 1 341.411 3.516 20 5 EHBDMO COc1cc(F)c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000089512014 1138200644 /nfs/dbraw/zinc/20/06/44/1138200644.db2.gz SKAYMQHBGFZHTI-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CS[C@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089924792 1138207904 /nfs/dbraw/zinc/20/79/04/1138207904.db2.gz YCTOIVGIYGJQBY-INIZCTEOSA-N 1 1 347.440 3.967 20 5 EHBDMO CC(C)OC(=O)C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000181827438 1139935063 /nfs/dbraw/zinc/93/50/63/1139935063.db2.gz WFCYUGNERAFERZ-QGZVFWFLSA-N 1 1 342.395 3.767 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865707 1140174166 /nfs/dbraw/zinc/17/41/66/1140174166.db2.gz GIMJCOKFJFJNJP-AWEZNQCLSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(C)n1cnnc1[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924398 1140738076 /nfs/dbraw/zinc/73/80/76/1140738076.db2.gz MUKRJPMPPQTOKN-LSDHHAIUSA-N 1 1 343.431 3.708 20 5 EHBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625587 1141128731 /nfs/dbraw/zinc/12/87/31/1141128731.db2.gz CJVFZWRAJVFQOA-WFASDCNBSA-N 1 1 349.456 3.649 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000269629387 1141130132 /nfs/dbraw/zinc/13/01/32/1141130132.db2.gz DUKDFKAULIORRT-GOSISDBHSA-N 1 1 330.384 3.666 20 5 EHBDMO COC[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271212200 1141327145 /nfs/dbraw/zinc/32/71/45/1141327145.db2.gz YRTTYOFBONBLNM-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCOC1 ZINC000339207633 1141528585 /nfs/dbraw/zinc/52/85/85/1141528585.db2.gz ZHQUANIWCLWRAI-CYBMUJFWSA-N 1 1 332.322 3.613 20 5 EHBDMO Cc1ccccc1[C@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246844044 1014259961 /nfs/dbraw/zinc/25/99/61/1014259961.db2.gz KNTSUMGVDXLVHI-LSDHHAIUSA-N 1 1 326.400 3.546 20 5 EHBDMO CO[C@H]1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000536667497 1032090075 /nfs/dbraw/zinc/09/00/75/1032090075.db2.gz DSFVZGATEWAHJQ-INIZCTEOSA-N 1 1 346.358 3.747 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000536667497 1032090099 /nfs/dbraw/zinc/09/00/99/1032090099.db2.gz DSFVZGATEWAHJQ-INIZCTEOSA-N 1 1 346.358 3.747 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346966 1015072958 /nfs/dbraw/zinc/07/29/58/1015072958.db2.gz NTOQKCUDNVCIKN-OAHLLOKOSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1ccccc1 ZINC000198596718 1125493019 /nfs/dbraw/zinc/49/30/19/1125493019.db2.gz FEEALCXOYHKWMQ-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1ccccc1 ZINC000198596718 1125493023 /nfs/dbraw/zinc/49/30/23/1125493023.db2.gz FEEALCXOYHKWMQ-GFCCVEGCSA-N 1 1 347.802 3.707 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226897 1016662709 /nfs/dbraw/zinc/66/27/09/1016662709.db2.gz DJIBNAFALYIQGT-WCQYABFASA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC23CCCCC3)c2c(c1)COCO2 ZINC000408009585 1016896459 /nfs/dbraw/zinc/89/64/59/1016896459.db2.gz LYEUOGFNJMBKBK-UHFFFAOYSA-N 1 1 332.400 3.760 20 5 EHBDMO CC(C)n1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494381 1032658102 /nfs/dbraw/zinc/65/81/02/1032658102.db2.gz AOHBXNHZMDTMPE-QGZVFWFLSA-N 1 1 328.416 3.752 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@H]2/C=C/c2cccs2)c1 ZINC000543990651 1017117918 /nfs/dbraw/zinc/11/79/18/1017117918.db2.gz PLWRAYHAXWYARI-KIUWMYQTSA-N 1 1 346.456 3.811 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000449507234 1032691320 /nfs/dbraw/zinc/69/13/20/1032691320.db2.gz STLDSXKLSMUSKY-DYVFJYSZSA-N 1 1 330.384 3.712 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2cc(N)ccc2O1 ZINC000415025507 1017413696 /nfs/dbraw/zinc/41/36/96/1017413696.db2.gz QILICINSPZXHMN-HNNXBMFYSA-N 1 1 327.384 3.569 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000119081513 1018121143 /nfs/dbraw/zinc/12/11/43/1018121143.db2.gz PFFDATDOPJMABB-ZIAGYGMSSA-N 1 1 329.400 3.913 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(C2CCOCC2)CC1 ZINC000119531620 1018167672 /nfs/dbraw/zinc/16/76/72/1018167672.db2.gz SZSAHZYNBLUUNV-UHFFFAOYSA-N 1 1 338.835 3.887 20 5 EHBDMO C[N@@H+](CCCn1ccnc1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290364595 1018536305 /nfs/dbraw/zinc/53/63/05/1018536305.db2.gz HAPHZXYCBVFHSC-UHFFFAOYSA-N 1 1 340.383 3.573 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000331175017 1018573434 /nfs/dbraw/zinc/57/34/34/1018573434.db2.gz PJUZZYCEIPSLEN-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000331175017 1018573448 /nfs/dbraw/zinc/57/34/48/1018573448.db2.gz PJUZZYCEIPSLEN-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO C[N@@H+](CCNc1ccc2ncccc2c1[N+](=O)[O-])Cc1ccccc1 ZINC000064916263 1018719896 /nfs/dbraw/zinc/71/98/96/1018719896.db2.gz CTHWDIUYCLVOTA-UHFFFAOYSA-N 1 1 336.395 3.687 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026190 1032796684 /nfs/dbraw/zinc/79/66/84/1032796684.db2.gz FLAQUJADDWBYHN-KRWDZBQOSA-N 1 1 334.416 3.527 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000594026190 1032796654 /nfs/dbraw/zinc/79/66/54/1032796654.db2.gz FLAQUJADDWBYHN-KRWDZBQOSA-N 1 1 334.416 3.527 20 5 EHBDMO CC[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427624 1032815499 /nfs/dbraw/zinc/81/54/99/1032815499.db2.gz JFBZSKYVLDHTCJ-XJKSGUPXSA-N 1 1 345.468 3.883 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412991 1019644150 /nfs/dbraw/zinc/64/41/50/1019644150.db2.gz FQJGSDCNOXFQJS-MOTZXUDYSA-N 1 1 348.406 3.905 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)cc1OC(F)F ZINC000433817116 1019654639 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O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCc2ccccc23)c(F)c1 ZINC000610738844 1023403668 /nfs/dbraw/zinc/40/36/68/1023403668.db2.gz MBROSCUDIVYREQ-UHFFFAOYSA-N 1 1 342.370 3.755 20 5 EHBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000449751759 1033166696 /nfs/dbraw/zinc/16/66/96/1033166696.db2.gz AOIMDNUSNCORFH-SAABIXHNSA-N 1 1 326.396 3.981 20 5 EHBDMO CC(C)(C)C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769840 1033184850 /nfs/dbraw/zinc/18/48/50/1033184850.db2.gz COYCVBHBQCCXKR-ZDUSSCGKSA-N 1 1 334.416 3.719 20 5 EHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000522298919 1024184958 /nfs/dbraw/zinc/18/49/58/1024184958.db2.gz LQZGSNVIGAHHSR-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](OCCC(C)C)C1 ZINC000538735962 1024498158 /nfs/dbraw/zinc/49/81/58/1024498158.db2.gz QFGZNWNXYBDZSV-KRWDZBQOSA-N 1 1 336.432 3.631 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](OCCC(C)C)C1 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UAEVPQSULJIEFG-UHFFFAOYSA-N 1 1 346.353 3.685 20 5 EHBDMO Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000478046188 1025623769 /nfs/dbraw/zinc/62/37/69/1025623769.db2.gz IUUMQCCLSNHDSG-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200903 1025642767 /nfs/dbraw/zinc/64/27/67/1025642767.db2.gz OGEPLPOIFJVRNC-SUMWQHHRSA-N 1 1 327.384 3.582 20 5 EHBDMO Cc1ccccc1[C@H]([C@@H](C)NCc1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000443004431 1025656043 /nfs/dbraw/zinc/65/60/43/1025656043.db2.gz DCUCOYVGOFRNTM-UZLBHIALSA-N 1 1 341.455 3.993 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000443067262 1025683810 /nfs/dbraw/zinc/68/38/10/1025683810.db2.gz FHGZWFYMPSLDEI-KGLIPLIRSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1c(C[N@H+](C)[C@@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000451324670 1025826523 /nfs/dbraw/zinc/82/65/23/1025826523.db2.gz LPPMQIOITFIETQ-KRWDZBQOSA-N 1 1 334.803 3.722 20 5 EHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000451355442 1025860874 /nfs/dbraw/zinc/86/08/74/1025860874.db2.gz VCNMCLQGFCRNPC-LZLYRXPVSA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CCC3(CCCCC3)O1)C2 ZINC000522050884 1025917027 /nfs/dbraw/zinc/91/70/27/1025917027.db2.gz AUCVFHQGTYITTA-MRXNPFEDSA-N 1 1 330.428 3.835 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CCC3(CCCCC3)O1)C2 ZINC000522050884 1025917041 /nfs/dbraw/zinc/91/70/41/1025917041.db2.gz AUCVFHQGTYITTA-MRXNPFEDSA-N 1 1 330.428 3.835 20 5 EHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730851 1025917000 /nfs/dbraw/zinc/91/70/00/1025917000.db2.gz QXGRHFSAPVHZKC-GUYCJALGSA-N 1 1 334.416 3.862 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000020813847 1025985479 /nfs/dbraw/zinc/98/54/79/1025985479.db2.gz LMJXXLNEUDNZFI-CQSZACIVSA-N 1 1 327.384 3.535 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)c1ccccc1 ZINC000020813847 1025985490 /nfs/dbraw/zinc/98/54/90/1025985490.db2.gz LMJXXLNEUDNZFI-CQSZACIVSA-N 1 1 327.384 3.535 20 5 EHBDMO Cc1nnc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542841 1026089832 /nfs/dbraw/zinc/08/98/32/1026089832.db2.gz AJYGJHLIPRTLGI-BXUZGUMPSA-N 1 1 332.429 3.695 20 5 EHBDMO Cc1nnc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000451542841 1026089852 /nfs/dbraw/zinc/08/98/52/1026089852.db2.gz AJYGJHLIPRTLGI-BXUZGUMPSA-N 1 1 332.429 3.695 20 5 EHBDMO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544355 1026093153 /nfs/dbraw/zinc/09/31/53/1026093153.db2.gz DYUHQBKSZYUJLL-SWLSCSKDSA-N 1 1 342.399 3.796 20 5 EHBDMO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544355 1026093170 /nfs/dbraw/zinc/09/31/70/1026093170.db2.gz DYUHQBKSZYUJLL-SWLSCSKDSA-N 1 1 342.399 3.796 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000451552605 1026104095 /nfs/dbraw/zinc/10/40/95/1026104095.db2.gz WPZVSABDOJLQPZ-SFHVURJKSA-N 1 1 325.412 3.986 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000451834713 1026318131 /nfs/dbraw/zinc/31/81/31/1026318131.db2.gz JFGFLKXGDSFPQK-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000451834713 1026318143 /nfs/dbraw/zinc/31/81/43/1026318143.db2.gz JFGFLKXGDSFPQK-QGZVFWFLSA-N 1 1 328.368 3.794 20 5 EHBDMO Cc1cccc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c1[N+](=O)[O-] ZINC000302509008 1027173341 /nfs/dbraw/zinc/17/33/41/1027173341.db2.gz RSBQUCOMBQVDPW-AWEZNQCLSA-N 1 1 331.441 3.848 20 5 EHBDMO Cc1ccc(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000121346706 1027213335 /nfs/dbraw/zinc/21/33/35/1027213335.db2.gz ZPZAHQOSPIAOJX-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO Cc1ccc(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] ZINC000121346706 1027213350 /nfs/dbraw/zinc/21/33/50/1027213350.db2.gz ZPZAHQOSPIAOJX-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO C[NH+](C)C(C)(C)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237079955 1027373172 /nfs/dbraw/zinc/37/31/72/1027373172.db2.gz VLZWLKMDNSTEES-UHFFFAOYSA-N 1 1 333.457 3.753 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)[C@H]2C=C[C@H](CO)C2)cc1 ZINC000347332009 1027724360 /nfs/dbraw/zinc/72/43/60/1027724360.db2.gz IPPGQLARFYNDTN-RDJZCZTQSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)[C@H]2C=C[C@H](CO)C2)cc1 ZINC000347332009 1027724378 /nfs/dbraw/zinc/72/43/78/1027724378.db2.gz IPPGQLARFYNDTN-RDJZCZTQSA-N 1 1 344.436 3.596 20 5 EHBDMO CC[N@H+](Cc1ccccc1C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000048059096 1027759160 /nfs/dbraw/zinc/75/91/60/1027759160.db2.gz MGPUNQWAJTWJLW-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO CC[N@@H+](Cc1ccccc1C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000048059096 1027759181 /nfs/dbraw/zinc/75/91/81/1027759181.db2.gz MGPUNQWAJTWJLW-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000366725332 1027850050 /nfs/dbraw/zinc/85/00/50/1027850050.db2.gz WMYDHSMIEBZJGX-LIRRHRJNSA-N 1 1 336.395 3.769 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429057 1027858076 /nfs/dbraw/zinc/85/80/76/1027858076.db2.gz BCMKPZMBCNLTSC-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000533429057 1027858095 /nfs/dbraw/zinc/85/80/95/1027858095.db2.gz BCMKPZMBCNLTSC-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](C4CCCC4)C3)o2)cc1 ZINC000420963899 1027932431 /nfs/dbraw/zinc/93/24/31/1027932431.db2.gz OPERNAAHVNPTSL-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440557824 1028276629 /nfs/dbraw/zinc/27/66/29/1028276629.db2.gz VORCNDRAMKLHHB-ALKREAHSSA-N 1 1 330.428 3.764 20 5 EHBDMO C[NH2+]C[C@H](C)CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285347 1028323938 /nfs/dbraw/zinc/32/39/38/1028323938.db2.gz ZJWABFRPJBNPGT-QWHCGFSZSA-N 1 1 333.457 3.829 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C[NH3+])C1CCCC1 ZINC000423504701 1028469301 /nfs/dbraw/zinc/46/93/01/1028469301.db2.gz NUHVEZGIOZDESX-GJZGRUSLSA-N 1 1 337.489 3.573 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293743369 1028552771 /nfs/dbraw/zinc/55/27/71/1028552771.db2.gz VZJTUPPDWVQBRY-MRXNPFEDSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000293743369 1028552781 /nfs/dbraw/zinc/55/27/81/1028552781.db2.gz VZJTUPPDWVQBRY-MRXNPFEDSA-N 1 1 336.819 3.639 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000523701623 1028554672 /nfs/dbraw/zinc/55/46/72/1028554672.db2.gz MEWIXCOFALJUKY-KRWDZBQOSA-N 1 1 326.396 3.593 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3csc([N+](=O)[O-])c3)c2C1 ZINC000171307438 1028566710 /nfs/dbraw/zinc/56/67/10/1028566710.db2.gz FSQPGRQJDPGHKP-UHFFFAOYSA-N 1 1 331.397 3.634 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3csc([N+](=O)[O-])c3)c2C1 ZINC000171307438 1028566728 /nfs/dbraw/zinc/56/67/28/1028566728.db2.gz FSQPGRQJDPGHKP-UHFFFAOYSA-N 1 1 331.397 3.634 20 5 EHBDMO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000508529784 1028792910 /nfs/dbraw/zinc/79/29/10/1028792910.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000508529784 1028792981 /nfs/dbraw/zinc/79/29/81/1028792981.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO CN1CCC[C@@H](C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000508529784 1028792985 /nfs/dbraw/zinc/79/29/85/1028792985.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 1 1 343.427 3.628 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000228842856 1029138477 /nfs/dbraw/zinc/13/84/77/1029138477.db2.gz RPZZFRIKFQXCSR-NXEZZACHSA-N 1 1 330.215 3.940 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066369 1029235540 /nfs/dbraw/zinc/23/55/40/1029235540.db2.gz WSJVREGQZGKCNL-SUMWQHHRSA-N 1 1 334.416 3.862 20 5 EHBDMO C[C@H](CCN(C)C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237446656 1029310777 /nfs/dbraw/zinc/31/07/77/1029310777.db2.gz JZKGWBQGDUNAEK-CYBMUJFWSA-N 1 1 333.457 3.753 20 5 EHBDMO C[C@H](CC[NH+](C)C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237446656 1029310789 /nfs/dbraw/zinc/31/07/89/1029310789.db2.gz JZKGWBQGDUNAEK-CYBMUJFWSA-N 1 1 333.457 3.753 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](CCO)C3CCCC3)o2)c1 ZINC000505284693 1029441401 /nfs/dbraw/zinc/44/14/01/1029441401.db2.gz YAQWJPYMGJLHRD-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)CCC[C@@H]1C ZINC000533293611 1029586646 /nfs/dbraw/zinc/58/66/46/1029586646.db2.gz WASKHZUVYVWYTL-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525409445 1029840288 /nfs/dbraw/zinc/84/02/88/1029840288.db2.gz ZWWZRGJZHAADCE-BMGDILEWSA-N 1 1 348.443 3.629 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cnc(C3CC3)o2)cc1[N+](=O)[O-] ZINC000453356603 1030149158 /nfs/dbraw/zinc/14/91/58/1030149158.db2.gz MZEFSHRLABMCFP-LLVKDONJSA-N 1 1 331.372 3.710 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000441246511 1030154373 /nfs/dbraw/zinc/15/43/73/1030154373.db2.gz PEJKAABIUQYTON-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1COc3ccc(F)cc31)CCC2 ZINC000447595749 1030330204 /nfs/dbraw/zinc/33/02/04/1030330204.db2.gz AOTLUSMQTYFAKJ-IRXDYDNUSA-N 1 1 328.343 3.835 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1COc3ccc(F)cc31)CCC2 ZINC000447595747 1030331226 /nfs/dbraw/zinc/33/12/26/1030331226.db2.gz AOTLUSMQTYFAKJ-IAGOWNOFSA-N 1 1 328.343 3.835 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000482383577 1030364676 /nfs/dbraw/zinc/36/46/76/1030364676.db2.gz YRDPTKGZIUOMDB-HXUWFJFHSA-N 1 1 338.407 3.925 20 5 EHBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267978 1030514984 /nfs/dbraw/zinc/51/49/84/1030514984.db2.gz PLWBTDCXRCYIBG-CXAGYDPISA-N 1 1 334.416 3.862 20 5 EHBDMO C[N@@H+](CCc1nccs1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093843892 1030683292 /nfs/dbraw/zinc/68/32/92/1030683292.db2.gz IYXCANXIOUUHRK-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000160522027 1030812868 /nfs/dbraw/zinc/81/28/68/1030812868.db2.gz UHNASMBACRUHKZ-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000160522027 1030812894 /nfs/dbraw/zinc/81/28/94/1030812894.db2.gz UHNASMBACRUHKZ-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1cc(F)cc2cccnc21 ZINC000192640702 1030876385 /nfs/dbraw/zinc/87/63/85/1030876385.db2.gz BNHUDZDUJWQUIY-UHFFFAOYSA-N 1 1 325.343 3.914 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1cc(F)cc2cccnc21 ZINC000192640702 1030876405 /nfs/dbraw/zinc/87/64/05/1030876405.db2.gz BNHUDZDUJWQUIY-UHFFFAOYSA-N 1 1 325.343 3.914 20 5 EHBDMO CN(C)c1cccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000537659796 1030914368 /nfs/dbraw/zinc/91/43/68/1030914368.db2.gz RHTRPGLZJITJGS-JXMROGBWSA-N 1 1 325.412 3.806 20 5 EHBDMO CO[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@@H]1C ZINC000249269058 1030921195 /nfs/dbraw/zinc/92/11/95/1030921195.db2.gz ZWAAEZHNAAQICB-BLLLJJGKSA-N 1 1 347.440 3.575 20 5 EHBDMO CO[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@@H]1C ZINC000249269058 1030921214 /nfs/dbraw/zinc/92/12/14/1030921214.db2.gz ZWAAEZHNAAQICB-BLLLJJGKSA-N 1 1 347.440 3.575 20 5 EHBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccccc1 ZINC000611791689 1030925184 /nfs/dbraw/zinc/92/51/84/1030925184.db2.gz BIGNJFLMIXOPNT-UHFFFAOYSA-N 1 1 347.802 3.755 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@H]1c1ccc(Cl)cc1 ZINC000249277073 1030949149 /nfs/dbraw/zinc/94/91/49/1030949149.db2.gz LLIBOTIGPVRNIG-DGCLKSJQSA-N 1 1 338.820 3.562 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@H]1c1ccc(Cl)cc1 ZINC000249277073 1030949162 /nfs/dbraw/zinc/94/91/62/1030949162.db2.gz LLIBOTIGPVRNIG-DGCLKSJQSA-N 1 1 338.820 3.562 20 5 EHBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361713 1030985531 /nfs/dbraw/zinc/98/55/31/1030985531.db2.gz YCOTULQTZAPZBW-HOCLYGCPSA-N 1 1 344.411 3.980 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1cccc(F)c1 ZINC000026223908 1031386521 /nfs/dbraw/zinc/38/65/21/1031386521.db2.gz IQFBRORHHPKLPI-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CCS[C@H]1CCCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761291522 1033540488 /nfs/dbraw/zinc/54/04/88/1033540488.db2.gz MZFMCFAZQHGMLU-HNNXBMFYSA-N 1 1 348.472 3.818 20 5 EHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cc(F)c(F)c(F)c1 ZINC000537528745 1033580342 /nfs/dbraw/zinc/58/03/42/1033580342.db2.gz RKQZXUBNNFCLKR-UHFFFAOYSA-N 1 1 340.301 3.523 20 5 EHBDMO Cc1c(C[NH2+]Cc2cccc(OC3CC3)c2F)cccc1[N+](=O)[O-] ZINC000594940888 1033587730 /nfs/dbraw/zinc/58/77/30/1033587730.db2.gz UTPNLLXXNNKALC-UHFFFAOYSA-N 1 1 330.359 3.873 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000595019584 1033612788 /nfs/dbraw/zinc/61/27/88/1033612788.db2.gz RSSQLDVRUKJGCA-STQMWFEESA-N 1 1 332.404 3.793 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000595085645 1033698577 /nfs/dbraw/zinc/69/85/77/1033698577.db2.gz SPLNLFYTVABTAP-DIFFPNOSSA-N 1 1 328.368 3.647 20 5 EHBDMO C[N@@H+]1CCCC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068692 1033709095 /nfs/dbraw/zinc/70/90/95/1033709095.db2.gz CJHMXCIVKJMZTQ-KSSFIOAISA-N 1 1 331.460 3.639 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068692 1033709110 /nfs/dbraw/zinc/70/91/10/1033709110.db2.gz CJHMXCIVKJMZTQ-KSSFIOAISA-N 1 1 331.460 3.639 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000599072756 1033713914 /nfs/dbraw/zinc/71/39/14/1033713914.db2.gz HIKYCHLDMIVTKF-CRAIPNDOSA-N 1 1 340.427 3.754 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CC[N@H+]2C2CCCC2)ccc2ncccc21 ZINC000599165774 1033781939 /nfs/dbraw/zinc/78/19/39/1033781939.db2.gz SJNAFDJOMJPFAM-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000595715488 1033959536 /nfs/dbraw/zinc/95/95/36/1033959536.db2.gz AKXRIPKPGVBMBX-SFHVURJKSA-N 1 1 342.395 3.584 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000603859150 1033983300 /nfs/dbraw/zinc/98/33/00/1033983300.db2.gz GSKVQSUUEMEMDI-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](C4CCC4)C3)n2)cc1 ZINC000595837052 1034002449 /nfs/dbraw/zinc/00/24/49/1034002449.db2.gz OHFZYDNSGHXYIQ-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000596308350 1034164941 /nfs/dbraw/zinc/16/49/41/1034164941.db2.gz RDUWAESAKUDEEU-NSHDSACASA-N 1 1 343.374 3.729 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c2ncccc12 ZINC000596571258 1034293271 /nfs/dbraw/zinc/29/32/71/1034293271.db2.gz RPXZJNRYONJDEO-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)s1 ZINC000597231205 1034614169 /nfs/dbraw/zinc/61/41/69/1034614169.db2.gz OHBOIKSYPMEDCS-ZIAGYGMSSA-N 1 1 344.436 3.792 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@H](c2ccccc2F)[C@@H](C)O)cccc1[N+](=O)[O-] ZINC000581196319 1035478975 /nfs/dbraw/zinc/47/89/75/1035478975.db2.gz RTXLGSUNXNJKQH-JCGVRSQUSA-N 1 1 332.375 3.815 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573351 1035538449 /nfs/dbraw/zinc/53/84/49/1035538449.db2.gz RJBZRLUDQCVAFT-SJLPKXTDSA-N 1 1 345.830 3.783 20 5 EHBDMO CN1CC[C@@H]([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573351 1035538451 /nfs/dbraw/zinc/53/84/51/1035538451.db2.gz RJBZRLUDQCVAFT-SJLPKXTDSA-N 1 1 345.830 3.783 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000463527853 1035584330 /nfs/dbraw/zinc/58/43/30/1035584330.db2.gz UGLBIQOEGGZCQJ-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492376794 1035707016 /nfs/dbraw/zinc/70/70/16/1035707016.db2.gz NQHFVNKNMISEPC-UHFFFAOYSA-N 1 1 344.411 3.642 20 5 EHBDMO C[C@]12C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000582401933 1035751632 /nfs/dbraw/zinc/75/16/32/1035751632.db2.gz PVUKRJFHFOXQEH-BKTMZONDSA-N 1 1 327.384 3.604 20 5 EHBDMO CC(C)(C)Oc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000443422991 1035819236 /nfs/dbraw/zinc/81/92/36/1035819236.db2.gz AIPVKCZTZVDCHD-LSDHHAIUSA-N 1 1 333.432 3.811 20 5 EHBDMO C[C@H]([NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414191498 1035975902 /nfs/dbraw/zinc/97/59/02/1035975902.db2.gz UDHGDWJATBFGTH-JMPLFQLZSA-N 1 1 348.424 3.580 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000589106404 1036253078 /nfs/dbraw/zinc/25/30/78/1036253078.db2.gz BLAWXSHQLGGNSN-UHFFFAOYSA-N 1 1 340.855 3.592 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2c(F)cccc2OC)ccc1[N+](=O)[O-] ZINC000492938006 1036424118 /nfs/dbraw/zinc/42/41/18/1036424118.db2.gz WRVCRRKTYDYBPM-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CCC(CC)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000165380951 1036440851 /nfs/dbraw/zinc/44/08/51/1036440851.db2.gz NVFTVPHFOSOFJG-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000589518868 1036489008 /nfs/dbraw/zinc/48/90/08/1036489008.db2.gz XERZGQCLGKBYTM-HXUWFJFHSA-N 1 1 338.407 3.873 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1csnn1 ZINC000414295543 1036508905 /nfs/dbraw/zinc/50/89/05/1036508905.db2.gz FLEAVQOKEQGDGR-GHMZBOCLSA-N 1 1 338.458 3.668 20 5 EHBDMO COc1ccc(C2([NH2+]Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000464501106 1036514535 /nfs/dbraw/zinc/51/45/35/1036514535.db2.gz YEVCNJHNSACEST-UHFFFAOYSA-N 1 1 346.358 3.530 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000464838372 1036853807 /nfs/dbraw/zinc/85/38/07/1036853807.db2.gz VLLSUFCBEVSJAC-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC000541935855 1036862117 /nfs/dbraw/zinc/86/21/17/1036862117.db2.gz NAETWWQEKLWUHA-DOTOQJQBSA-N 1 1 340.427 3.854 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2CCCc2ccccc2)c1 ZINC000443650937 1036942354 /nfs/dbraw/zinc/94/23/54/1036942354.db2.gz QMOOHGSHKQNFOO-GOSISDBHSA-N 1 1 342.443 3.669 20 5 EHBDMO CCOc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000590659572 1036996188 /nfs/dbraw/zinc/99/61/88/1036996188.db2.gz AOZGZINAIWZBDH-MRXNPFEDSA-N 1 1 341.411 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](c3ccncc3)C2)cc1 ZINC000590741178 1037039673 /nfs/dbraw/zinc/03/96/73/1037039673.db2.gz ZURKGIDWRBDVNZ-KRWDZBQOSA-N 1 1 341.411 3.638 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493240362 1037104431 /nfs/dbraw/zinc/10/44/31/1037104431.db2.gz VRIYWYIVEOOETC-CYBMUJFWSA-N 1 1 325.840 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000386376620 1037320011 /nfs/dbraw/zinc/32/00/11/1037320011.db2.gz SONDOXPHDAAXQS-QGZVFWFLSA-N 1 1 340.427 3.704 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532470204 1037413933 /nfs/dbraw/zinc/41/39/33/1037413933.db2.gz CFUNJGIUYAJXOM-OWQGQXMQSA-N 1 1 345.443 3.742 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2c(F)cccc2N2CCCC2)c1 ZINC000271858016 1037516231 /nfs/dbraw/zinc/51/62/31/1037516231.db2.gz ICQKUBGQLUOCPN-UHFFFAOYSA-N 1 1 329.375 3.624 20 5 EHBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790588 1037528459 /nfs/dbraw/zinc/52/84/59/1037528459.db2.gz PFZNVOGXPLJXBL-HBUWYVDXSA-N 1 1 344.411 3.836 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@H]2CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000493714459 1037575716 /nfs/dbraw/zinc/57/57/16/1037575716.db2.gz YUZRIMURXWZZDK-HOCLYGCPSA-N 1 1 336.432 3.631 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C)CC1 ZINC000249836048 1037610664 /nfs/dbraw/zinc/61/06/64/1037610664.db2.gz RXSDBQYYTWVLNO-QWHCGFSZSA-N 1 1 330.388 3.828 20 5 EHBDMO COc1c(C)c[nH+]c(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)c1C ZINC000540371411 1037859760 /nfs/dbraw/zinc/85/97/60/1037859760.db2.gz INICTASDNKHNIS-UHFFFAOYSA-N 1 1 346.774 3.667 20 5 EHBDMO C[C@H]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1ccccc1[N+](=O)[O-] ZINC000539381847 1038872657 /nfs/dbraw/zinc/87/26/57/1038872657.db2.gz BJPDZSNPYIZCAB-JTQLQIEISA-N 1 1 334.759 3.828 20 5 EHBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711764 1038956695 /nfs/dbraw/zinc/95/66/95/1038956695.db2.gz NNQIXZIKRILCDB-OAHLLOKOSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711764 1038956705 /nfs/dbraw/zinc/95/67/05/1038956705.db2.gz NNQIXZIKRILCDB-OAHLLOKOSA-N 1 1 343.427 3.819 20 5 EHBDMO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000236808864 1039260588 /nfs/dbraw/zinc/26/05/88/1039260588.db2.gz XWIMLVNDDKEGSE-UHFFFAOYSA-N 1 1 348.424 3.901 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668093 1039385187 /nfs/dbraw/zinc/38/51/87/1039385187.db2.gz ICUGJSLWRZBFEK-DOMZBBRYSA-N 1 1 346.818 3.891 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000728918108 1039392093 /nfs/dbraw/zinc/39/20/93/1039392093.db2.gz JEJBMXZAZXGMCD-RBUKOAKNSA-N 1 1 344.386 3.822 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488988599 1039526274 /nfs/dbraw/zinc/52/62/74/1039526274.db2.gz WEDXLGORCGBLBB-KBPBESRZSA-N 1 1 345.374 3.733 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000488988599 1039526296 /nfs/dbraw/zinc/52/62/96/1039526296.db2.gz WEDXLGORCGBLBB-KBPBESRZSA-N 1 1 345.374 3.733 20 5 EHBDMO COc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991066 1039763566 /nfs/dbraw/zinc/76/35/66/1039763566.db2.gz BOYFCGANNOVSKY-KBXCAEBGSA-N 1 1 345.374 3.600 20 5 EHBDMO COc1cc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991070 1039764405 /nfs/dbraw/zinc/76/44/05/1039764405.db2.gz BOYFCGANNOVSKY-KSSFIOAISA-N 1 1 345.374 3.600 20 5 EHBDMO CC(C)[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@H+]1C ZINC000489388677 1039902665 /nfs/dbraw/zinc/90/26/65/1039902665.db2.gz JCBCIDDUTLDZEE-FQEVSTJZSA-N 1 1 347.462 3.800 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc2ccc(F)cc2[nH]1 ZINC000549806117 1039940692 /nfs/dbraw/zinc/94/06/92/1039940692.db2.gz QJZPSQUWIDDHGW-UHFFFAOYSA-N 1 1 327.359 3.890 20 5 EHBDMO CC(C)CC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000053363721 1040241992 /nfs/dbraw/zinc/24/19/92/1040241992.db2.gz LMIYYZOFAIEHBZ-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128286907 1040290880 /nfs/dbraw/zinc/29/08/80/1040290880.db2.gz BAXAMESXXUOEJA-STQMWFEESA-N 1 1 337.395 3.573 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031075 1040299305 /nfs/dbraw/zinc/29/93/05/1040299305.db2.gz NKLOBAOYFVQVLA-OAHLLOKOSA-N 1 1 330.359 3.732 20 5 EHBDMO COc1ccc(C[N@@H+](C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000512687361 1040539789 /nfs/dbraw/zinc/53/97/89/1040539789.db2.gz QICDKEMJDAJRKL-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547913 1040587777 /nfs/dbraw/zinc/58/77/77/1040587777.db2.gz RICQBXKFDCFDEG-MRXNPFEDSA-N 1 1 329.375 3.810 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547913 1040587792 /nfs/dbraw/zinc/58/77/92/1040587792.db2.gz RICQBXKFDCFDEG-MRXNPFEDSA-N 1 1 329.375 3.810 20 5 EHBDMO CC[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796935 1040836043 /nfs/dbraw/zinc/83/60/43/1040836043.db2.gz FAVHCOGAYRRVFF-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796935 1040836051 /nfs/dbraw/zinc/83/60/51/1040836051.db2.gz FAVHCOGAYRRVFF-ZDUSSCGKSA-N 1 1 332.425 3.934 20 5 EHBDMO COCC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433185754 1041021716 /nfs/dbraw/zinc/02/17/16/1041021716.db2.gz FVTRETHJPDMTHR-GFCCVEGCSA-N 1 1 344.864 3.592 20 5 EHBDMO COCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433185754 1041021725 /nfs/dbraw/zinc/02/17/25/1041021725.db2.gz FVTRETHJPDMTHR-GFCCVEGCSA-N 1 1 344.864 3.592 20 5 EHBDMO Cc1c(F)cccc1NC(=O)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000433278133 1041190271 /nfs/dbraw/zinc/19/02/71/1041190271.db2.gz FIAXOHDDULFLKU-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CC(=O)c1cc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344414 1041216044 /nfs/dbraw/zinc/21/60/44/1041216044.db2.gz GSORBMUCFBLZHM-JKIFEVAISA-N 1 1 345.443 3.639 20 5 EHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311635 1042261115 /nfs/dbraw/zinc/26/11/15/1042261115.db2.gz XPFUJEKIFQLAKF-OAHLLOKOSA-N 1 1 347.440 3.748 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](CO)C(C)(C)C ZINC000093821754 1042544768 /nfs/dbraw/zinc/54/47/68/1042544768.db2.gz BCDXHMYCIYELMF-HNNXBMFYSA-N 1 1 349.456 3.557 20 5 EHBDMO C[C@@H]1CC[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072897482 1042764384 /nfs/dbraw/zinc/76/43/84/1042764384.db2.gz HYHHRJFHHWYJOS-ZIAGYGMSSA-N 1 1 329.400 3.913 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nccc(C(F)F)n1 ZINC000342265919 1042844879 /nfs/dbraw/zinc/84/48/79/1042844879.db2.gz LPVIARSYPDQPDJ-XFFZJAGNSA-N 1 1 334.326 3.516 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161092 /nfs/dbraw/zinc/16/10/92/1044161092.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 1 1 331.460 3.681 20 5 EHBDMO COCCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000512250678 1044399073 /nfs/dbraw/zinc/39/90/73/1044399073.db2.gz DLUUPMPCNVKTKH-UHFFFAOYSA-N 1 1 338.791 3.977 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)ccc1O ZINC000131029834 1125700156 /nfs/dbraw/zinc/70/01/56/1125700156.db2.gz HUPVHNBAZGOLMY-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)ccc1O ZINC000131029834 1125700160 /nfs/dbraw/zinc/70/01/60/1125700160.db2.gz HUPVHNBAZGOLMY-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO CC[C@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283258 1127473761 /nfs/dbraw/zinc/47/37/61/1127473761.db2.gz PFKBJQOHBYXWMX-NWDGAFQWSA-N 1 1 341.839 3.943 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000552137790 1127619131 /nfs/dbraw/zinc/61/91/31/1127619131.db2.gz NAHXLJCRUSDESP-LZOLKVDOSA-N 1 1 332.444 3.729 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506898 1128484224 /nfs/dbraw/zinc/48/42/24/1128484224.db2.gz CYWKYZJRUCPULH-KXBFYZLASA-N 1 1 325.412 3.917 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000542702557 1128548606 /nfs/dbraw/zinc/54/86/06/1128548606.db2.gz YQYKPJVCULCLOK-HXUWFJFHSA-N 1 1 340.423 3.737 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000542702725 1128549586 /nfs/dbraw/zinc/54/95/86/1128549586.db2.gz RJVJZXPPFLWGSD-HXUWFJFHSA-N 1 1 340.423 3.775 20 5 EHBDMO CC(C)C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)CC(C)(C)C ZINC000761831864 1120975870 /nfs/dbraw/zinc/97/58/70/1120975870.db2.gz QJRFSBYIWLRGHS-UHFFFAOYSA-N 1 1 345.447 3.815 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3ccccc3C2)c2ccncc21 ZINC000301073807 1121361106 /nfs/dbraw/zinc/36/11/06/1121361106.db2.gz MLYPESYPTODRTR-UHFFFAOYSA-N 1 1 348.406 3.613 20 5 EHBDMO CCC1CCC([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000921045887 1123458682 /nfs/dbraw/zinc/45/86/82/1123458682.db2.gz HDEVUTQHSIJFLU-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800297 1123664462 /nfs/dbraw/zinc/66/44/62/1123664462.db2.gz AARZVUOZDYHWAU-GOSISDBHSA-N 1 1 344.436 3.764 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916525 1123691826 /nfs/dbraw/zinc/69/18/26/1123691826.db2.gz WFJCXUNTEXNRFZ-CQSZACIVSA-N 1 1 332.350 3.938 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1Cc1ccccc1[N+](=O)[O-] ZINC000610133869 1123738848 /nfs/dbraw/zinc/73/88/48/1123738848.db2.gz BFANPTYLBITACB-QGZVFWFLSA-N 1 1 339.439 3.691 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216825 1124100457 /nfs/dbraw/zinc/10/04/57/1124100457.db2.gz ZQJWZVYOHHMWIH-DOTOQJQBSA-N 1 1 348.443 3.632 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000069064191 1124103103 /nfs/dbraw/zinc/10/31/03/1124103103.db2.gz ISWLZJNBDZWBRC-AWEZNQCLSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1cc(NC(C)(C)C[N@@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000301833838 1129168294 /nfs/dbraw/zinc/16/82/94/1129168294.db2.gz VDPCHPRDSYDVHM-UHFFFAOYSA-N 1 1 328.416 3.621 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301832637 1129173025 /nfs/dbraw/zinc/17/30/25/1129173025.db2.gz RNUWMXXDAVTEGA-LLVKDONJSA-N 1 1 331.338 3.757 20 5 EHBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000080605822 1124625253 /nfs/dbraw/zinc/62/52/53/1124625253.db2.gz IHNLBXWKZGOINZ-GUYCJALGSA-N 1 1 346.456 3.855 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)CCc1ccccc1)C1CC1 ZINC000182554127 1125333025 /nfs/dbraw/zinc/33/30/25/1125333025.db2.gz QCEKDTMXUVHHNW-IBGZPJMESA-N 1 1 340.423 3.553 20 5 EHBDMO C[C@@H]1CO[C@@H](c2ccccc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851865 1129216493 /nfs/dbraw/zinc/21/64/93/1129216493.db2.gz IFPUYHOMJJFCKJ-DNVCBOLYSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255902962 1129225634 /nfs/dbraw/zinc/22/56/34/1129225634.db2.gz TUXPZXDSCXWWDG-ZQMJAJRESA-N 1 1 326.396 3.877 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)nc1-c1ccccc1 ZINC000301880121 1129252843 /nfs/dbraw/zinc/25/28/43/1129252843.db2.gz PCZQYXPTVMVTRD-HZPDHXFCSA-N 1 1 338.411 3.696 20 5 EHBDMO CC(C)[N@@H+](CCCOCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458556 1129276062 /nfs/dbraw/zinc/27/60/62/1129276062.db2.gz BSJBWOVCGPCHHL-UHFFFAOYSA-N 1 1 334.338 3.774 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2sccc2[N+](=O)[O-])cc1F ZINC000301917245 1129348423 /nfs/dbraw/zinc/34/84/23/1129348423.db2.gz ASUZKAVTHKNHCW-UHFFFAOYSA-N 1 1 332.360 3.902 20 5 EHBDMO CCOc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971349 1129465269 /nfs/dbraw/zinc/46/52/69/1129465269.db2.gz GFQJSYWUWVDUKL-QFBILLFUSA-N 1 1 341.411 3.851 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466461847 1129468329 /nfs/dbraw/zinc/46/83/29/1129468329.db2.gz ANCHQWZWTXNCCJ-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1ccn2c(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc2c1 ZINC000154284140 1129546751 /nfs/dbraw/zinc/54/67/51/1129546751.db2.gz GBQBKLYLEVXKLC-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1ccn2c(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc2c1 ZINC000154284140 1129546752 /nfs/dbraw/zinc/54/67/52/1129546752.db2.gz GBQBKLYLEVXKLC-UHFFFAOYSA-N 1 1 336.395 3.716 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684041 1129599494 /nfs/dbraw/zinc/59/94/94/1129599494.db2.gz ZIKOPFBZNSIWJH-LJQANCHMSA-N 1 1 340.423 3.942 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000330952839 1129649878 /nfs/dbraw/zinc/64/98/78/1129649878.db2.gz FQFXDUQZBRLGOV-CYBMUJFWSA-N 1 1 332.322 3.766 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000330952839 1129649881 /nfs/dbraw/zinc/64/98/81/1129649881.db2.gz FQFXDUQZBRLGOV-CYBMUJFWSA-N 1 1 332.322 3.766 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000302166291 1129771076 /nfs/dbraw/zinc/77/10/76/1129771076.db2.gz JQPBFGASYNVRIQ-AWEZNQCLSA-N 1 1 331.441 3.848 20 5 EHBDMO CCOC(=O)CC[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044414 1129796664 /nfs/dbraw/zinc/79/66/64/1129796664.db2.gz CNUYOTNLQMSFMT-GJZGRUSLSA-N 1 1 334.416 3.711 20 5 EHBDMO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@H+]1CCCC[C@H]1C ZINC000731206203 1130779333 /nfs/dbraw/zinc/77/93/33/1130779333.db2.gz BHKMWMZJYNVBEX-NEPJUHHUSA-N 1 1 334.445 3.879 20 5 EHBDMO C[N@H+](CCCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000738324401 1131468732 /nfs/dbraw/zinc/46/87/32/1131468732.db2.gz RCBDHUWHEGYTDU-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000738324401 1131468733 /nfs/dbraw/zinc/46/87/33/1131468733.db2.gz RCBDHUWHEGYTDU-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO Cc1cccc(F)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000742381130 1131718933 /nfs/dbraw/zinc/71/89/33/1131718933.db2.gz XZOMGGSBVZQMRS-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC(F)(F)[C@H](F)C1)CC2 ZINC001172902666 1131885218 /nfs/dbraw/zinc/88/52/18/1131885218.db2.gz BNIHHPWTUTVLRW-UKRRQHHQSA-N 1 1 328.334 3.521 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172905389 1131886311 /nfs/dbraw/zinc/88/63/11/1131886311.db2.gz RRBGIVNERGXJDI-SFHVURJKSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@H]3CC[C@@H](C1)C3(F)F)CC2 ZINC001172906353 1131887247 /nfs/dbraw/zinc/88/72/47/1131887247.db2.gz XIRAOEVUTMKXSE-XHSDSOJGSA-N 1 1 336.382 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](c3cccnc3)C1)CC2 ZINC001172915535 1131903245 /nfs/dbraw/zinc/90/32/45/1131903245.db2.gz OPGPJTKXIRCVRN-OALUTQOASA-N 1 1 337.423 3.727 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000743842621 1131980648 /nfs/dbraw/zinc/98/06/48/1131980648.db2.gz IYYGJTILJBBZSO-UONOGXRCSA-N 1 1 349.431 3.645 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000743842621 1131980653 /nfs/dbraw/zinc/98/06/53/1131980653.db2.gz IYYGJTILJBBZSO-UONOGXRCSA-N 1 1 349.431 3.645 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001173222751 1132005508 /nfs/dbraw/zinc/00/55/08/1132005508.db2.gz VHDJQPAKVNXABD-HNAYVOBHSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H]1c1ccccc1 ZINC001173222748 1132005574 /nfs/dbraw/zinc/00/55/74/1132005574.db2.gz VHDJQPAKVNXABD-DNVCBOLYSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001173226134 1132006372 /nfs/dbraw/zinc/00/63/72/1132006372.db2.gz HUTWEKMCTRLATB-GFCCVEGCSA-N 1 1 331.803 3.633 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001173226388 1132006837 /nfs/dbraw/zinc/00/68/37/1132006837.db2.gz JIWICESRZUYSAP-DNVCBOLYSA-N 1 1 326.396 3.679 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173233362 1132010491 /nfs/dbraw/zinc/01/04/91/1132010491.db2.gz VTFBUPDVICOUTP-AWEZNQCLSA-N 1 1 326.396 3.593 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001173232496 1132010642 /nfs/dbraw/zinc/01/06/42/1132010642.db2.gz BSOOPMRUTNGUSX-HUUCEWRRSA-N 1 1 330.428 3.750 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCCC(=O)c1cccnc1 ZINC001173232322 1132010950 /nfs/dbraw/zinc/01/09/50/1132010950.db2.gz FCTSOBXKKIMZOG-OAHLLOKOSA-N 1 1 341.411 3.516 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+](CCc3ccccc3)C3CC3)c2c1 ZINC000746022518 1132350024 /nfs/dbraw/zinc/35/00/24/1132350024.db2.gz CXXNHHKPOJTHTE-UHFFFAOYSA-N 1 1 336.395 3.609 20 5 EHBDMO Cc1nn(C[N@H+](Cc2cccc(C)c2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000746054005 1132358251 /nfs/dbraw/zinc/35/82/51/1132358251.db2.gz QGAMJTOKJVHUMA-UHFFFAOYSA-N 1 1 330.432 3.832 20 5 EHBDMO Cc1nn(C[N@@H+](Cc2cccc(C)c2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000746054005 1132358258 /nfs/dbraw/zinc/35/82/58/1132358258.db2.gz QGAMJTOKJVHUMA-UHFFFAOYSA-N 1 1 330.432 3.832 20 5 EHBDMO CC(=O)N=C1C=C[N@@H+](c2c3ccccc3cc3ccccc32)C=C1N ZINC001175352253 1132645822 /nfs/dbraw/zinc/64/58/22/1132645822.db2.gz HWNUZSZPEJBVGY-UHFFFAOYSA-N 1 1 327.387 3.813 20 5 EHBDMO CC(=O)N=C1C=C[N@H+](c2c3ccccc3cc3ccccc32)C=C1N ZINC001175352253 1132645827 /nfs/dbraw/zinc/64/58/27/1132645827.db2.gz HWNUZSZPEJBVGY-UHFFFAOYSA-N 1 1 327.387 3.813 20 5 EHBDMO CC(C)CC[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765820 1133050634 /nfs/dbraw/zinc/05/06/34/1133050634.db2.gz PNXDKXPOYAXMQC-MRXNPFEDSA-N 1 1 343.431 3.711 20 5 EHBDMO C[C@H]([N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000770288120 1133405694 /nfs/dbraw/zinc/40/56/94/1133405694.db2.gz FVFAJOXKQXRZMK-JTQLQIEISA-N 1 1 327.222 3.978 20 5 EHBDMO C[C@H]([N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000770288120 1133405696 /nfs/dbraw/zinc/40/56/96/1133405696.db2.gz FVFAJOXKQXRZMK-JTQLQIEISA-N 1 1 327.222 3.978 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nccc2c1CCCC2 ZINC001181696904 1133518585 /nfs/dbraw/zinc/51/85/85/1133518585.db2.gz CYYLBDXQZNRYAS-UHFFFAOYSA-N 1 1 325.412 3.543 20 5 EHBDMO O=[N+]([O-])c1cc2cnn(C[N@@H+]3CC[C@@H](c4ccco4)C3)c2c(Cl)c1 ZINC000774627679 1133808388 /nfs/dbraw/zinc/80/83/88/1133808388.db2.gz RABYJTIGUNVURX-LLVKDONJSA-N 1 1 346.774 3.638 20 5 EHBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CC[C@@H](c4ccco4)C3)c2c(Cl)c1 ZINC000774627679 1133808395 /nfs/dbraw/zinc/80/83/95/1133808395.db2.gz RABYJTIGUNVURX-LLVKDONJSA-N 1 1 346.774 3.638 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC000786584218 1133871161 /nfs/dbraw/zinc/87/11/61/1133871161.db2.gz SUHFUQPOOWKCLZ-UHFFFAOYSA-N 1 1 347.459 3.746 20 5 EHBDMO CC[N@@H+](CCc1ccccn1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000787408104 1134003564 /nfs/dbraw/zinc/00/35/64/1134003564.db2.gz YNRDEGSOVCALKS-SSZFMOIBSA-N 1 1 325.412 3.958 20 5 EHBDMO O=[N+]([O-])c1cccnc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170330620 1134750369 /nfs/dbraw/zinc/75/03/69/1134750369.db2.gz CXOLOGVNABDPAQ-OSYLJGHBSA-N 1 1 338.411 3.597 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2cccs2)c([N+](=O)[O-])c1 ZINC001170344567 1134758535 /nfs/dbraw/zinc/75/85/35/1134758535.db2.gz CACMSPWHFXVWID-CYBMUJFWSA-N 1 1 334.441 3.770 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340094 1134759105 /nfs/dbraw/zinc/75/91/05/1134759105.db2.gz DKJSTUQVEMFDHN-WCQYABFASA-N 1 1 346.349 3.809 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792875690 1134809656 /nfs/dbraw/zinc/80/96/56/1134809656.db2.gz IWUUPTGSQHFHRG-GFCCVEGCSA-N 1 1 345.355 3.753 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCSC3(CCCCC3)C2)c1 ZINC001191465224 1134876127 /nfs/dbraw/zinc/87/61/27/1134876127.db2.gz YQIBMGJVPGAFCB-UHFFFAOYSA-N 1 1 336.457 3.725 20 5 EHBDMO CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC001191529103 1134880488 /nfs/dbraw/zinc/88/04/88/1134880488.db2.gz ABXGOGSCRRRGMN-OAHLLOKOSA-N 1 1 331.441 3.887 20 5 EHBDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC001191529103 1134880494 /nfs/dbraw/zinc/88/04/94/1134880494.db2.gz ABXGOGSCRRRGMN-OAHLLOKOSA-N 1 1 331.441 3.887 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCc2ccc(F)cc21 ZINC001195694377 1135456758 /nfs/dbraw/zinc/45/67/58/1135456758.db2.gz KRQQEUZHYKVUDO-AWEZNQCLSA-N 1 1 328.387 3.938 20 5 EHBDMO C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939168 1135486731 /nfs/dbraw/zinc/48/67/31/1135486731.db2.gz WXYJXKKZGOANJM-YGRLFVJLSA-N 1 1 347.242 3.885 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939168 1135486732 /nfs/dbraw/zinc/48/67/32/1135486732.db2.gz WXYJXKKZGOANJM-YGRLFVJLSA-N 1 1 347.242 3.885 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001196024443 1135506811 /nfs/dbraw/zinc/50/68/11/1135506811.db2.gz ZGMIDMGNKJNERR-UHFFFAOYSA-N 1 1 340.423 3.810 20 5 EHBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000808793773 1135738863 /nfs/dbraw/zinc/73/88/63/1135738863.db2.gz UCTKYVNUVRHIKP-VNHYZAJKSA-N 1 1 346.349 3.681 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC001198563992 1135831001 /nfs/dbraw/zinc/83/10/01/1135831001.db2.gz VBIRAVMITANSFI-SJORKVTESA-N 1 1 348.443 3.502 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563867 1135831069 /nfs/dbraw/zinc/83/10/69/1135831069.db2.gz TXPOPYPMTOLTCL-HUUCEWRRSA-N 1 1 338.835 3.887 20 5 EHBDMO CC(C)C[C@H](CO)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809981121 1135908556 /nfs/dbraw/zinc/90/85/56/1135908556.db2.gz ZRUFPCGUEGSEGJ-GFCCVEGCSA-N 1 1 335.231 3.740 20 5 EHBDMO CCOc1cc(CO[NH+]=C(N)CCc2ccccc2)ccc1[N+](=O)[O-] ZINC000809995260 1135910010 /nfs/dbraw/zinc/91/00/10/1135910010.db2.gz OGKASMPRZGTLIP-UHFFFAOYSA-N 1 1 343.383 3.625 20 5 EHBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000810618309 1135980711 /nfs/dbraw/zinc/98/07/11/1135980711.db2.gz DKPDVZALINCQMQ-LBPRGKRZSA-N 1 1 345.399 3.643 20 5 EHBDMO CC(C)(C)c1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810847383 1136014640 /nfs/dbraw/zinc/01/46/40/1136014640.db2.gz OHCIFOMJJGDRAO-HUUCEWRRSA-N 1 1 346.427 3.676 20 5 EHBDMO C[C@@H](CN1CCN(C)CC1)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000106485831 1136114649 /nfs/dbraw/zinc/11/46/49/1136114649.db2.gz QFYOOGACGGLSRY-SFHVURJKSA-N 1 1 347.506 3.719 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280115 1136135299 /nfs/dbraw/zinc/13/52/99/1136135299.db2.gz ZVIKIQHRUIEEBB-RTBURBONSA-N 1 1 326.396 3.774 20 5 EHBDMO Cc1ccccc1C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776579096 1136443947 /nfs/dbraw/zinc/44/39/47/1136443947.db2.gz JAMYTFOPHLIZSL-LJQANCHMSA-N 1 1 326.396 3.601 20 5 EHBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581353 1136444486 /nfs/dbraw/zinc/44/44/86/1136444486.db2.gz DANDHHOCWWSLMT-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1ccc(F)cc1Cl)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581353 1136444487 /nfs/dbraw/zinc/44/44/87/1136444487.db2.gz DANDHHOCWWSLMT-MRXNPFEDSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585578 1136448347 /nfs/dbraw/zinc/44/83/47/1136448347.db2.gz XDJNZWMDQFOBOV-UXHICEINSA-N 1 1 340.423 3.644 20 5 EHBDMO O=C(CC[N@@H+](CCC1CC1)CC1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000852716722 1136479796 /nfs/dbraw/zinc/47/97/96/1136479796.db2.gz QTJLCLNTCWVNJW-UHFFFAOYSA-N 1 1 349.406 3.575 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-n2ccnc2)cs1 ZINC000338954958 1136512803 /nfs/dbraw/zinc/51/28/03/1136512803.db2.gz RXIVBXFCCJPWNG-UHFFFAOYSA-N 1 1 342.424 3.517 20 5 EHBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000818050578 1136860905 /nfs/dbraw/zinc/86/09/05/1136860905.db2.gz LQHXROSXEKKHCF-UKTHLTGXSA-N 1 1 336.351 3.593 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCc3c[nH]nc32)cc(C(F)(F)F)c1 ZINC000857864301 1136915087 /nfs/dbraw/zinc/91/50/87/1136915087.db2.gz GWGPKULVBOMYJC-CYBMUJFWSA-N 1 1 340.305 3.504 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c1 ZINC000339015680 1136995397 /nfs/dbraw/zinc/99/53/97/1136995397.db2.gz WPCFZVODFYIFHG-ABAIWWIYSA-N 1 1 344.333 3.615 20 5 EHBDMO Cc1c(F)nccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386279 1137141846 /nfs/dbraw/zinc/14/18/46/1137141846.db2.gz NWOGDGWHAHFELY-INIZCTEOSA-N 1 1 329.375 3.817 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1F ZINC000844394082 1137216651 /nfs/dbraw/zinc/21/66/51/1137216651.db2.gz OCAGADPNXISDPQ-HNNXBMFYSA-N 1 1 333.319 3.883 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000846109300 1137333216 /nfs/dbraw/zinc/33/32/16/1137333216.db2.gz UMMAQHNLAIFJRI-CQSZACIVSA-N 1 1 348.296 3.817 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC3(Br)CC3)C2)cc1 ZINC000846962413 1137379521 /nfs/dbraw/zinc/37/95/21/1137379521.db2.gz ZUVQQKSTCIJQSW-ZDUSSCGKSA-N 1 1 339.233 3.702 20 5 EHBDMO Cc1cccc(C)c1C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])CC(C)C ZINC001171456838 1137490297 /nfs/dbraw/zinc/49/02/97/1137490297.db2.gz IFMQZLMQUXORNW-UHFFFAOYSA-N 1 1 330.432 3.603 20 5 EHBDMO CSC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000872626729 1137582044 /nfs/dbraw/zinc/58/20/44/1137582044.db2.gz MQCCRGUSZCMUBR-UHFFFAOYSA-N 1 1 339.442 3.657 20 5 EHBDMO C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@H](C(F)(F)F)O1 ZINC000877825433 1137692327 /nfs/dbraw/zinc/69/23/27/1137692327.db2.gz ZYSXONRLJIAMFX-HQWBGCBWSA-N 1 1 344.333 3.650 20 5 EHBDMO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@H](C(F)(F)F)O1 ZINC000877825433 1137692328 /nfs/dbraw/zinc/69/23/28/1137692328.db2.gz ZYSXONRLJIAMFX-HQWBGCBWSA-N 1 1 344.333 3.650 20 5 EHBDMO CC[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878045252 1137700594 /nfs/dbraw/zinc/70/05/94/1137700594.db2.gz HFMUOZCEGXIAIC-NSHDSACASA-N 1 1 336.779 3.673 20 5 EHBDMO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000879684215 1137755134 /nfs/dbraw/zinc/75/51/34/1137755134.db2.gz UYNVGKXUXZZMBE-MQVJKMGUSA-N 1 1 342.399 3.505 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880316349 1137774722 /nfs/dbraw/zinc/77/47/22/1137774722.db2.gz DXOFQYBDETVKKM-CYBMUJFWSA-N 1 1 347.440 3.828 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](c4nccs4)C3)c2c1 ZINC000882855646 1137835895 /nfs/dbraw/zinc/83/58/95/1137835895.db2.gz POGNQCTZRXHSGM-NSHDSACASA-N 1 1 326.381 3.593 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC(C)(C)C1 ZINC000112702266 1137909503 /nfs/dbraw/zinc/90/95/03/1137909503.db2.gz UPAWDMAJTXLQFP-GFCCVEGCSA-N 1 1 330.388 3.828 20 5 EHBDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000119112788 1137938252 /nfs/dbraw/zinc/93/82/52/1137938252.db2.gz VCVRGSUWXMRHCZ-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000119112788 1137938253 /nfs/dbraw/zinc/93/82/53/1137938253.db2.gz VCVRGSUWXMRHCZ-UHFFFAOYSA-N 1 1 340.383 3.610 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c1 ZINC000886818102 1138148750 /nfs/dbraw/zinc/14/87/50/1138148750.db2.gz ALHNLERLMDNSSR-ABAIWWIYSA-N 1 1 344.333 3.615 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000886818581 1138148964 /nfs/dbraw/zinc/14/89/64/1138148964.db2.gz HEXBYZWSLIVAKH-YGRLFVJLSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000886818581 1138148965 /nfs/dbraw/zinc/14/89/65/1138148965.db2.gz HEXBYZWSLIVAKH-YGRLFVJLSA-N 1 1 345.226 3.903 20 5 EHBDMO CC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCO1 ZINC000092406828 1138227274 /nfs/dbraw/zinc/22/72/74/1138227274.db2.gz ZUCDAIMRWCQYFM-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCO1 ZINC000092406828 1138227276 /nfs/dbraw/zinc/22/72/76/1138227276.db2.gz ZUCDAIMRWCQYFM-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO C[C@@H]1C[C@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130655748 1138467389 /nfs/dbraw/zinc/46/73/89/1138467389.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130655748 1138467392 /nfs/dbraw/zinc/46/73/92/1138467392.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130655748 1138467393 /nfs/dbraw/zinc/46/73/93/1138467393.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 1 1 343.427 3.769 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc([C@@H]2CCCO2)s1 ZINC000283026488 1138880080 /nfs/dbraw/zinc/88/00/80/1138880080.db2.gz MPWDMRZLMLBJGG-INIZCTEOSA-N 1 1 347.440 3.577 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000181917091 1139939976 /nfs/dbraw/zinc/93/99/76/1139939976.db2.gz JBSUEXPRLXBJDM-HNNXBMFYSA-N 1 1 330.409 3.930 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182380019 1139968920 /nfs/dbraw/zinc/96/89/20/1139968920.db2.gz CPGKUJKWKVCZIE-HNNXBMFYSA-N 1 1 334.807 3.925 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182380019 1139968924 /nfs/dbraw/zinc/96/89/24/1139968924.db2.gz CPGKUJKWKVCZIE-HNNXBMFYSA-N 1 1 334.807 3.925 20 5 EHBDMO C[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000183928838 1140066627 /nfs/dbraw/zinc/06/66/27/1140066627.db2.gz CXRAMNPHGDCVDV-JTQLQIEISA-N 1 1 325.821 3.940 20 5 EHBDMO CCOc1cccc([C@@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000184305378 1140094504 /nfs/dbraw/zinc/09/45/04/1140094504.db2.gz UENNVPXHFSIPOI-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@@H](C)C1 ZINC000187991340 1140279673 /nfs/dbraw/zinc/27/96/73/1140279673.db2.gz LJGJAQVSCLQIHB-OLZOCXBDSA-N 1 1 330.388 3.828 20 5 EHBDMO CO[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@@H]1C ZINC000188301112 1140291068 /nfs/dbraw/zinc/29/10/68/1140291068.db2.gz ZWAAEZHNAAQICB-LRDDRELGSA-N 1 1 347.440 3.575 20 5 EHBDMO CO[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@@H]1C ZINC000188301112 1140291074 /nfs/dbraw/zinc/29/10/74/1140291074.db2.gz ZWAAEZHNAAQICB-LRDDRELGSA-N 1 1 347.440 3.575 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cnn(C(C)(C)C)c1C ZINC000191266488 1140449737 /nfs/dbraw/zinc/44/97/37/1140449737.db2.gz MJNHUMNCDSBRHQ-GFCCVEGCSA-N 1 1 346.431 3.714 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000191358767 1140458346 /nfs/dbraw/zinc/45/83/46/1140458346.db2.gz QCTOHYTWOFEJFZ-HNNXBMFYSA-N 1 1 348.447 3.550 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000193623677 1140580707 /nfs/dbraw/zinc/58/07/07/1140580707.db2.gz SZKGFQNMFGWJEJ-ZDUSSCGKSA-N 1 1 333.369 3.902 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000193623677 1140580709 /nfs/dbraw/zinc/58/07/09/1140580709.db2.gz SZKGFQNMFGWJEJ-ZDUSSCGKSA-N 1 1 333.369 3.902 20 5 EHBDMO Cc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)ccc1F ZINC000267630314 1140813878 /nfs/dbraw/zinc/81/38/78/1140813878.db2.gz SJOGBZLZOCIBRV-GFCCVEGCSA-N 1 1 346.358 3.760 20 5 EHBDMO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000268834494 1141002648 /nfs/dbraw/zinc/00/26/48/1141002648.db2.gz LDGWJHVQWQLZBF-AWEZNQCLSA-N 1 1 329.400 3.774 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269635075 1141129433 /nfs/dbraw/zinc/12/94/33/1141129433.db2.gz AOPCBQVRUAMYFF-APPDUMDISA-N 1 1 336.338 3.599 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000271051420 1141300156 /nfs/dbraw/zinc/30/01/56/1141300156.db2.gz WKEDNGMSSMLYTC-CYBMUJFWSA-N 1 1 348.786 3.607 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000271051420 1141300159 /nfs/dbraw/zinc/30/01/59/1141300159.db2.gz WKEDNGMSSMLYTC-CYBMUJFWSA-N 1 1 348.786 3.607 20 5 EHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CCO2 ZINC000274227119 1141487952 /nfs/dbraw/zinc/48/79/52/1141487952.db2.gz DDFGNNXMIRZTHW-HNNXBMFYSA-N 1 1 348.786 3.870 20 5 EHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCOC1 ZINC000339207634 1141528459 /nfs/dbraw/zinc/52/84/59/1141528459.db2.gz ZHQUANIWCLWRAI-ZDUSSCGKSA-N 1 1 332.322 3.613 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])C1 ZINC000071954824 215979902 /nfs/dbraw/zinc/97/99/02/215979902.db2.gz LAUVKELLUGVSFX-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO COC(=O)[C@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H]1C(C)C ZINC000430148980 1014426769 /nfs/dbraw/zinc/42/67/69/1014426769.db2.gz MEZXAAMPYOXFNE-WYTCUBLDSA-N 1 1 346.427 3.518 20 5 EHBDMO O=c1cc(C[N@@H+]2CCOC3(CCC3)C2)c2c(ccc3ccccc32)o1 ZINC000154075278 1014962800 /nfs/dbraw/zinc/96/28/00/1014962800.db2.gz ADKQZWGGPKPUEV-UHFFFAOYSA-N 1 1 335.403 3.701 20 5 EHBDMO O=c1cc(C[N@H+]2CCOC3(CCC3)C2)c2c(ccc3ccccc32)o1 ZINC000154075278 1014962810 /nfs/dbraw/zinc/96/28/10/1014962810.db2.gz ADKQZWGGPKPUEV-UHFFFAOYSA-N 1 1 335.403 3.701 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2c(CC)noc2CC)cc1[N+](=O)[O-] ZINC000154198473 1015183011 /nfs/dbraw/zinc/18/30/11/1015183011.db2.gz GZYZZEHAXIMETF-GFCCVEGCSA-N 1 1 347.415 3.957 20 5 EHBDMO C[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000246920383 1016049355 /nfs/dbraw/zinc/04/93/55/1016049355.db2.gz QAQHGOUQEAQKCA-KBPBESRZSA-N 1 1 329.400 3.913 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000278723523 1032140346 /nfs/dbraw/zinc/14/03/46/1032140346.db2.gz KUQYKHNZJMTQKQ-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266258 1016817622 /nfs/dbraw/zinc/81/76/22/1016817622.db2.gz MMCVKFGFNRHEQZ-CJNGLKHVSA-N 1 1 342.399 3.799 20 5 EHBDMO Cc1ccc2nc(C[NH2+]Cc3ccc(C(C)C)c([N+](=O)[O-])c3)cn2c1 ZINC000573193039 1032165701 /nfs/dbraw/zinc/16/57/01/1032165701.db2.gz QNNYMOYFMCFCCB-UHFFFAOYSA-N 1 1 338.411 3.964 20 5 EHBDMO C[C@H]1CCC[N@H+]1Cc1cccc(-c2cc(CO)cc([N+](=O)[O-])c2)c1 ZINC000592984885 1032655071 /nfs/dbraw/zinc/65/50/71/1032655071.db2.gz BSOGBTWICDSVKL-AWEZNQCLSA-N 1 1 326.396 3.738 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cccc4c[nH]nc43)C2)cc1 ZINC000449495748 1032662588 /nfs/dbraw/zinc/66/25/88/1032662588.db2.gz DXYNWIPEKQZGQT-INIZCTEOSA-N 1 1 336.395 3.851 20 5 EHBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952392 1017351456 /nfs/dbraw/zinc/35/14/56/1017351456.db2.gz QQRGAABWCLIUQZ-TZMCWYRMSA-N 1 1 331.441 3.553 20 5 EHBDMO O=C(C[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000177397417 1017654493 /nfs/dbraw/zinc/65/44/93/1017654493.db2.gz YHKIDCIRQSSIPG-CQSZACIVSA-N 1 1 330.409 3.894 20 5 EHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000177397417 1017654497 /nfs/dbraw/zinc/65/44/97/1017654497.db2.gz YHKIDCIRQSSIPG-CQSZACIVSA-N 1 1 330.409 3.894 20 5 EHBDMO COc1cc(N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081757 1017705215 /nfs/dbraw/zinc/70/52/15/1017705215.db2.gz YATLHLGMSTZHQX-HZPDHXFCSA-N 1 1 347.459 3.694 20 5 EHBDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159466 /nfs/dbraw/zinc/15/94/66/1018159466.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159473 /nfs/dbraw/zinc/15/94/73/1018159473.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159486 /nfs/dbraw/zinc/15/94/86/1018159486.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000119645339 1018176322 /nfs/dbraw/zinc/17/63/22/1018176322.db2.gz MXWJCWFRCOYFNF-SNVBAGLBSA-N 1 1 334.759 3.828 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCCCC2)C1 ZINC001167341524 1018313327 /nfs/dbraw/zinc/31/33/27/1018313327.db2.gz KHIJRYIDPYTKLL-HNNXBMFYSA-N 1 1 345.443 3.968 20 5 EHBDMO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000340598136 1018614995 /nfs/dbraw/zinc/61/49/95/1018614995.db2.gz QCRAHTHFYQPWEC-UHFFFAOYSA-N 1 1 327.428 3.679 20 5 EHBDMO O=C(C[NH+]1C2CCCC1CCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000610395056 1018751866 /nfs/dbraw/zinc/75/18/66/1018751866.db2.gz VBBRMTRDXLAVBF-UHFFFAOYSA-N 1 1 337.807 3.594 20 5 EHBDMO CC(C)([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cccs1 ZINC000542575099 1018807412 /nfs/dbraw/zinc/80/74/12/1018807412.db2.gz VPGYJTIWFNDXDY-UHFFFAOYSA-N 1 1 344.396 3.731 20 5 EHBDMO CSc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047743780 1020345677 /nfs/dbraw/zinc/34/56/77/1020345677.db2.gz UCCWRLNDHGHRGO-UHFFFAOYSA-N 1 1 343.452 3.639 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103328 1020433075 /nfs/dbraw/zinc/43/30/75/1020433075.db2.gz OJSMVNKARAUKBC-FQEVSTJZSA-N 1 1 338.407 3.873 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000602470972 1032905752 /nfs/dbraw/zinc/90/57/52/1032905752.db2.gz AGXRAOGXEAIXHZ-UHFFFAOYSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1ccc(CN(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495389 1021178793 /nfs/dbraw/zinc/17/87/93/1021178793.db2.gz LJEWIPBXNMKGSW-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1ccc(C[N@@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495389 1021178798 /nfs/dbraw/zinc/17/87/98/1021178798.db2.gz LJEWIPBXNMKGSW-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495389 1021178808 /nfs/dbraw/zinc/17/88/08/1021178808.db2.gz LJEWIPBXNMKGSW-IBGZPJMESA-N 1 1 339.439 3.610 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000439256662 1021301076 /nfs/dbraw/zinc/30/10/76/1021301076.db2.gz HUYSAMRJZWCPLI-LJQANCHMSA-N 1 1 346.402 3.897 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2oc(CC)nc2C)cc1[N+](=O)[O-] ZINC000426339984 1021311427 /nfs/dbraw/zinc/31/14/27/1021311427.db2.gz OKPABWNIKANUAI-LLVKDONJSA-N 1 1 333.388 3.703 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000337337836 1021400571 /nfs/dbraw/zinc/40/05/71/1021400571.db2.gz PIQHSMLMBHRQRW-UHFFFAOYSA-N 1 1 347.440 3.550 20 5 EHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477786 1021459779 /nfs/dbraw/zinc/45/97/79/1021459779.db2.gz HVEYZHABZJGNCI-RHSMWYFYSA-N 1 1 328.416 3.610 20 5 EHBDMO COc1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670756 1021639489 /nfs/dbraw/zinc/63/94/89/1021639489.db2.gz RHBUNVPQVBMEIP-KGLIPLIRSA-N 1 1 334.416 3.623 20 5 EHBDMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cccc4cc5ccccc5cc43)[C@@H]2C1 ZINC001270531374 1021711730 /nfs/dbraw/zinc/71/17/30/1021711730.db2.gz JPEKYZMIJUYQLY-GHTZIAJQSA-N 1 1 330.431 3.769 20 5 EHBDMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000015312400 1021881196 /nfs/dbraw/zinc/88/11/96/1021881196.db2.gz SYZRITZPRADBMK-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000015312400 1021881203 /nfs/dbraw/zinc/88/12/03/1021881203.db2.gz SYZRITZPRADBMK-SFHVURJKSA-N 1 1 342.395 3.949 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000441172294 1022031524 /nfs/dbraw/zinc/03/15/24/1022031524.db2.gz AEXLDJZZTUAUDF-FLVLSHQESA-N 1 1 340.427 3.786 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000441172294 1022031539 /nfs/dbraw/zinc/03/15/39/1022031539.db2.gz AEXLDJZZTUAUDF-FLVLSHQESA-N 1 1 340.427 3.786 20 5 EHBDMO CCC[C@@H]([NH2+]C1CCN(CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255762 1022325258 /nfs/dbraw/zinc/32/52/58/1022325258.db2.gz QRIDFRMGAQRENN-LJQANCHMSA-N 1 1 331.460 3.900 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CCO)c2ccco2)o1 ZINC000184514893 1022558511 /nfs/dbraw/zinc/55/85/11/1022558511.db2.gz WETFKXPKAWCMGS-OAHLLOKOSA-N 1 1 342.351 3.661 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)[C@H](C)O1 ZINC000438346896 1022584933 /nfs/dbraw/zinc/58/49/33/1022584933.db2.gz FEYCVKWXBZHJQK-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)[C@H](C)O1 ZINC000438346896 1022584947 /nfs/dbraw/zinc/58/49/47/1022584947.db2.gz FEYCVKWXBZHJQK-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989790 1022590692 /nfs/dbraw/zinc/59/06/92/1022590692.db2.gz UPMAWLYMMKCBOQ-JSGCOSHPSA-N 1 1 332.425 3.526 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)[C@H](C)O1 ZINC000438371688 1022615885 /nfs/dbraw/zinc/61/58/85/1022615885.db2.gz GSBWAKXEFRFKSM-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)[C@H](C)O1 ZINC000438371688 1022615893 /nfs/dbraw/zinc/61/58/93/1022615893.db2.gz GSBWAKXEFRFKSM-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO CC1=C(C)C[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280781526 1022707673 /nfs/dbraw/zinc/70/76/73/1022707673.db2.gz QCUGQSBAXMESCM-ZDUSSCGKSA-N 1 1 328.372 3.748 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@@H]43)o2)cc1 ZINC000510665883 1022852162 /nfs/dbraw/zinc/85/21/62/1022852162.db2.gz SQWLWQWDAZEUHB-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@@H]43)o2)cc1 ZINC000510665883 1022852174 /nfs/dbraw/zinc/85/21/74/1022852174.db2.gz SQWLWQWDAZEUHB-FUHWJXTLSA-N 1 1 328.368 3.608 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000441452441 1022866756 /nfs/dbraw/zinc/86/67/56/1022866756.db2.gz XFOQKKOKZYVICG-QGZVFWFLSA-N 1 1 334.416 3.527 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000438563098 1023125470 /nfs/dbraw/zinc/12/54/70/1023125470.db2.gz SAFXHYSZZXACHI-RXQFDZFGSA-N 1 1 340.427 3.749 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000602768223 1033163752 /nfs/dbraw/zinc/16/37/52/1033163752.db2.gz YCFYFOJAHQNBSX-OAHLLOKOSA-N 1 1 334.807 3.590 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H]2c2cccc3ccccc32)n1 ZINC000176217130 1023882979 /nfs/dbraw/zinc/88/29/79/1023882979.db2.gz XXRBMIMTBRMPFU-GOSISDBHSA-N 1 1 336.395 3.782 20 5 EHBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000514176397 1024202032 /nfs/dbraw/zinc/20/20/32/1024202032.db2.gz PBOYEFHPLSBSDC-NOZJJQNGSA-N 1 1 329.322 3.508 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641875 1024302832 /nfs/dbraw/zinc/30/28/32/1024302832.db2.gz MRWWXEVIYQOYGL-KGLIPLIRSA-N 1 1 333.432 3.600 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000430131413 1024662858 /nfs/dbraw/zinc/66/28/58/1024662858.db2.gz LVYZMJDPWZVBKU-KRWDZBQOSA-N 1 1 332.444 3.967 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](CCCO)C2)s1 ZINC000449793071 1033237130 /nfs/dbraw/zinc/23/71/30/1033237130.db2.gz VPWVPXFNZVQOJH-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895844051 1024891785 /nfs/dbraw/zinc/89/17/85/1024891785.db2.gz LOBOKPPTPOVYLV-SWLSCSKDSA-N 1 1 344.333 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889921 1033243614 /nfs/dbraw/zinc/24/36/14/1033243614.db2.gz XAMPVCFOVPVQEF-INIZCTEOSA-N 1 1 334.379 3.528 20 5 EHBDMO C[C@H](c1ccc(F)cc1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000071952348 1024917736 /nfs/dbraw/zinc/91/77/36/1024917736.db2.gz WMNMPTCRUXAHSB-CQSZACIVSA-N 1 1 329.375 3.617 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1CC(C)(C)C ZINC000435441720 1024928493 /nfs/dbraw/zinc/92/84/93/1024928493.db2.gz HJIQQKIJLYRHQZ-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1ccc(CNC[C@@H]2CCC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000435750527 1025111507 /nfs/dbraw/zinc/11/15/07/1025111507.db2.gz YGDOFEJPIDZJTG-SFHVURJKSA-N 1 1 331.460 3.790 20 5 EHBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000185457974 1025119456 /nfs/dbraw/zinc/11/94/56/1025119456.db2.gz DAPOMNZMZFLLAT-CYBMUJFWSA-N 1 1 349.431 3.674 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@@H](OC)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551275501 1025236584 /nfs/dbraw/zinc/23/65/84/1025236584.db2.gz UNLGLAKUKGGSBJ-MOPGFXCFSA-N 1 1 344.411 3.854 20 5 EHBDMO Cc1cc(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433137 1025461282 /nfs/dbraw/zinc/46/12/82/1025461282.db2.gz IARGFXJEXFMPGI-DOTOQJQBSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H]1CCC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467893 1025466018 /nfs/dbraw/zinc/46/60/18/1025466018.db2.gz OHVOOXVKXRUJFQ-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467880 1025466567 /nfs/dbraw/zinc/46/65/67/1025466567.db2.gz OHVOOXVKXRUJFQ-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000436307286 1025573120 /nfs/dbraw/zinc/57/31/20/1025573120.db2.gz KIUPCLDMCZQHHO-QWRGUYRKSA-N 1 1 346.353 3.541 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200892 1025641684 /nfs/dbraw/zinc/64/16/84/1025641684.db2.gz OGEPLPOIFJVRNC-CXAGYDPISA-N 1 1 327.384 3.582 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](C/C=C/c1ccc(Cl)cc1)CC2 ZINC000469766725 1025789542 /nfs/dbraw/zinc/78/95/42/1025789542.db2.gz DYUNMKUXYHCTLB-OWOJBTEDSA-N 1 1 329.787 3.715 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000451740298 1026255307 /nfs/dbraw/zinc/25/53/07/1026255307.db2.gz ZWGJAMMQEIBOSY-HNNXBMFYSA-N 1 1 334.807 3.672 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000342575284 1026327667 /nfs/dbraw/zinc/32/76/67/1026327667.db2.gz XMGYOPNXBHEGGT-OAHLLOKOSA-N 1 1 346.383 3.680 20 5 EHBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)o1 ZINC000342575284 1026327682 /nfs/dbraw/zinc/32/76/82/1026327682.db2.gz XMGYOPNXBHEGGT-OAHLLOKOSA-N 1 1 346.383 3.680 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000023991489 1026772742 /nfs/dbraw/zinc/77/27/42/1026772742.db2.gz WJPWEVOCOHKVPV-UTUOFQBUSA-N 1 1 339.823 3.553 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000531378700 1026848925 /nfs/dbraw/zinc/84/89/25/1026848925.db2.gz WWKMICAQNCWYCF-SFHVURJKSA-N 1 1 325.412 3.696 20 5 EHBDMO Cc1cc(F)ccc1[C@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135220196 1027041685 /nfs/dbraw/zinc/04/16/85/1027041685.db2.gz XOJBCGYXCVBRGI-LJQANCHMSA-N 1 1 344.386 3.740 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C(C)C)C1CCCCC1 ZINC000533371159 1027762969 /nfs/dbraw/zinc/76/29/69/1027762969.db2.gz MMRFARDBEGVXOB-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@@H]3CCCc4ccccc43)C2)nc1 ZINC000440486074 1028065679 /nfs/dbraw/zinc/06/56/79/1028065679.db2.gz JBFKATVZRJARLJ-CRAIPNDOSA-N 1 1 338.411 3.554 20 5 EHBDMO Cc1cnc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668100 1028067359 /nfs/dbraw/zinc/06/73/59/1028067359.db2.gz NRPXYXQGNBOLEV-CJNGLKHVSA-N 1 1 346.456 3.855 20 5 EHBDMO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000421371231 1028328075 /nfs/dbraw/zinc/32/80/75/1028328075.db2.gz JHSQDIZYAWLMCW-CHWSQXEVSA-N 1 1 332.425 3.669 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC(C)(C)Cc2occc21 ZINC000178729100 1028375334 /nfs/dbraw/zinc/37/53/34/1028375334.db2.gz ZXEWFDCUAPZQGG-OAHLLOKOSA-N 1 1 330.384 4.000 20 5 EHBDMO C[C@H](N[C@H]1CC[NH2+]C[C@@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398889 1028412099 /nfs/dbraw/zinc/41/20/99/1028412099.db2.gz PDHVOOPINYJCKS-YDHLFZDLSA-N 1 1 345.468 3.972 20 5 EHBDMO COC(=O)c1cc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])oc1C ZINC000292452230 1028427553 /nfs/dbraw/zinc/42/75/53/1028427553.db2.gz OATIIUDZRBMLHJ-MNOVXSKESA-N 1 1 332.356 3.695 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)[C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000445578103 1028960897 /nfs/dbraw/zinc/96/08/97/1028960897.db2.gz CAZVVFBVMJSPQZ-CQSZACIVSA-N 1 1 329.400 3.808 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912012 1029055382 /nfs/dbraw/zinc/05/53/82/1029055382.db2.gz OVGQBILFCUNYPI-JYJNAYRXSA-N 1 1 349.475 3.907 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912012 1029055396 /nfs/dbraw/zinc/05/53/96/1029055396.db2.gz OVGQBILFCUNYPI-JYJNAYRXSA-N 1 1 349.475 3.907 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000532976402 1029133491 /nfs/dbraw/zinc/13/34/91/1029133491.db2.gz IAZIZMINETVYKS-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066366 1029236241 /nfs/dbraw/zinc/23/62/41/1029236241.db2.gz WSJVREGQZGKCNL-CXAGYDPISA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(OC(F)F)cc1)C2 ZINC000536001494 1029687689 /nfs/dbraw/zinc/68/76/89/1029687689.db2.gz CYHKJAVXZVTLEL-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(OC(F)F)cc1)C2 ZINC000536001494 1029687692 /nfs/dbraw/zinc/68/76/92/1029687692.db2.gz CYHKJAVXZVTLEL-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cc4cc(F)ccc4o3)nc2c1 ZINC000446827423 1029812052 /nfs/dbraw/zinc/81/20/52/1029812052.db2.gz OEAIPWANUDZKDT-UHFFFAOYSA-N 1 1 340.314 3.646 20 5 EHBDMO CCc1ccc(C[N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000441181226 1029877083 /nfs/dbraw/zinc/87/70/83/1029877083.db2.gz HSBGSURREPSOGN-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000611774602 1029995076 /nfs/dbraw/zinc/99/50/76/1029995076.db2.gz DZYOIIZOMOHFCD-AWEZNQCLSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000611774602 1029995088 /nfs/dbraw/zinc/99/50/88/1029995088.db2.gz DZYOIIZOMOHFCD-AWEZNQCLSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)C1CCCCC1 ZINC000447388357 1030156725 /nfs/dbraw/zinc/15/67/25/1030156725.db2.gz WNGOFNNJTIINHJ-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)C2CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453396115 1030248071 /nfs/dbraw/zinc/24/80/71/1030248071.db2.gz YDMVQLWMDRCULL-PKOBYXMFSA-N 1 1 344.411 3.590 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000159528165 1030255071 /nfs/dbraw/zinc/25/50/71/1030255071.db2.gz JKIJQJDKYDPRQV-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO CC(C)[C@@H](CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[NH+]1CCCC1 ZINC000583604381 1030266067 /nfs/dbraw/zinc/26/60/67/1030266067.db2.gz MWXQUWDIQZVKFA-RTBURBONSA-N 1 1 331.460 3.682 20 5 EHBDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013893 1030273613 /nfs/dbraw/zinc/27/36/13/1030273613.db2.gz ZEALOROLMXXQAH-MRXNPFEDSA-N 1 1 334.416 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccn(-c3ccccc3)n1)CCC2 ZINC000447548751 1030280888 /nfs/dbraw/zinc/28/08/88/1030280888.db2.gz IIHMNWQWDSDLPG-FQEVSTJZSA-N 1 1 348.406 3.948 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000532351996 1030576614 /nfs/dbraw/zinc/57/66/14/1030576614.db2.gz PPNTUSQOZHUDSB-BEFAXECRSA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000532351996 1030576622 /nfs/dbraw/zinc/57/66/22/1030576622.db2.gz PPNTUSQOZHUDSB-BEFAXECRSA-N 1 1 326.396 3.903 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282036061 1030624723 /nfs/dbraw/zinc/62/47/23/1030624723.db2.gz WZJORGBAEQIKHU-CYBMUJFWSA-N 1 1 344.390 3.651 20 5 EHBDMO C[C@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@H+]1C ZINC000343436011 1030867271 /nfs/dbraw/zinc/86/72/71/1030867271.db2.gz LJGSGCBFLROKBB-LIRRHRJNSA-N 1 1 333.435 3.601 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CO)C(C)(C)C ZINC000537658643 1030885999 /nfs/dbraw/zinc/88/59/99/1030885999.db2.gz NLRUOQDKOIRFIG-QGZVFWFLSA-N 1 1 332.400 3.694 20 5 EHBDMO COc1ccc(OCC[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073325 1030940523 /nfs/dbraw/zinc/94/05/23/1030940523.db2.gz XVXJDYUZOQPIGB-IFXJQAMLSA-N 1 1 342.395 3.675 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000484341803 1031545488 /nfs/dbraw/zinc/54/54/88/1031545488.db2.gz PCCCAHKIFXHBRN-AWEZNQCLSA-N 1 1 346.349 3.884 20 5 EHBDMO CC(C)(C)c1ncc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000278605072 1031603111 /nfs/dbraw/zinc/60/31/11/1031603111.db2.gz GBFBMQCJPFTAHS-UHFFFAOYSA-N 1 1 345.428 3.515 20 5 EHBDMO C[C@H]1CCN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302016333 1031768575 /nfs/dbraw/zinc/76/85/75/1031768575.db2.gz LVBGUAKCUYQTLL-AWEZNQCLSA-N 1 1 331.441 3.757 20 5 EHBDMO Cc1nc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])nc2ccccc12 ZINC000552005669 1031840190 /nfs/dbraw/zinc/84/01/90/1031840190.db2.gz JCUXCDUSTGLCOR-UHFFFAOYSA-N 1 1 336.395 3.521 20 5 EHBDMO Cc1nc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])nc2ccccc12 ZINC000552005669 1031840201 /nfs/dbraw/zinc/84/02/01/1031840201.db2.gz JCUXCDUSTGLCOR-UHFFFAOYSA-N 1 1 336.395 3.521 20 5 EHBDMO O=[N+]([O-])c1c(N[C@H]2CCC[N@H+]3CCCC[C@H]23)ccc2ncccc21 ZINC000594598789 1033447230 /nfs/dbraw/zinc/44/72/30/1033447230.db2.gz HYBMALIREUWTBL-DOTOQJQBSA-N 1 1 326.400 3.572 20 5 EHBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000594647349 1033473289 /nfs/dbraw/zinc/47/32/89/1033473289.db2.gz VNVDJVDWXRYPJN-KRWDZBQOSA-N 1 1 345.446 3.602 20 5 EHBDMO COCc1csc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000594945163 1033590924 /nfs/dbraw/zinc/59/09/24/1033590924.db2.gz MMPRQUSYWUYKRN-UHFFFAOYSA-N 1 1 326.805 3.746 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCc2c1cccc2O ZINC000595013878 1033607755 /nfs/dbraw/zinc/60/77/55/1033607755.db2.gz USDHYGMOIIUNDW-MEDUHNTESA-N 1 1 328.368 3.647 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000595020485 1033612722 /nfs/dbraw/zinc/61/27/22/1033612722.db2.gz ZNLRWEJHLOSXKL-BZNIZROVSA-N 1 1 346.358 3.917 20 5 EHBDMO C[N@H+]1CCCC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993955 1033647222 /nfs/dbraw/zinc/64/72/22/1033647222.db2.gz FKTKLCFMKZGMSC-OAHLLOKOSA-N 1 1 343.427 3.676 20 5 EHBDMO COc1cccc(C2([NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000595029660 1033650742 /nfs/dbraw/zinc/65/07/42/1033650742.db2.gz JXJXMWRPMFQGHN-CYBMUJFWSA-N 1 1 342.395 3.952 20 5 EHBDMO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595032144 1033653088 /nfs/dbraw/zinc/65/30/88/1033653088.db2.gz HZPYPHKDTFMYGS-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073937 1033716505 /nfs/dbraw/zinc/71/65/05/1033716505.db2.gz NDPCZMGQGRPLNZ-YOEHRIQHSA-N 1 1 347.459 3.661 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073937 1033716522 /nfs/dbraw/zinc/71/65/22/1033716522.db2.gz NDPCZMGQGRPLNZ-YOEHRIQHSA-N 1 1 347.459 3.661 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2C[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599092347 1033731284 /nfs/dbraw/zinc/73/12/84/1033731284.db2.gz LMWYVKVZKWHJLK-MZMPZRCHSA-N 1 1 330.384 3.607 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599110645 1033740726 /nfs/dbraw/zinc/74/07/26/1033740726.db2.gz DZPFSVRVCMKMMY-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cc(CO)ccc3F)C2)cc1 ZINC000599434160 1033934178 /nfs/dbraw/zinc/93/41/78/1033934178.db2.gz SLEATYOPWADEBI-MRXNPFEDSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](CCF)C3)co2)cc1 ZINC000595755097 1033984415 /nfs/dbraw/zinc/98/44/15/1033984415.db2.gz GGYAWXWTPYVSAW-ZDUSSCGKSA-N 1 1 333.363 3.821 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595787493 1033999076 /nfs/dbraw/zinc/99/90/76/1033999076.db2.gz JGGVRTRRNPPURH-YVEFUNNKSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c(F)c1 ZINC000595787493 1033999081 /nfs/dbraw/zinc/99/90/81/1033999081.db2.gz JGGVRTRRNPPURH-YVEFUNNKSA-N 1 1 340.370 3.654 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2Cc2cccc(F)c2)cc1 ZINC000603893068 1034015462 /nfs/dbraw/zinc/01/54/62/1034015462.db2.gz VOMBHHSLHQEWSV-IBGZPJMESA-N 1 1 328.387 3.984 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CC1(C)C ZINC000595909473 1034027157 /nfs/dbraw/zinc/02/71/57/1034027157.db2.gz OLRVGBRNXHMSRK-DGCLKSJQSA-N 1 1 330.388 3.684 20 5 EHBDMO C[N@H+](Cc1ccc(OC(F)F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179314989 1034107997 /nfs/dbraw/zinc/10/79/97/1034107997.db2.gz WGTFFZSFIHCOPK-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO C[N@@H+](Cc1ccc(OC(F)F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179314989 1034108008 /nfs/dbraw/zinc/10/80/08/1034108008.db2.gz WGTFFZSFIHCOPK-UHFFFAOYSA-N 1 1 340.301 3.967 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000596308486 1034165536 /nfs/dbraw/zinc/16/55/36/1034165536.db2.gz STONXNBSUVACKW-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1cccc2c(NC[C@@H]3CCC[N@@H+](CC4CC4)C3)ccnc21 ZINC000596570740 1034293858 /nfs/dbraw/zinc/29/38/58/1034293858.db2.gz NHPKVAIXYLESQV-HNNXBMFYSA-N 1 1 340.427 3.677 20 5 EHBDMO O=[N+]([O-])c1cccc2c(NC[C@H]3CCC[N@@H+](CC4CC4)C3)ccnc21 ZINC000596570742 1034294772 /nfs/dbraw/zinc/29/47/72/1034294772.db2.gz NHPKVAIXYLESQV-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491204989 1034300096 /nfs/dbraw/zinc/30/00/96/1034300096.db2.gz HQDHQLUJCUPKPP-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO Cn1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(-c2cccs2)n1 ZINC000179694461 1034586116 /nfs/dbraw/zinc/58/61/16/1034586116.db2.gz LHLCWMNPWZCISI-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO Cn1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(-c2cccs2)n1 ZINC000179694461 1034586121 /nfs/dbraw/zinc/58/61/21/1034586121.db2.gz LHLCWMNPWZCISI-UHFFFAOYSA-N 1 1 342.424 3.689 20 5 EHBDMO C[C@]12COC[C@@H]1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210921 1034593292 /nfs/dbraw/zinc/59/32/92/1034593292.db2.gz ITTOXXHLTGWVBJ-UGSOOPFHSA-N 1 1 344.436 3.792 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@](O)(C4CC4)C3)o2)c1 ZINC000597203874 1034608971 /nfs/dbraw/zinc/60/89/71/1034608971.db2.gz AFXJJBSCNKLITM-LJQANCHMSA-N 1 1 342.395 3.592 20 5 EHBDMO CO[C@@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC000548917045 1034780760 /nfs/dbraw/zinc/78/07/60/1034780760.db2.gz ZECDAUVDNRQZSO-SFHVURJKSA-N 1 1 346.814 3.994 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000179873049 1034877599 /nfs/dbraw/zinc/87/75/99/1034877599.db2.gz WYQNWTWZCQTWCC-LLVKDONJSA-N 1 1 344.358 3.622 20 5 EHBDMO C[N@@H+](CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000450973388 1034998213 /nfs/dbraw/zinc/99/82/13/1034998213.db2.gz JWRJVNVHNQVJBY-UHFFFAOYSA-N 1 1 326.396 3.732 20 5 EHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463494475 1035544370 /nfs/dbraw/zinc/54/43/70/1035544370.db2.gz HZCLYKOYAUARKO-UHFFFAOYSA-N 1 1 348.374 3.773 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463494475 1035544376 /nfs/dbraw/zinc/54/43/76/1035544376.db2.gz HZCLYKOYAUARKO-UHFFFAOYSA-N 1 1 348.374 3.773 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000173979837 1035823850 /nfs/dbraw/zinc/82/38/50/1035823850.db2.gz DUPVWJQMFCRYBR-LJQANCHMSA-N 1 1 340.423 3.676 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492481425 1035852218 /nfs/dbraw/zinc/85/22/18/1035852218.db2.gz DJOQSEGVIIEMLU-INIZCTEOSA-N 1 1 329.400 3.669 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492481425 1035852241 /nfs/dbraw/zinc/85/22/41/1035852241.db2.gz DJOQSEGVIIEMLU-INIZCTEOSA-N 1 1 329.400 3.669 20 5 EHBDMO O=[N+]([O-])c1cnc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)s1 ZINC000443437950 1035899314 /nfs/dbraw/zinc/89/93/14/1035899314.db2.gz NBBOIEPXPKXHEV-UHFFFAOYSA-N 1 1 329.385 3.871 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000443958078 1035949585 /nfs/dbraw/zinc/94/95/85/1035949585.db2.gz LNHWZFBNSZXQEK-UONOGXRCSA-N 1 1 348.447 3.596 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113838 1036256304 /nfs/dbraw/zinc/25/63/04/1036256304.db2.gz ZOXJYGLTYCGZAP-SMDDNHRTSA-N 1 1 343.349 3.534 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](O)C1CC1 ZINC000589197905 1036303251 /nfs/dbraw/zinc/30/32/51/1036303251.db2.gz APKPXVZOYXLAPY-INIZCTEOSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1ccccc1C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026224077 1036394011 /nfs/dbraw/zinc/39/40/11/1036394011.db2.gz SJDWNQXUXFTYFE-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082352 1036734963 /nfs/dbraw/zinc/73/49/63/1036734963.db2.gz RZYNJDSXEPWDFB-KRWDZBQOSA-N 1 1 334.379 3.742 20 5 EHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cnn(Cc2ccccc2)c1 ZINC000180412995 1036783251 /nfs/dbraw/zinc/78/32/51/1036783251.db2.gz MELJWFQUJZRDKI-HNNXBMFYSA-N 1 1 336.395 3.690 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H](c2ccccc2)C1 ZINC000761511270 1037081478 /nfs/dbraw/zinc/08/14/78/1037081478.db2.gz PSDKBQLULNONRT-SFHVURJKSA-N 1 1 345.830 3.737 20 5 EHBDMO CC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248894028 1037087977 /nfs/dbraw/zinc/08/79/77/1037087977.db2.gz HRKGAWUOOAMQHH-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248894028 1037087995 /nfs/dbraw/zinc/08/79/95/1037087995.db2.gz HRKGAWUOOAMQHH-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO CN(C)CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525447 1037109973 /nfs/dbraw/zinc/10/99/73/1037109973.db2.gz KATZRSDCGYJXIR-OAHLLOKOSA-N 1 1 327.856 3.704 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@@H]2COC(C)(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000595048326 1037217149 /nfs/dbraw/zinc/21/71/49/1037217149.db2.gz KBHAWPMYIGRHMV-KSSFIOAISA-N 1 1 344.411 3.997 20 5 EHBDMO CC[C@H](O)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850726 1037280256 /nfs/dbraw/zinc/28/02/56/1037280256.db2.gz OVBWTWHPUMFJCJ-BEBFYNPSSA-N 1 1 340.423 3.881 20 5 EHBDMO COC(=O)c1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000271796866 1037295500 /nfs/dbraw/zinc/29/55/00/1037295500.db2.gz OOOQZMUSQBEPJS-NEPJUHHUSA-N 1 1 332.356 3.695 20 5 EHBDMO CN(C)C(C)(C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491365648 1037422363 /nfs/dbraw/zinc/42/23/63/1037422363.db2.gz FIRDUYWBWCQLHS-SFHVURJKSA-N 1 1 327.428 3.614 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000540023882 1037480348 /nfs/dbraw/zinc/48/03/48/1037480348.db2.gz BIZRSMXFSDVMMZ-UHFFFAOYSA-N 1 1 346.475 3.637 20 5 EHBDMO CC[N@@H+](CCC1CC1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883248 1037553158 /nfs/dbraw/zinc/55/31/58/1037553158.db2.gz BCSWVQAHHDNSMV-LLVKDONJSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC3(C2)CCCCC3)cccc1[N+](=O)[O-] ZINC000532574623 1037678325 /nfs/dbraw/zinc/67/83/25/1037678325.db2.gz QWWUCAURGQMSOS-UHFFFAOYSA-N 1 1 345.443 3.888 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1CCCC1)[C@H]1CC[C@H](O)CC1 ZINC000592130654 1037838897 /nfs/dbraw/zinc/83/88/97/1037838897.db2.gz HOKXYDNPCSGCTH-IYARVYRRSA-N 1 1 332.444 3.891 20 5 EHBDMO COC(=O)CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470172486 1038426206 /nfs/dbraw/zinc/42/62/06/1038426206.db2.gz XJKZBBXQBHZXSE-GDNBJRDFSA-N 1 1 334.416 3.519 20 5 EHBDMO C/C(=C/c1ccccc1)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737318 1038500724 /nfs/dbraw/zinc/50/07/24/1038500724.db2.gz VVQCPKXQVUSWFV-HKBKRHGFSA-N 1 1 338.411 3.580 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959429 1038696866 /nfs/dbraw/zinc/69/68/66/1038696866.db2.gz PLTVMAQXRFUFKC-YJBOKZPZSA-N 1 1 329.375 3.900 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301455 1039089235 /nfs/dbraw/zinc/08/92/35/1039089235.db2.gz SDTQVNIZJGDDFK-HNNXBMFYSA-N 1 1 346.408 3.860 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301455 1039089253 /nfs/dbraw/zinc/08/92/53/1039089253.db2.gz SDTQVNIZJGDDFK-HNNXBMFYSA-N 1 1 346.408 3.860 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@H](O)Cc1ccccc1 ZINC000552293345 1039164779 /nfs/dbraw/zinc/16/47/79/1039164779.db2.gz YZTYMNPUWAZWHW-MBNYPGIVSA-N 1 1 340.423 3.534 20 5 EHBDMO CCCN1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320295 1039677687 /nfs/dbraw/zinc/67/76/87/1039677687.db2.gz JIBMJNZTKZKUDY-IBGZPJMESA-N 1 1 331.460 3.826 20 5 EHBDMO COc1cccnc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417353839 1039713416 /nfs/dbraw/zinc/71/34/16/1039713416.db2.gz YFJZZTIFTHSLMT-INIZCTEOSA-N 1 1 327.384 3.556 20 5 EHBDMO COc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991072 1039764247 /nfs/dbraw/zinc/76/42/47/1039764247.db2.gz BOYFCGANNOVSKY-RDTXWAMCSA-N 1 1 345.374 3.600 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428727988 1040107713 /nfs/dbraw/zinc/10/77/13/1040107713.db2.gz ZUVFDLFABHVDIQ-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000490034292 1040301416 /nfs/dbraw/zinc/30/14/16/1040301416.db2.gz VBXTYPPEPKBEFF-RHSMWYFYSA-N 1 1 326.396 3.981 20 5 EHBDMO COCCCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000418128416 1040616654 /nfs/dbraw/zinc/61/66/54/1040616654.db2.gz BJZCPGUGJFHNNJ-UHFFFAOYSA-N 1 1 335.429 3.577 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744372 1041257579 /nfs/dbraw/zinc/25/75/79/1041257579.db2.gz CGVCBAUCRFLLRF-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(F)c1 ZINC000481708349 1041288795 /nfs/dbraw/zinc/28/87/95/1041288795.db2.gz AWUSZONRWXHFEU-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(F)c1 ZINC000481708349 1041288804 /nfs/dbraw/zinc/28/88/04/1041288804.db2.gz AWUSZONRWXHFEU-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO COc1c(C)c[nH+]c(CN(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000067226842 1042774646 /nfs/dbraw/zinc/77/46/46/1042774646.db2.gz DWRMDDDGBOMJGN-AWEZNQCLSA-N 1 1 329.400 3.808 20 5 EHBDMO CCn1nccc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000278876749 1042807759 /nfs/dbraw/zinc/80/77/59/1042807759.db2.gz MNULDKBVJXJGBA-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO CC(C)c1ccc(C[NH2+]CCc2ccc3cn[nH]c3c2)cc1[N+](=O)[O-] ZINC000585743471 1043018381 /nfs/dbraw/zinc/01/83/81/1043018381.db2.gz XEHGZWGPMOMWBH-UHFFFAOYSA-N 1 1 338.411 3.927 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000301604782 1128516397 /nfs/dbraw/zinc/51/63/97/1128516397.db2.gz MBHKVWZMQVUBKR-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000715646809 1128651640 /nfs/dbraw/zinc/65/16/40/1128651640.db2.gz GJCLYGOBKBGZMW-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c(Cl)c1 ZINC000715646809 1128651643 /nfs/dbraw/zinc/65/16/43/1128651643.db2.gz GJCLYGOBKBGZMW-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO COC(=O)c1oc([C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847844 1128716052 /nfs/dbraw/zinc/71/60/52/1128716052.db2.gz GDQKFPSWKAVNOK-ZDUSSCGKSA-N 1 1 346.383 3.518 20 5 EHBDMO CCOc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OCC)cc1 ZINC001648924407 1120203652 /nfs/dbraw/zinc/20/36/52/1120203652.db2.gz DQIRIFZMYSEKFR-UHFFFAOYSA-N 1 1 330.384 3.682 20 5 EHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(O)c1 ZINC000494544614 1120590261 /nfs/dbraw/zinc/59/02/61/1120590261.db2.gz DUFOVEJCQGEDCZ-AWEZNQCLSA-N 1 1 330.384 3.762 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)c2ccc(F)cc2F)C2CC2)c1 ZINC000153327201 1120965499 /nfs/dbraw/zinc/96/54/99/1120965499.db2.gz RHDZMKZRDSJDBW-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143323 1121784836 /nfs/dbraw/zinc/78/48/36/1121784836.db2.gz OXLCSTUULHJZSO-SWLSCSKDSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609234599 1121859419 /nfs/dbraw/zinc/85/94/19/1121859419.db2.gz XHXKVTAMOJODDN-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609234599 1121859425 /nfs/dbraw/zinc/85/94/25/1121859425.db2.gz XHXKVTAMOJODDN-SFHVURJKSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1C(F)(F)F ZINC000301117820 1121946823 /nfs/dbraw/zinc/94/68/23/1121946823.db2.gz WIJNNLUEHXPMQI-GXTWGEPZSA-N 1 1 329.322 3.652 20 5 EHBDMO Cc1cccc(N2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000488059939 1121980120 /nfs/dbraw/zinc/98/01/20/1121980120.db2.gz UPTUTSUZKZMZMT-INIZCTEOSA-N 1 1 325.412 3.786 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCC[C@@H]1O ZINC000497144532 1122351244 /nfs/dbraw/zinc/35/12/44/1122351244.db2.gz KMWNSQBAZLRDGV-QAPCUYQASA-N 1 1 344.411 3.838 20 5 EHBDMO Cc1ccc(N2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000917089830 1122487067 /nfs/dbraw/zinc/48/70/67/1122487067.db2.gz NRSVLLMJBIZWCD-UHFFFAOYSA-N 1 1 339.439 3.924 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301205685 1122510816 /nfs/dbraw/zinc/51/08/16/1122510816.db2.gz SJGMADBFODAHQL-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000497597275 1122601568 /nfs/dbraw/zinc/60/15/68/1122601568.db2.gz YPVBHMAVVKRCIU-CYBMUJFWSA-N 1 1 346.818 3.526 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000609545272 1123608287 /nfs/dbraw/zinc/60/82/87/1123608287.db2.gz KXAMFFXYCHGJMJ-AWEZNQCLSA-N 1 1 348.447 3.617 20 5 EHBDMO COCC[N@@H+](CCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705395 1123647897 /nfs/dbraw/zinc/64/78/97/1123647897.db2.gz YYMOSPJSWIUMON-UHFFFAOYSA-N 1 1 348.830 3.939 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800457 1123664426 /nfs/dbraw/zinc/66/44/26/1123664426.db2.gz IAUKTFPEVYRCJR-SFHVURJKSA-N 1 1 344.436 3.764 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc2c(c1)OCO2 ZINC000237578997 1123780144 /nfs/dbraw/zinc/78/01/44/1123780144.db2.gz XIPAXVFSHBMJLY-JTQLQIEISA-N 1 1 334.759 3.828 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569537 1125363830 /nfs/dbraw/zinc/36/38/30/1125363830.db2.gz GGUGPPOWGDJJQL-HYEGPXJVSA-N 1 1 332.444 3.746 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569530 1125364138 /nfs/dbraw/zinc/36/41/38/1125364138.db2.gz FMHJDRJJZXLORY-FDPIWHGQSA-N 1 1 332.444 3.746 20 5 EHBDMO CC1CCC([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000198202628 1125402643 /nfs/dbraw/zinc/40/26/43/1125402643.db2.gz YLMGSRYWXSSGRK-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO CN(CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000735493799 1131353550 /nfs/dbraw/zinc/35/35/50/1131353550.db2.gz QVPMTZKWRQUTQE-UHFFFAOYSA-N 1 1 333.819 3.816 20 5 EHBDMO CN(CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000735493799 1131353555 /nfs/dbraw/zinc/35/35/55/1131353555.db2.gz QVPMTZKWRQUTQE-UHFFFAOYSA-N 1 1 333.819 3.816 20 5 EHBDMO CCc1oc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C(=O)OC ZINC000619844953 1125416000 /nfs/dbraw/zinc/41/60/00/1125416000.db2.gz DNAKQURQCSBQOS-GFCCVEGCSA-N 1 1 346.383 3.696 20 5 EHBDMO C[C@H](c1ccco1)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000131028831 1129376406 /nfs/dbraw/zinc/37/64/06/1129376406.db2.gz LFKDUFYHOQTXNI-CYBMUJFWSA-N 1 1 340.383 3.781 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938963 1129388695 /nfs/dbraw/zinc/38/86/95/1129388695.db2.gz XQZDCIBXUHPQOP-KGLIPLIRSA-N 1 1 328.416 3.675 20 5 EHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000117349717 1129435120 /nfs/dbraw/zinc/43/51/20/1129435120.db2.gz NKWUWLWPRFYDSB-OAHLLOKOSA-N 1 1 330.388 3.655 20 5 EHBDMO CC(C)c1ccc(C[NH2+]Cc2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000922470405 1129540920 /nfs/dbraw/zinc/54/09/20/1129540920.db2.gz PEIPOONVXBQOOR-UHFFFAOYSA-N 1 1 331.441 3.953 20 5 EHBDMO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154266495 1129544277 /nfs/dbraw/zinc/54/42/77/1129544277.db2.gz JFQQARDKFOQSTE-UHFFFAOYSA-N 1 1 328.416 3.780 20 5 EHBDMO CC(C)(C)c1n[nH]cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154266495 1129544280 /nfs/dbraw/zinc/54/42/80/1129544280.db2.gz JFQQARDKFOQSTE-UHFFFAOYSA-N 1 1 328.416 3.780 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000124338182 1129598844 /nfs/dbraw/zinc/59/88/44/1129598844.db2.gz BVZZSCMLHHMPPR-SNVBAGLBSA-N 1 1 348.321 3.529 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000302331867 1129776100 /nfs/dbraw/zinc/77/61/00/1129776100.db2.gz ZXQYEMKUZAAZIB-UHFFFAOYSA-N 1 1 343.214 3.933 20 5 EHBDMO CC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000030142121 1129912977 /nfs/dbraw/zinc/91/29/77/1129912977.db2.gz HRKGAWUOOAMQHH-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000030142121 1129912979 /nfs/dbraw/zinc/91/29/79/1129912979.db2.gz HRKGAWUOOAMQHH-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001307590579 1130098423 /nfs/dbraw/zinc/09/84/23/1130098423.db2.gz WDZVJQAAZWTGDU-GHMZBOCLSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522743 1130230586 /nfs/dbraw/zinc/23/05/86/1130230586.db2.gz UNGCKJPWFFDCCG-YWZLYKJASA-N 1 1 338.407 3.830 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000245522743 1130230591 /nfs/dbraw/zinc/23/05/91/1130230591.db2.gz UNGCKJPWFFDCCG-YWZLYKJASA-N 1 1 338.407 3.830 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@H](c4ccco4)C3)c2c1 ZINC000732181697 1130893071 /nfs/dbraw/zinc/89/30/71/1130893071.db2.gz KHVSROJTCZKERQ-NSHDSACASA-N 1 1 345.380 3.912 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@H](c4ccco4)C3)c2c1 ZINC000732181697 1130893077 /nfs/dbraw/zinc/89/30/77/1130893077.db2.gz KHVSROJTCZKERQ-NSHDSACASA-N 1 1 345.380 3.912 20 5 EHBDMO O=C(C[NH2+]Cc1csc([N+](=O)[O-])c1)Nc1cccc2ccccc21 ZINC000732231536 1130903117 /nfs/dbraw/zinc/90/31/17/1130903117.db2.gz QXNNFOLTULGXKY-UHFFFAOYSA-N 1 1 341.392 3.538 20 5 EHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059332 1131462077 /nfs/dbraw/zinc/46/20/77/1131462077.db2.gz XKSQBTZGXBOLFE-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057481 1131462099 /nfs/dbraw/zinc/46/20/99/1131462099.db2.gz RJVNCKDXBOWOOH-WMLDXEAASA-N 1 1 343.431 3.711 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000743386508 1131907143 /nfs/dbraw/zinc/90/71/43/1131907143.db2.gz IXPAVGQUQFQKJR-GOSISDBHSA-N 1 1 328.416 3.928 20 5 EHBDMO C[C@H]1c2cccn2CC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912466 1131917883 /nfs/dbraw/zinc/91/78/83/1131917883.db2.gz ABVUQZXLILPUHF-WMLDXEAASA-N 1 1 325.412 3.721 20 5 EHBDMO C[C@H]1c2cccn2CC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912466 1131917888 /nfs/dbraw/zinc/91/78/88/1131917888.db2.gz ABVUQZXLILPUHF-WMLDXEAASA-N 1 1 325.412 3.721 20 5 EHBDMO CC[C@@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015191 1131936159 /nfs/dbraw/zinc/93/61/59/1131936159.db2.gz LFGSABICPCNFGD-GFCCVEGCSA-N 1 1 339.386 3.716 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001173226389 1132006591 /nfs/dbraw/zinc/00/65/91/1132006591.db2.gz JIWICESRZUYSAP-HNAYVOBHSA-N 1 1 326.396 3.679 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC001173227871 1132008473 /nfs/dbraw/zinc/00/84/73/1132008473.db2.gz SFKVVKZDQFDNCA-BEFAXECRSA-N 1 1 326.396 3.599 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1nc2ccccc2o1 ZINC001173231721 1132008950 /nfs/dbraw/zinc/00/89/50/1132008950.db2.gz CMKYGZACFCBLNC-ZDUSSCGKSA-N 1 1 325.368 3.799 20 5 EHBDMO CCC[N@H+](Cc1ccc(F)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746034548 1132351121 /nfs/dbraw/zinc/35/11/21/1132351121.db2.gz UTSCXCRAKHIRGE-UHFFFAOYSA-N 1 1 342.374 3.953 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H](C(F)F)C1CCCCC1 ZINC001174716375 1132449994 /nfs/dbraw/zinc/44/99/94/1132449994.db2.gz QNKGZWADVHLKGY-OAHLLOKOSA-N 1 1 328.359 3.777 20 5 EHBDMO CC[N@@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046721 1132641645 /nfs/dbraw/zinc/64/16/45/1132641645.db2.gz MGIQHAOMOMFCIQ-UKRRQHHQSA-N 1 1 330.350 3.973 20 5 EHBDMO C[C@@H](c1ccc(Br)cc1)[N@@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055405 1132644450 /nfs/dbraw/zinc/64/44/50/1132644450.db2.gz PXDFNMORLFYEOR-HUBLWGQQSA-N 1 1 341.249 3.887 20 5 EHBDMO CC1CC[NH+](CC[C@@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353472 1132647550 /nfs/dbraw/zinc/64/75/50/1132647550.db2.gz ZTTDOXYWBWQQDH-IBGZPJMESA-N 1 1 345.487 3.724 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762593 1133049025 /nfs/dbraw/zinc/04/90/25/1133049025.db2.gz IZLCKWBJZUCAEW-BLLLJJGKSA-N 1 1 331.420 3.506 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000767943608 1133074018 /nfs/dbraw/zinc/07/40/18/1133074018.db2.gz ZPZLAXRSWLCVHC-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000773699594 1133091133 /nfs/dbraw/zinc/09/11/33/1133091133.db2.gz IAJNUQAHLUBJJK-UONOGXRCSA-N 1 1 338.835 3.887 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1F ZINC000768199347 1133105866 /nfs/dbraw/zinc/10/58/66/1133105866.db2.gz HEWGQNBZEWLRCY-FNORWQNLSA-N 1 1 330.359 3.888 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000768543320 1133154827 /nfs/dbraw/zinc/15/48/27/1133154827.db2.gz RGSXCDCFILXMRI-ZDUSSCGKSA-N 1 1 348.786 3.520 20 5 EHBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000768543320 1133154833 /nfs/dbraw/zinc/15/48/33/1133154833.db2.gz RGSXCDCFILXMRI-ZDUSSCGKSA-N 1 1 348.786 3.520 20 5 EHBDMO Cc1ccccc1-n1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC001179512029 1133258529 /nfs/dbraw/zinc/25/85/29/1133258529.db2.gz LQZCCDINPTWDPX-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513298 1133379974 /nfs/dbraw/zinc/37/99/74/1133379974.db2.gz BOCMBFSSJLVOBS-OAHLLOKOSA-N 1 1 346.358 3.785 20 5 EHBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513298 1133379980 /nfs/dbraw/zinc/37/99/80/1133379980.db2.gz BOCMBFSSJLVOBS-OAHLLOKOSA-N 1 1 346.358 3.785 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517570 1133702754 /nfs/dbraw/zinc/70/27/54/1133702754.db2.gz HNBGPFDUYJUPOT-DAYGRLMNSA-N 1 1 347.459 3.583 20 5 EHBDMO CC(C)(C)[NH+]1CCN(c2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC001184972976 1134009434 /nfs/dbraw/zinc/00/94/34/1134009434.db2.gz NKCVEOBWLCJRBB-UHFFFAOYSA-N 1 1 332.231 3.822 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+](C/C=C/c3ccccc3)CC2)c1 ZINC001185116915 1134038144 /nfs/dbraw/zinc/03/81/44/1134038144.db2.gz NMBLKOSZAXZJKZ-VMPITWQZSA-N 1 1 337.423 3.739 20 5 EHBDMO Cc1[nH+]ccn1-c1ncccc1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000788073976 1134077186 /nfs/dbraw/zinc/07/71/86/1134077186.db2.gz BEKCFAHEMKLLNY-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000774886693 1134099733 /nfs/dbraw/zinc/09/97/33/1134099733.db2.gz WQZYZXGKELZWTA-KRWDZBQOSA-N 1 1 331.372 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)cc1 ZINC000788572198 1134146324 /nfs/dbraw/zinc/14/63/24/1134146324.db2.gz OQCFORACCWIWRD-UHFFFAOYSA-N 1 1 326.400 3.512 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788797934 1134170687 /nfs/dbraw/zinc/17/06/87/1134170687.db2.gz OQFZCJWRNNJARE-MRVPVSSYSA-N 1 1 341.745 3.959 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)cn1 ZINC000775157506 1134410639 /nfs/dbraw/zinc/41/06/39/1134410639.db2.gz DRZVKOQDXYAOCJ-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1cccc(C)c1)CC(C)C ZINC001190559726 1134718805 /nfs/dbraw/zinc/71/88/05/1134718805.db2.gz CLUJQILFNFKWEJ-UHFFFAOYSA-N 1 1 330.432 3.566 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326685 1134748576 /nfs/dbraw/zinc/74/85/76/1134748576.db2.gz BOOOAQJSJARJMU-STQMWFEESA-N 1 1 342.386 3.902 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170352653 1134753771 /nfs/dbraw/zinc/75/37/71/1134753771.db2.gz PLYQPANNDFNPRP-CYBMUJFWSA-N 1 1 344.386 3.732 20 5 EHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2cccs2)c([N+](=O)[O-])c1 ZINC001170344568 1134758862 /nfs/dbraw/zinc/75/88/62/1134758862.db2.gz CACMSPWHFXVWID-ZDUSSCGKSA-N 1 1 334.441 3.770 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069303 1134786550 /nfs/dbraw/zinc/78/65/50/1134786550.db2.gz GLVOZPMMMNVWSN-VXGBXAGGSA-N 1 1 339.823 3.697 20 5 EHBDMO CO[C@@H](C)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC001191099317 1134792251 /nfs/dbraw/zinc/79/22/51/1134792251.db2.gz LQCOJHIWYBBKLI-NSHDSACASA-N 1 1 345.237 3.603 20 5 EHBDMO CO[C@@H](C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC001191099317 1134792255 /nfs/dbraw/zinc/79/22/55/1134792255.db2.gz LQCOJHIWYBBKLI-NSHDSACASA-N 1 1 345.237 3.603 20 5 EHBDMO COc1cc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)ccc1[N+](=O)[O-] ZINC000792907660 1134819551 /nfs/dbraw/zinc/81/95/51/1134819551.db2.gz UIKSKDGXICYNIS-UONOGXRCSA-N 1 1 345.226 3.619 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)ccc1[N+](=O)[O-] ZINC000792907660 1134819554 /nfs/dbraw/zinc/81/95/54/1134819554.db2.gz UIKSKDGXICYNIS-UONOGXRCSA-N 1 1 345.226 3.619 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000793617788 1134973675 /nfs/dbraw/zinc/97/36/75/1134973675.db2.gz SJJYBPHZGGRKIO-KGLIPLIRSA-N 1 1 329.227 3.919 20 5 EHBDMO C[C@H](C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)CO)c1ccccc1 ZINC000805820425 1135335434 /nfs/dbraw/zinc/33/54/34/1135335434.db2.gz MWUOZQFAGVZJGL-CABCVRRESA-N 1 1 346.402 3.720 20 5 EHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC001196175108 1135527209 /nfs/dbraw/zinc/52/72/09/1135527209.db2.gz FPEAMPJZLSRXNM-HUUCEWRRSA-N 1 1 333.432 3.742 20 5 EHBDMO C[N@@H+]1CC=C(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000775700242 1135532515 /nfs/dbraw/zinc/53/25/15/1135532515.db2.gz JHYRHIGITRUNBV-UHFFFAOYSA-N 1 1 349.740 3.941 20 5 EHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccccc1[N+](=O)[O-] ZINC000809689320 1135871760 /nfs/dbraw/zinc/87/17/60/1135871760.db2.gz XPMSDRWAVJGPJO-RMKNXTFCSA-N 1 1 341.367 3.691 20 5 EHBDMO C[N@H+](Cc1ccc2ccccc2c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271500 1136121499 /nfs/dbraw/zinc/12/14/99/1136121499.db2.gz LQTHGYVYBRJBAR-FQEVSTJZSA-N 1 1 336.391 3.913 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280110 1136135330 /nfs/dbraw/zinc/13/53/30/1136135330.db2.gz ZVIKIQHRUIEEBB-MOPGFXCFSA-N 1 1 326.396 3.774 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)[C@H](O)c1ccccc1 ZINC000812847510 1136259723 /nfs/dbraw/zinc/25/97/23/1136259723.db2.gz DSJZYOMGWITDER-ACJLOTCBSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851549 1136261173 /nfs/dbraw/zinc/26/11/73/1136261173.db2.gz SMMDYKIBYGWRCN-ACJLOTCBSA-N 1 1 332.375 3.678 20 5 EHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000173190354 1136341701 /nfs/dbraw/zinc/34/17/01/1136341701.db2.gz OADQQRRUZPCSFL-DOMZBBRYSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582926 1136442482 /nfs/dbraw/zinc/44/24/82/1136442482.db2.gz DHHYJAJJTFQEHK-MOPGFXCFSA-N 1 1 326.396 3.638 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC000776582423 1136442593 /nfs/dbraw/zinc/44/25/93/1136442593.db2.gz QAGBUAICFGHAOT-PXNSSMCTSA-N 1 1 340.423 3.583 20 5 EHBDMO CC[C@H](C)[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579239 1136444210 /nfs/dbraw/zinc/44/42/10/1136444210.db2.gz KAYKLDLKDFZHPI-KXBFYZLASA-N 1 1 328.412 3.929 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591249 1136451173 /nfs/dbraw/zinc/45/11/73/1136451173.db2.gz IETFKUXXOIPIBY-MOPGFXCFSA-N 1 1 344.386 3.995 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666337 1136491819 /nfs/dbraw/zinc/49/18/19/1136491819.db2.gz GMGJIIKVNURMBM-QAPCUYQASA-N 1 1 346.814 3.771 20 5 EHBDMO COc1c(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)oc2ccccc21 ZINC000815619841 1136619921 /nfs/dbraw/zinc/61/99/21/1136619921.db2.gz ZKRSFQADRIBSCI-LLVKDONJSA-N 1 1 341.367 3.783 20 5 EHBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774782 1136661193 /nfs/dbraw/zinc/66/11/93/1136661193.db2.gz OKJBUSBDADPSKT-KURKYZTESA-N 1 1 340.427 3.715 20 5 EHBDMO CCOc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)cc1OC ZINC000858170856 1136946216 /nfs/dbraw/zinc/94/62/16/1136946216.db2.gz RGVHXYMHNRKABI-LBPRGKRZSA-N 1 1 348.374 3.992 20 5 EHBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000859530341 1137018379 /nfs/dbraw/zinc/01/83/79/1137018379.db2.gz NHNLRRCDYGJIIU-CYBMUJFWSA-N 1 1 337.420 3.502 20 5 EHBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000859530341 1137018381 /nfs/dbraw/zinc/01/83/81/1137018381.db2.gz NHNLRRCDYGJIIU-CYBMUJFWSA-N 1 1 337.420 3.502 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859585273 1137021475 /nfs/dbraw/zinc/02/14/75/1137021475.db2.gz MMZIJTMMDVNQFC-HNAYVOBHSA-N 1 1 326.396 3.639 20 5 EHBDMO C[N@H+]1CCCC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481995 1137146444 /nfs/dbraw/zinc/14/64/44/1137146444.db2.gz CFEWSYSUCVMEJH-LLVKDONJSA-N 1 1 346.258 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1 ZINC000824696055 1137148768 /nfs/dbraw/zinc/14/87/68/1137148768.db2.gz GWWMZPCYPOIPOE-DJIMGWMZSA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N[C@H]1CCn2cc[nH+]c2C1 ZINC000865689265 1137304675 /nfs/dbraw/zinc/30/46/75/1137304675.db2.gz YOBJBAFKOAMVGD-QMMMGPOBSA-N 1 1 327.171 3.525 20 5 EHBDMO CCC[C@@H]([NH2+]Cc1nn(C)cc1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866564102 1137365013 /nfs/dbraw/zinc/36/50/13/1137365013.db2.gz VVTGGEUYLPQVCZ-CQSZACIVSA-N 1 1 338.358 3.897 20 5 EHBDMO CC(C)c1ccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867943117 1137390686 /nfs/dbraw/zinc/39/06/86/1137390686.db2.gz MIXBKFQBJSLSFG-GOSISDBHSA-N 1 1 327.384 3.531 20 5 EHBDMO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2n1C)c1cccc([N+](=O)[O-])c1 ZINC000772996235 1137439807 /nfs/dbraw/zinc/43/98/07/1137439807.db2.gz BNGWYBIOCNYSJW-OAHLLOKOSA-N 1 1 342.374 3.862 20 5 EHBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100776 1137484640 /nfs/dbraw/zinc/48/46/40/1137484640.db2.gz VCGUXVDPVGHTRM-ABAIWWIYSA-N 1 1 346.349 3.597 20 5 EHBDMO COc1ccc([C@@H](CCO)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872042269 1137567163 /nfs/dbraw/zinc/56/71/63/1137567163.db2.gz AEJVGVKBXAIZBD-MLGOLLRUSA-N 1 1 348.374 3.517 20 5 EHBDMO COc1cccc(OC)c1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873136236 1137591007 /nfs/dbraw/zinc/59/10/07/1137591007.db2.gz XQZKMXVVPMCGDF-UHFFFAOYSA-N 1 1 330.384 3.519 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)ccc1O ZINC000876562760 1137655521 /nfs/dbraw/zinc/65/55/21/1137655521.db2.gz SQIOYNNZKZOGEZ-UHFFFAOYSA-N 1 1 330.384 3.558 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000877420516 1137675921 /nfs/dbraw/zinc/67/59/21/1137675921.db2.gz WHQVGIAPRRSWOC-UHFFFAOYSA-N 1 1 344.333 3.555 20 5 EHBDMO CC1CCC([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000877919713 1137695728 /nfs/dbraw/zinc/69/57/28/1137695728.db2.gz VEKAOGWYJQYAER-UHFFFAOYSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H]2C2CCCC2)o1 ZINC000877986061 1137698433 /nfs/dbraw/zinc/69/84/33/1137698433.db2.gz KILVPSYZPCFXLG-OAHLLOKOSA-N 1 1 342.399 3.799 20 5 EHBDMO C[N@@H+](CCC1CC1)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878287593 1137709830 /nfs/dbraw/zinc/70/98/30/1137709830.db2.gz GYNTZIBYBYBPOZ-UHFFFAOYSA-N 1 1 336.779 3.530 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878428000 1137715462 /nfs/dbraw/zinc/71/54/62/1137715462.db2.gz PLTZDNDLXKBKFI-ZDUSSCGKSA-N 1 1 330.388 3.799 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000879236117 1137741788 /nfs/dbraw/zinc/74/17/88/1137741788.db2.gz ZYYXVGFAZZVKQQ-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1cccc2c1C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000879236117 1137741789 /nfs/dbraw/zinc/74/17/89/1137741789.db2.gz ZYYXVGFAZZVKQQ-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012606 1137765475 /nfs/dbraw/zinc/76/54/75/1137765475.db2.gz VQNXSDMAYHSVMH-AWEZNQCLSA-N 1 1 347.440 3.748 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@@H]2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000883321978 1137854775 /nfs/dbraw/zinc/85/47/75/1137854775.db2.gz RDPTYHPSHHUYNZ-RUGDWHBFSA-N 1 1 340.427 3.586 20 5 EHBDMO CC[N@H+](Cc1ccc(Cl)s1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136891825 1138043920 /nfs/dbraw/zinc/04/39/20/1138043920.db2.gz LSQYWOWBFJVGMB-AWEZNQCLSA-N 1 1 340.832 3.865 20 5 EHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962748 1138044483 /nfs/dbraw/zinc/04/44/83/1138044483.db2.gz DWOLRLGBZNDWPL-PXAZEXFGSA-N 1 1 334.803 3.975 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000136958619 1138044629 /nfs/dbraw/zinc/04/46/29/1138044629.db2.gz SRWMGWYNOWAJGR-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000136958619 1138044632 /nfs/dbraw/zinc/04/46/32/1138044632.db2.gz SRWMGWYNOWAJGR-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO COC[C@@H](C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886302813 1138065873 /nfs/dbraw/zinc/06/58/73/1138065873.db2.gz WYEPYRYQHWDJIV-KDOFPFPSSA-N 1 1 341.411 3.514 20 5 EHBDMO COC[C@@H](C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886302813 1138065875 /nfs/dbraw/zinc/06/58/75/1138065875.db2.gz WYEPYRYQHWDJIV-KDOFPFPSSA-N 1 1 341.411 3.514 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C1 ZINC000066514947 1138075785 /nfs/dbraw/zinc/07/57/85/1138075785.db2.gz WMXONDBCGLIYID-UHFFFAOYSA-N 1 1 331.397 3.634 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C1 ZINC000066514947 1138075787 /nfs/dbraw/zinc/07/57/87/1138075787.db2.gz WMXONDBCGLIYID-UHFFFAOYSA-N 1 1 331.397 3.634 20 5 EHBDMO CC[N@H+]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000264645663 1138589462 /nfs/dbraw/zinc/58/94/62/1138589462.db2.gz RKEBGKYWYYDEBL-UHFFFAOYSA-N 1 1 333.435 3.556 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000337824775 1138676605 /nfs/dbraw/zinc/67/66/05/1138676605.db2.gz SJDPXWXVAZECDB-UHFFFAOYSA-N 1 1 328.294 3.621 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000338358432 1138854472 /nfs/dbraw/zinc/85/44/72/1138854472.db2.gz NVPBOSFAYMPADU-UHFFFAOYSA-N 1 1 328.368 3.876 20 5 EHBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102193 1139734938 /nfs/dbraw/zinc/73/49/38/1139734938.db2.gz VGSZZPLDRXVUBH-WMLDXEAASA-N 1 1 337.419 3.682 20 5 EHBDMO C[C@H](O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867720 1139869278 /nfs/dbraw/zinc/86/92/78/1139869278.db2.gz XWODQLCQXLMUMB-JSGCOSHPSA-N 1 1 332.425 3.526 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186841767 1140224667 /nfs/dbraw/zinc/22/46/67/1140224667.db2.gz VCGIJHWYDLYQTO-AWEZNQCLSA-N 1 1 336.457 3.562 20 5 EHBDMO C[C@H]1CSCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000190848402 1140421179 /nfs/dbraw/zinc/42/11/79/1140421179.db2.gz AEMSJYNWRJMCDZ-GFCCVEGCSA-N 1 1 349.481 3.903 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4ccncc4)CC3)nc2c1 ZINC000191658022 1140477450 /nfs/dbraw/zinc/47/74/50/1140477450.db2.gz AHOZURMVAKKUGE-UHFFFAOYSA-N 1 1 338.367 3.511 20 5 EHBDMO COC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000192924890 1140556621 /nfs/dbraw/zinc/55/66/21/1140556621.db2.gz KRBLYZDJWUOPQL-IRXDYDNUSA-N 1 1 330.384 3.851 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000267441945 1140791729 /nfs/dbraw/zinc/79/17/29/1140791729.db2.gz IDZVVRPXWQOADD-GOEBONIOSA-N 1 1 332.425 3.744 20 5 EHBDMO C[C@H](CO)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CCC1 ZINC000339144508 1141509417 /nfs/dbraw/zinc/50/94/17/1141509417.db2.gz HFIFWBONYLYJSG-LLVKDONJSA-N 1 1 346.349 3.597 20 5 EHBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N2C(=O)CCc1c2ccccc2cc2ccccc21 ZINC001274656752 1141573328 /nfs/dbraw/zinc/57/33/28/1141573328.db2.gz PNFGGUYLOURFBF-KDURUIRLSA-N 1 1 344.458 3.841 20 5 EHBDMO C[N@@H+]1C[C@H]2C[C@@H](C1)N2C(=O)CCc1c2ccccc2cc2ccccc21 ZINC001274656752 1141573331 /nfs/dbraw/zinc/57/33/31/1141573331.db2.gz PNFGGUYLOURFBF-KDURUIRLSA-N 1 1 344.458 3.841 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC000078704983 217105681 /nfs/dbraw/zinc/10/56/81/217105681.db2.gz LEDRJGVTYXKHDM-UHFFFAOYSA-N 1 1 328.387 3.984 20 5 EHBDMO COc1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000064795180 1014539594 /nfs/dbraw/zinc/53/95/94/1014539594.db2.gz XIGCVRGGUXNDKZ-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCCCC2)CC1 ZINC000608833552 1014885461 /nfs/dbraw/zinc/88/54/61/1014885461.db2.gz PROREVMYUSLFKJ-OAHLLOKOSA-N 1 1 345.443 3.968 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000032801173 1015735967 /nfs/dbraw/zinc/73/59/67/1015735967.db2.gz YHGWVTSDARVQOK-NEPJUHHUSA-N 1 1 347.802 3.926 20 5 EHBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383519 1016118843 /nfs/dbraw/zinc/11/88/43/1016118843.db2.gz BCMNRSQRDHZAMW-NPMABZOXSA-N 1 1 332.425 3.525 20 5 EHBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000175383519 1016118850 /nfs/dbraw/zinc/11/88/50/1016118850.db2.gz BCMNRSQRDHZAMW-NPMABZOXSA-N 1 1 332.425 3.525 20 5 EHBDMO CC[C@H](C)[N@@H+](CCc1ccccc1F)Cc1onc(C)c1[N+](=O)[O-] ZINC001167244549 1016739970 /nfs/dbraw/zinc/73/99/70/1016739970.db2.gz UPZJFGDOCVSHMD-LBPRGKRZSA-N 1 1 335.379 3.874 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593522 1032314414 /nfs/dbraw/zinc/31/44/14/1032314414.db2.gz VOYBOPWMXNVOAE-FZKQIMNGSA-N 1 1 334.416 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCC3CCOCC3)C2)cc1 ZINC000449501928 1032677452 /nfs/dbraw/zinc/67/74/52/1032677452.db2.gz QKOZPRKALCSZSO-GOSISDBHSA-N 1 1 332.444 3.981 20 5 EHBDMO COc1cc(C)nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504365 1032687138 /nfs/dbraw/zinc/68/71/38/1032687138.db2.gz VVKRQVCHBJSLLK-INIZCTEOSA-N 1 1 341.411 3.686 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000545418692 1018534292 /nfs/dbraw/zinc/53/42/92/1018534292.db2.gz PVRXWCUZNLVWMK-CYBMUJFWSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866229 1018541118 /nfs/dbraw/zinc/54/11/18/1018541118.db2.gz AJICGUOODCFLOK-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866229 1018541128 /nfs/dbraw/zinc/54/11/28/1018541128.db2.gz AJICGUOODCFLOK-YPMHNXCESA-N 1 1 348.353 3.515 20 5 EHBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290409545 1018602756 /nfs/dbraw/zinc/60/27/56/1018602756.db2.gz JZAHVOFTHNCDGG-ZGRWHYIRSA-N 1 1 326.400 3.785 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404508 1032776774 /nfs/dbraw/zinc/77/67/74/1032776774.db2.gz ZARRCMMRNNKBKZ-GUYCJALGSA-N 1 1 332.375 3.817 20 5 EHBDMO O=[N+]([O-])c1cnccc1NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000310910799 1019090321 /nfs/dbraw/zinc/09/03/21/1019090321.db2.gz QRYXRPZQBONTSX-KRWDZBQOSA-N 1 1 340.427 3.704 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000580373715 1019208139 /nfs/dbraw/zinc/20/81/39/1019208139.db2.gz INQDSAFBFWSGTE-AWEZNQCLSA-N 1 1 340.379 3.838 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000580373715 1019208148 /nfs/dbraw/zinc/20/81/48/1019208148.db2.gz INQDSAFBFWSGTE-AWEZNQCLSA-N 1 1 340.379 3.838 20 5 EHBDMO CC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427639 1032815160 /nfs/dbraw/zinc/81/51/60/1032815160.db2.gz LTBKCWBPURVAGN-GUYCJALGSA-N 1 1 345.468 3.883 20 5 EHBDMO Cc1csc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182657619 1019732815 /nfs/dbraw/zinc/73/28/15/1019732815.db2.gz RKPDDRWJPPTQAY-CQSZACIVSA-N 1 1 346.456 3.551 20 5 EHBDMO Cc1cc(NCCNc2cccc(C)[nH+]2)c2cccc([N+](=O)[O-])c2n1 ZINC000345112351 1019956526 /nfs/dbraw/zinc/95/65/26/1019956526.db2.gz KXZLGKHWVNWZAS-UHFFFAOYSA-N 1 1 337.383 3.679 20 5 EHBDMO CC(C)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000501155486 1020732897 /nfs/dbraw/zinc/73/28/97/1020732897.db2.gz VCPMLIYAYRNBSX-UHFFFAOYSA-N 1 1 333.432 3.824 20 5 EHBDMO O=C(CC[N@H+]1CC[C@@H]1c1cccc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000610505058 1020859404 /nfs/dbraw/zinc/85/94/04/1020859404.db2.gz XLUBLBAQYOOJAF-MRXNPFEDSA-N 1 1 343.358 3.510 20 5 EHBDMO C[N@H+]1CCCC12CCN(c1c(Cl)cc(Cl)cc1[N+](=O)[O-])CC2 ZINC000518505564 1021254083 /nfs/dbraw/zinc/25/40/83/1021254083.db2.gz UKEIOKSUGKOUFE-UHFFFAOYSA-N 1 1 344.242 3.966 20 5 EHBDMO CCCCOc1ncccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516313782 1021291277 /nfs/dbraw/zinc/29/12/77/1021291277.db2.gz WDMWNHHGWBVQDV-QGZVFWFLSA-N 1 1 341.411 3.946 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000506801527 1022035126 /nfs/dbraw/zinc/03/51/26/1022035126.db2.gz ZVGIDJCNDFHYLZ-UHFFFAOYSA-N 1 1 339.439 3.740 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000341542791 1022220142 /nfs/dbraw/zinc/22/01/42/1022220142.db2.gz FFARSGHQFQPSPP-LBPRGKRZSA-N 1 1 349.460 3.666 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000602656828 1033056934 /nfs/dbraw/zinc/05/69/34/1033056934.db2.gz YNZXFUBVIRLZCU-UKRRQHHQSA-N 1 1 344.333 3.757 20 5 EHBDMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968574 1022521082 /nfs/dbraw/zinc/52/10/82/1022521082.db2.gz SNCIJFJQJCVWMF-CHWSQXEVSA-N 1 1 332.425 3.526 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H](CCO)c3ccco3)o2)cc1 ZINC000184519184 1022573980 /nfs/dbraw/zinc/57/39/80/1022573980.db2.gz MAZUPHGCXBFYHO-INIZCTEOSA-N 1 1 342.351 3.661 20 5 EHBDMO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000894771406 1022869101 /nfs/dbraw/zinc/86/91/01/1022869101.db2.gz HXVAOQBLNKLVRN-SNVBAGLBSA-N 1 1 343.412 3.601 20 5 EHBDMO C[NH+](C)[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000237172693 1022888800 /nfs/dbraw/zinc/88/88/00/1022888800.db2.gz IVDSPPCALIDVAQ-KRWDZBQOSA-N 1 1 345.468 3.753 20 5 EHBDMO CC[C@]1(C)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072803159 1022965692 /nfs/dbraw/zinc/96/56/92/1022965692.db2.gz AZVOCWVVGYFKJF-QGZVFWFLSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000507007820 1023073964 /nfs/dbraw/zinc/07/39/64/1023073964.db2.gz QJQGRMXYQGBGPK-CZUORRHYSA-N 1 1 329.375 3.981 20 5 EHBDMO COc1ccc(OCC[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000441476439 1023097555 /nfs/dbraw/zinc/09/75/55/1023097555.db2.gz POUOFLFSBIRUEM-IIAWOOMASA-N 1 1 334.416 3.635 20 5 EHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000507178791 1023166411 /nfs/dbraw/zinc/16/64/11/1023166411.db2.gz IYODXWPTBAAAJQ-INIZCTEOSA-N 1 1 326.396 3.772 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475577 1023240567 /nfs/dbraw/zinc/24/05/67/1023240567.db2.gz XZOSWXDIZVTYQY-JKSUJKDBSA-N 1 1 349.450 3.820 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000610782624 1023508508 /nfs/dbraw/zinc/50/85/08/1023508508.db2.gz WPTCFMHCJWDWTA-UHFFFAOYSA-N 1 1 343.214 3.539 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000610782624 1023508513 /nfs/dbraw/zinc/50/85/13/1023508513.db2.gz WPTCFMHCJWDWTA-UHFFFAOYSA-N 1 1 343.214 3.539 20 5 EHBDMO COC[C@@H]1CCCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449760485 1033153637 /nfs/dbraw/zinc/15/36/37/1033153637.db2.gz PAPZCGQTWRXZKC-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO COC[C@@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449760485 1033153642 /nfs/dbraw/zinc/15/36/42/1033153642.db2.gz PAPZCGQTWRXZKC-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214674 1023883052 /nfs/dbraw/zinc/88/30/52/1023883052.db2.gz RDNQYOPNYMKOKK-LBPRGKRZSA-N 1 1 334.807 3.670 20 5 EHBDMO Cc1c2ccccc2oc1[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])C(C)C ZINC000602806238 1033180077 /nfs/dbraw/zinc/18/00/77/1033180077.db2.gz PTJUMTWBFCZSBU-MRXNPFEDSA-N 1 1 342.399 3.870 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccn1CCC(C)C ZINC000237198247 1024202846 /nfs/dbraw/zinc/20/28/46/1024202846.db2.gz DHOJMULYPNMEET-UHFFFAOYSA-N 1 1 331.416 3.741 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000280899666 1024411742 /nfs/dbraw/zinc/41/17/42/1024411742.db2.gz DSUPKIIDKRLVOC-CRAIPNDOSA-N 1 1 341.411 3.650 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2nccs2)C1 ZINC000895581235 1024637646 /nfs/dbraw/zinc/63/76/46/1024637646.db2.gz MNEWZKZQSMPCEW-GLNPCMGASA-N 1 1 329.425 3.944 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccco1)C(C)C ZINC000346313279 1024638581 /nfs/dbraw/zinc/63/85/81/1024638581.db2.gz LVBTWNVMASBHJR-UHFFFAOYSA-N 1 1 345.399 3.735 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310338872 1024850314 /nfs/dbraw/zinc/85/03/14/1024850314.db2.gz CGQRSWDKDLUIQU-KRWDZBQOSA-N 1 1 325.412 3.837 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]C2(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000427967481 1024914194 /nfs/dbraw/zinc/91/41/94/1024914194.db2.gz RPCFZPVPISVRNU-CQSZACIVSA-N 1 1 339.395 3.725 20 5 EHBDMO Cc1c([C@@H](C)[NH2+]C2(C(=O)Nc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000427972459 1024915637 /nfs/dbraw/zinc/91/56/37/1024915637.db2.gz BACOTBXNOCNCHZ-CQSZACIVSA-N 1 1 339.395 3.725 20 5 EHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000015573750 1025068880 /nfs/dbraw/zinc/06/88/80/1025068880.db2.gz ATKWUNQURQSDPD-UHFFFAOYSA-N 1 1 325.412 3.827 20 5 EHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000015573750 1025068894 /nfs/dbraw/zinc/06/88/94/1025068894.db2.gz ATKWUNQURQSDPD-UHFFFAOYSA-N 1 1 325.412 3.827 20 5 EHBDMO C[C@@H]1C[N@H+](C(C)(C)CNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000515341086 1025179724 /nfs/dbraw/zinc/17/97/24/1025179724.db2.gz XDQDJCKGJGUGAF-TXEJJXNPSA-N 1 1 341.839 3.548 20 5 EHBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000515341086 1025179730 /nfs/dbraw/zinc/17/97/30/1025179730.db2.gz XDQDJCKGJGUGAF-TXEJJXNPSA-N 1 1 341.839 3.548 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896227660 1025261698 /nfs/dbraw/zinc/26/16/98/1025261698.db2.gz NUNQXHYFWUEOTB-LYKUJDHUSA-N 1 1 344.308 3.974 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000137 1025381841 /nfs/dbraw/zinc/38/18/41/1025381841.db2.gz WDUWNJURNCTRCJ-XLNTUCKNSA-N 1 1 346.471 3.789 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(C(C)(C)C)CC1 ZINC000530361464 1025704247 /nfs/dbraw/zinc/70/42/47/1025704247.db2.gz PJDBRWCEKDOAQY-UHFFFAOYSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000530495483 1025945950 /nfs/dbraw/zinc/94/59/50/1025945950.db2.gz QDPZCEGLPGBSJD-KRWDZBQOSA-N 1 1 332.425 3.670 20 5 EHBDMO CCO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000451549068 1026099340 /nfs/dbraw/zinc/09/93/40/1026099340.db2.gz VTWDQYHDNCRGML-WMLDXEAASA-N 1 1 336.432 3.629 20 5 EHBDMO Cc1cnc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553125 1026105535 /nfs/dbraw/zinc/10/55/35/1026105535.db2.gz XKWYEGNAIJXXGW-GDBMZVCRSA-N 1 1 326.400 3.634 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626635 1026151234 /nfs/dbraw/zinc/15/12/34/1026151234.db2.gz RBJIOJOUNJMIRW-SNVBAGLBSA-N 1 1 344.358 3.825 20 5 EHBDMO COc1cc(C[N@H+]2C[C@@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626632 1026151441 /nfs/dbraw/zinc/15/14/41/1026151441.db2.gz RBJIOJOUNJMIRW-JTQLQIEISA-N 1 1 344.358 3.825 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)cc1Cl ZINC000783676749 1026220727 /nfs/dbraw/zinc/22/07/27/1026220727.db2.gz NVJGHXOFVYMEBH-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1Cl ZINC000783676749 1026220730 /nfs/dbraw/zinc/22/07/30/1026220730.db2.gz NVJGHXOFVYMEBH-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000475150855 1026255151 /nfs/dbraw/zinc/25/51/51/1026255151.db2.gz KWNQTXFVBNBOMB-IBGZPJMESA-N 1 1 328.412 3.593 20 5 EHBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704825 1026355565 /nfs/dbraw/zinc/35/55/65/1026355565.db2.gz XSIABJYVBMFKRT-XJKSGUPXSA-N 1 1 330.384 3.590 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000530972509 1026448752 /nfs/dbraw/zinc/44/87/52/1026448752.db2.gz SBTIILVQOPBQOE-FQEVSTJZSA-N 1 1 340.423 3.819 20 5 EHBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000531405954 1026886439 /nfs/dbraw/zinc/88/64/39/1026886439.db2.gz OEPLDILRPDAXEX-IBGZPJMESA-N 1 1 328.412 3.614 20 5 EHBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000342784005 1027031563 /nfs/dbraw/zinc/03/15/63/1027031563.db2.gz REOUDPZQZNTFTO-GFCCVEGCSA-N 1 1 349.460 3.522 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000183808646 1027112251 /nfs/dbraw/zinc/11/22/51/1027112251.db2.gz OOXIOPWZIIDUOB-UHFFFAOYSA-N 1 1 346.774 3.830 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413179891 1027202616 /nfs/dbraw/zinc/20/26/16/1027202616.db2.gz CTDGMWKASYSXQC-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO Cc1c(CN[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663384 1027580634 /nfs/dbraw/zinc/58/06/34/1027580634.db2.gz FKFXORYIULODQB-HNAYVOBHSA-N 1 1 339.439 3.656 20 5 EHBDMO Cc1c(CN[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663384 1027580642 /nfs/dbraw/zinc/58/06/42/1027580642.db2.gz FKFXORYIULODQB-HNAYVOBHSA-N 1 1 339.439 3.656 20 5 EHBDMO Cc1nn(C(C)C)c(C)c1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000894271438 1027681142 /nfs/dbraw/zinc/68/11/42/1027681142.db2.gz GTQKBJJVCBJRJK-UHFFFAOYSA-N 1 1 330.432 3.664 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000503270564 1027698075 /nfs/dbraw/zinc/69/80/75/1027698075.db2.gz KVTASMAJPXRPRN-UHFFFAOYSA-N 1 1 329.400 3.765 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCCC1 ZINC000533398448 1027769735 /nfs/dbraw/zinc/76/97/35/1027769735.db2.gz QIVBLYKMLMNCBN-LLVKDONJSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)c(F)c1 ZINC000444685163 1028131018 /nfs/dbraw/zinc/13/10/18/1028131018.db2.gz QMSAFENOPIQITE-UHFFFAOYSA-N 1 1 346.337 3.774 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000532692287 1028166064 /nfs/dbraw/zinc/16/60/64/1028166064.db2.gz KBCGWROCDOPRJV-UHFFFAOYSA-N 1 1 345.443 3.527 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000444764382 1028250905 /nfs/dbraw/zinc/25/09/05/1028250905.db2.gz BCZFQVPXPINLHX-CQSZACIVSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000016434718 1028495849 /nfs/dbraw/zinc/49/58/49/1028495849.db2.gz MHNHGCYQGNJMRT-LLVKDONJSA-N 1 1 334.397 3.716 20 5 EHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000016434718 1028495854 /nfs/dbraw/zinc/49/58/54/1028495854.db2.gz MHNHGCYQGNJMRT-LLVKDONJSA-N 1 1 334.397 3.716 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000523855637 1028664395 /nfs/dbraw/zinc/66/43/95/1028664395.db2.gz RIEFTSYSBYPSIW-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000533242738 1029502841 /nfs/dbraw/zinc/50/28/41/1029502841.db2.gz LCIMNXZKOWYFLO-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000533287917 1029579492 /nfs/dbraw/zinc/57/94/92/1029579492.db2.gz HXCXQPCZHWCHCZ-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)CCC[C@H]1C ZINC000533293612 1029587622 /nfs/dbraw/zinc/58/76/22/1029587622.db2.gz WASKHZUVYVWYTL-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000159550242 1030265071 /nfs/dbraw/zinc/26/50/71/1030265071.db2.gz LKSYKQZNFMCRAZ-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1c(C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000159550242 1030265078 /nfs/dbraw/zinc/26/50/78/1030265078.db2.gz LKSYKQZNFMCRAZ-FQEVSTJZSA-N 1 1 338.407 3.577 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587023 1030321246 /nfs/dbraw/zinc/32/12/46/1030321246.db2.gz PWWBJURSHFAEKY-OXJNMPFZSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587023 1030321253 /nfs/dbraw/zinc/32/12/53/1030321253.db2.gz PWWBJURSHFAEKY-OXJNMPFZSA-N 1 1 345.487 3.930 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000520411926 1030490213 /nfs/dbraw/zinc/49/02/13/1030490213.db2.gz NCYPJICVJWBJOH-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO C[N@@H+](Cc1c2ccccc2cc2ccccc21)[C@H]1CCS(=O)(=O)C1 ZINC000157607146 1030658217 /nfs/dbraw/zinc/65/82/17/1030658217.db2.gz QGZBUYVUAYAOIH-KRWDZBQOSA-N 1 1 339.460 3.612 20 5 EHBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001168147750 1030926242 /nfs/dbraw/zinc/92/62/42/1030926242.db2.gz XGVHKKZJMOUKEW-INIZCTEOSA-N 1 1 347.459 3.990 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000729852625 1030939271 /nfs/dbraw/zinc/93/92/71/1030939271.db2.gz PKKWCPPUNVHIRZ-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000729852625 1030939287 /nfs/dbraw/zinc/93/92/87/1030939287.db2.gz PKKWCPPUNVHIRZ-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@H]1c1ccc(Cl)cc1 ZINC000249277077 1030947289 /nfs/dbraw/zinc/94/72/89/1030947289.db2.gz LLIBOTIGPVRNIG-WCQYABFASA-N 1 1 338.820 3.562 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@H]1c1ccc(Cl)cc1 ZINC000249277077 1030947301 /nfs/dbraw/zinc/94/73/01/1030947301.db2.gz LLIBOTIGPVRNIG-WCQYABFASA-N 1 1 338.820 3.562 20 5 EHBDMO CCOc1ncccc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192652250 1030954779 /nfs/dbraw/zinc/95/47/79/1030954779.db2.gz FVXDWUDBADRPCB-KRWDZBQOSA-N 1 1 327.384 3.556 20 5 EHBDMO CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)[nH+]c(C1CC1)n2C ZINC000192729072 1031418142 /nfs/dbraw/zinc/41/81/42/1031418142.db2.gz HBVFXVAOLFFFQD-UHFFFAOYSA-N 1 1 340.387 3.627 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H](C)[C@H]1C ZINC000475744577 1031834697 /nfs/dbraw/zinc/83/46/97/1031834697.db2.gz RBVXSTGVJDEZRJ-VHDGCEQUSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1ccc([C@H](C)NC[C@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950662 1032036534 /nfs/dbraw/zinc/03/65/34/1032036534.db2.gz HTEWZVLQVWMNJN-DLBZAZTESA-N 1 1 333.476 3.922 20 5 EHBDMO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594522408 1033430898 /nfs/dbraw/zinc/43/08/98/1033430898.db2.gz LGXPWCOLLGVUPP-XIWSCHCOSA-N 1 1 328.343 3.833 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCC[N@H+]4CCCC[C@H]34)c2c1 ZINC000594599887 1033445642 /nfs/dbraw/zinc/44/56/42/1033445642.db2.gz KAYVLJIRRCHUNT-IAGOWNOFSA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000611939329 1033453495 /nfs/dbraw/zinc/45/34/95/1033453495.db2.gz IHOZDGYDPDHPQL-AWEZNQCLSA-N 1 1 329.400 3.936 20 5 EHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329288 1033730272 /nfs/dbraw/zinc/73/02/72/1033730272.db2.gz PNKBPDJKGXXKPE-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@H](Cc2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595331247 1033731646 /nfs/dbraw/zinc/73/16/46/1033731646.db2.gz SWUNBSREQFIVFR-OAHLLOKOSA-N 1 1 335.379 3.729 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000593019667 1033819276 /nfs/dbraw/zinc/81/92/76/1033819276.db2.gz IKIAMDQUGAYZAA-GFCCVEGCSA-N 1 1 346.358 3.680 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500874 1033832027 /nfs/dbraw/zinc/83/20/27/1033832027.db2.gz GFYKFSJRKBQROL-CYBMUJFWSA-N 1 1 345.374 3.517 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500874 1033832032 /nfs/dbraw/zinc/83/20/32/1033832032.db2.gz GFYKFSJRKBQROL-CYBMUJFWSA-N 1 1 345.374 3.517 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520809 1033839802 /nfs/dbraw/zinc/83/98/02/1033839802.db2.gz FEWPTOIXMKXSEP-MRXNPFEDSA-N 1 1 348.406 3.918 20 5 EHBDMO Cc1noc(C[N@@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)c1[N+](=O)[O-] ZINC000595557438 1033861937 /nfs/dbraw/zinc/86/19/37/1033861937.db2.gz IRGRWJDEBAEHLS-JTQLQIEISA-N 1 1 335.791 3.706 20 5 EHBDMO Cc1noc(C[N@H+]2CCc3ccc(Cl)cc3[C@@H](C)C2)c1[N+](=O)[O-] ZINC000595557438 1033861950 /nfs/dbraw/zinc/86/19/50/1033861950.db2.gz IRGRWJDEBAEHLS-JTQLQIEISA-N 1 1 335.791 3.706 20 5 EHBDMO CC(C)C[C@@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)N(C)C ZINC000608835673 1033909526 /nfs/dbraw/zinc/90/95/26/1033909526.db2.gz IJGRDQFGSHKPHB-KRWDZBQOSA-N 1 1 345.443 3.921 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1cccnc1[N+](=O)[O-] ZINC000603859491 1033983120 /nfs/dbraw/zinc/98/31/20/1033983120.db2.gz CILHSLDGXYRRLB-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO O=C(C[N@H+]1CCC[C@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896346 1034003713 /nfs/dbraw/zinc/00/37/13/1034003713.db2.gz OOMSGTDZLFPLKM-INIZCTEOSA-N 1 1 331.416 3.578 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1F ZINC000599600087 1034040864 /nfs/dbraw/zinc/04/08/64/1034040864.db2.gz XBTBDFGTSSEGOF-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000059893812 1034041344 /nfs/dbraw/zinc/04/13/44/1034041344.db2.gz HHKLEMYEGIUAQN-NSHDSACASA-N 1 1 331.338 3.756 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092480 1034077627 /nfs/dbraw/zinc/07/76/27/1034077627.db2.gz ANXVASDKIBDLBR-UZLBHIALSA-N 1 1 343.471 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H]1CCC[N@@H+](CC3CC3)C1)CCC2 ZINC000596092480 1034077632 /nfs/dbraw/zinc/07/76/32/1034077632.db2.gz ANXVASDKIBDLBR-UZLBHIALSA-N 1 1 343.471 3.684 20 5 EHBDMO CC[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095280 1034078617 /nfs/dbraw/zinc/07/86/17/1034078617.db2.gz OOSGJCXCQWEPIK-LPHOPBHVSA-N 1 1 331.460 3.758 20 5 EHBDMO CC[C@H](NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095280 1034078632 /nfs/dbraw/zinc/07/86/32/1034078632.db2.gz OOSGJCXCQWEPIK-LPHOPBHVSA-N 1 1 331.460 3.758 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484205 1034388557 /nfs/dbraw/zinc/38/85/57/1034388557.db2.gz FGHYIMXUQKUYBW-GOSISDBHSA-N 1 1 328.368 3.516 20 5 EHBDMO CC(C)([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000604560027 1034412220 /nfs/dbraw/zinc/41/22/20/1034412220.db2.gz JNLBWOJPBQWMON-UHFFFAOYSA-N 1 1 338.367 3.670 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC4(COC4)C3)o2)c(Cl)c1 ZINC000597228641 1034611117 /nfs/dbraw/zinc/61/11/17/1034611117.db2.gz FNWCAWHXAVDXTJ-UHFFFAOYSA-N 1 1 348.786 3.731 20 5 EHBDMO CC(C)[N@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236652772 1035029611 /nfs/dbraw/zinc/02/96/11/1035029611.db2.gz WZIQSRJREKSWDN-UHFFFAOYSA-N 1 1 333.457 3.753 20 5 EHBDMO CC(C)[N@@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236652772 1035029622 /nfs/dbraw/zinc/02/96/22/1035029622.db2.gz WZIQSRJREKSWDN-UHFFFAOYSA-N 1 1 333.457 3.753 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589110893 1036257058 /nfs/dbraw/zinc/25/70/58/1036257058.db2.gz OYADUEDEZYTIQZ-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO C[N@@H+]1CCO[C@@H](CSCc2nc3ccccc3c3ccccc23)C1 ZINC000572601737 1036395538 /nfs/dbraw/zinc/39/55/38/1036395538.db2.gz YTKVUBROWGFLGG-OAHLLOKOSA-N 1 1 338.476 3.952 20 5 EHBDMO C[N@H+]1CCO[C@@H](CSCc2nc3ccccc3c3ccccc23)C1 ZINC000572601737 1036395556 /nfs/dbraw/zinc/39/55/56/1036395556.db2.gz YTKVUBROWGFLGG-OAHLLOKOSA-N 1 1 338.476 3.952 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589494408 1036437182 /nfs/dbraw/zinc/43/71/82/1036437182.db2.gz GJOXNQYCPDSULA-UHFFFAOYSA-N 1 1 342.395 3.794 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)s1 ZINC000609132754 1036468165 /nfs/dbraw/zinc/46/81/65/1036468165.db2.gz GWLUVZYZCURWSU-OAHLLOKOSA-N 1 1 331.441 3.633 20 5 EHBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082353 1036735911 /nfs/dbraw/zinc/73/59/11/1036735911.db2.gz RZYNJDSXEPWDFB-QGZVFWFLSA-N 1 1 334.379 3.742 20 5 EHBDMO CCN(C)c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000191232962 1036739996 /nfs/dbraw/zinc/73/99/96/1036739996.db2.gz ODWIFDFWXRROOH-UHFFFAOYSA-N 1 1 340.427 3.611 20 5 EHBDMO CCN(C)c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000191232962 1036740017 /nfs/dbraw/zinc/74/00/17/1036740017.db2.gz ODWIFDFWXRROOH-UHFFFAOYSA-N 1 1 340.427 3.611 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000026233088 1036838871 /nfs/dbraw/zinc/83/88/71/1036838871.db2.gz XBHVZMWIYTWYAC-KRWDZBQOSA-N 1 1 336.395 3.609 20 5 EHBDMO C[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000180469562 1036873198 /nfs/dbraw/zinc/87/31/98/1036873198.db2.gz MWVWBTBHKHNSBR-MGPUTAFESA-N 1 1 339.439 3.757 20 5 EHBDMO C[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N(C)C1CC1 ZINC000180469562 1036873218 /nfs/dbraw/zinc/87/32/18/1036873218.db2.gz MWVWBTBHKHNSBR-MGPUTAFESA-N 1 1 339.439 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCN(c3ccccc3)CC2)cc1Cl ZINC000761506880 1037076705 /nfs/dbraw/zinc/07/67/05/1037076705.db2.gz OOSYWODRWOOCER-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@@H]2/C=C/c2cccs2)n1 ZINC000542131642 1037107267 /nfs/dbraw/zinc/10/72/67/1037107267.db2.gz NKZDUSHJMZKCTR-MVGZEHJDSA-N 1 1 346.456 3.811 20 5 EHBDMO COc1ccc(-c2ccc(C[NH+]3CC(C(F)F)C3)o2)c([N+](=O)[O-])c1 ZINC000590968816 1037148349 /nfs/dbraw/zinc/14/83/49/1037148349.db2.gz SZSQIMAWPBVVOJ-UHFFFAOYSA-N 1 1 338.310 3.560 20 5 EHBDMO COc1c(C)c[nH+]c(Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)c1C ZINC000539756279 1037153807 /nfs/dbraw/zinc/15/38/07/1037153807.db2.gz FFAASMIYHJBGDJ-UHFFFAOYSA-N 1 1 338.367 3.527 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000539826120 1037248797 /nfs/dbraw/zinc/24/87/97/1037248797.db2.gz LXYWNENOSHWQJR-UHFFFAOYSA-N 1 1 348.406 3.852 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000539826120 1037248807 /nfs/dbraw/zinc/24/88/07/1037248807.db2.gz LXYWNENOSHWQJR-UHFFFAOYSA-N 1 1 348.406 3.852 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000177053859 1037342674 /nfs/dbraw/zinc/34/26/74/1037342674.db2.gz PUBXMBKXBSDBQG-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])ccc1O ZINC000177053859 1037342688 /nfs/dbraw/zinc/34/26/88/1037342688.db2.gz PUBXMBKXBSDBQG-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO CCOc1cc(NCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000386746339 1037347528 /nfs/dbraw/zinc/34/75/28/1037347528.db2.gz ZSKQQAYCNNWDFJ-UHFFFAOYSA-N 1 1 329.400 3.537 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462783693 1037386795 /nfs/dbraw/zinc/38/67/95/1037386795.db2.gz UIVJKGMAYLSYSQ-LLVKDONJSA-N 1 1 342.237 3.644 20 5 EHBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000462830801 1037453739 /nfs/dbraw/zinc/45/37/39/1037453739.db2.gz GCNCJJZEBVRYNB-UHFFFAOYSA-N 1 1 330.432 3.863 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCOC1 ZINC000462877889 1037507418 /nfs/dbraw/zinc/50/74/18/1037507418.db2.gz RKQVJPVFCDRHSG-INIZCTEOSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786892 1037536517 /nfs/dbraw/zinc/53/65/17/1037536517.db2.gz GTABYMUDLFIOSS-HBUWYVDXSA-N 1 1 344.411 3.836 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000532518771 1037560860 /nfs/dbraw/zinc/56/08/60/1037560860.db2.gz UWNOFEHWLFBNRQ-HUUCEWRRSA-N 1 1 341.411 3.657 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)ccc2ncccc21 ZINC000462947329 1037574048 /nfs/dbraw/zinc/57/40/48/1037574048.db2.gz LGLHZCYKGHYWAR-OAHLLOKOSA-N 1 1 340.427 3.819 20 5 EHBDMO C[N@H+](CCOC(C)(C)C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000591845293 1037650644 /nfs/dbraw/zinc/65/06/44/1037650644.db2.gz CUAMWUMTTAZTNW-UHFFFAOYSA-N 1 1 345.237 3.604 20 5 EHBDMO C[N@@H+](CCOC(C)(C)C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000591845293 1037650660 /nfs/dbraw/zinc/65/06/60/1037650660.db2.gz CUAMWUMTTAZTNW-UHFFFAOYSA-N 1 1 345.237 3.604 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1CC[N@@H+](C2CCCC2)C1 ZINC000468656246 1038397114 /nfs/dbraw/zinc/39/71/14/1038397114.db2.gz TZECUIVPKGFSDV-JMPLCFMRSA-N 1 1 329.444 3.605 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000468656246 1038397124 /nfs/dbraw/zinc/39/71/24/1038397124.db2.gz TZECUIVPKGFSDV-JMPLCFMRSA-N 1 1 329.444 3.605 20 5 EHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538731133 1038497090 /nfs/dbraw/zinc/49/70/90/1038497090.db2.gz DLSYTFNKWOQISM-HNNXBMFYSA-N 1 1 342.443 3.863 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000538760042 1038509746 /nfs/dbraw/zinc/50/97/46/1038509746.db2.gz NPJDZVPOWSSHTC-GJZGRUSLSA-N 1 1 347.459 3.513 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@H]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000485453220 1039085860 /nfs/dbraw/zinc/08/58/60/1039085860.db2.gz RSTCWGCEQUDMLA-KRWDZBQOSA-N 1 1 326.396 3.593 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H](O)C23CCCC3)o1 ZINC000552316902 1039201715 /nfs/dbraw/zinc/20/17/15/1039201715.db2.gz RXOQSCQKQBJZOH-SFHVURJKSA-N 1 1 342.395 3.734 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H](C4CC4)C3)s2)cc1 ZINC000485686072 1039423400 /nfs/dbraw/zinc/42/34/00/1039423400.db2.gz RNRFIWFGDWMQCK-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H](C4CC4)C3)s2)cc1 ZINC000485686072 1039423407 /nfs/dbraw/zinc/42/34/07/1039423407.db2.gz RNRFIWFGDWMQCK-KRWDZBQOSA-N 1 1 344.436 3.934 20 5 EHBDMO C[C@@H]1C[C@H](CCNc2ncccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000511603751 1039430463 /nfs/dbraw/zinc/43/04/63/1039430463.db2.gz MDGPRTLCQXQBDV-WBVHZDCISA-N 1 1 340.427 3.702 20 5 EHBDMO C[C@H]1C[C@H](CCNc2ncccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000511603749 1039431119 /nfs/dbraw/zinc/43/11/19/1039431119.db2.gz MDGPRTLCQXQBDV-RDJZCZTQSA-N 1 1 340.427 3.702 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000485738640 1039491105 /nfs/dbraw/zinc/49/11/05/1039491105.db2.gz OUYPIWTXIXEYJE-CYBMUJFWSA-N 1 1 328.368 3.825 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000842167932 1039519913 /nfs/dbraw/zinc/51/99/13/1039519913.db2.gz YLWFPSLMXZTGCG-DDHJBXDOSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000842167932 1039519931 /nfs/dbraw/zinc/51/99/31/1039519931.db2.gz YLWFPSLMXZTGCG-DDHJBXDOSA-N 1 1 339.823 3.552 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053232766 1039523402 /nfs/dbraw/zinc/52/34/02/1039523402.db2.gz WYQHSTLIPBVVSH-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053232766 1039523418 /nfs/dbraw/zinc/52/34/18/1039523418.db2.gz WYQHSTLIPBVVSH-GFCCVEGCSA-N 1 1 347.802 3.880 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474632 1039768568 /nfs/dbraw/zinc/76/85/68/1039768568.db2.gz IDQPXRFVRWWLAH-MAUKXSAKSA-N 1 1 331.460 3.540 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474632 1039768585 /nfs/dbraw/zinc/76/85/85/1039768585.db2.gz IDQPXRFVRWWLAH-MAUKXSAKSA-N 1 1 331.460 3.540 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700920 1039924735 /nfs/dbraw/zinc/92/47/35/1039924735.db2.gz RYZCYCWYQFVSDN-JKSUJKDBSA-N 1 1 349.475 3.909 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490034293 1040300720 /nfs/dbraw/zinc/30/07/20/1040300720.db2.gz VBXTYPPEPKBEFF-WMLDXEAASA-N 1 1 326.396 3.981 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000428739111 1040308838 /nfs/dbraw/zinc/30/88/38/1040308838.db2.gz QCDHHFGQXNUUOS-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000428739111 1040308850 /nfs/dbraw/zinc/30/88/50/1040308850.db2.gz QCDHHFGQXNUUOS-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069280 1040431468 /nfs/dbraw/zinc/43/14/68/1040431468.db2.gz GNHRALPPEIRXMF-ZBFHGGJFSA-N 1 1 333.432 3.824 20 5 EHBDMO COC1(C(F)(F)F)CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000418094056 1040575083 /nfs/dbraw/zinc/57/50/83/1040575083.db2.gz RFIVRFIDFSFLQT-XQRVVYSFSA-N 1 1 344.333 3.651 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000249363858 1041132059 /nfs/dbraw/zinc/13/20/59/1041132059.db2.gz VIVDZQFUMHBLJW-SJCJKPOMSA-N 1 1 346.456 3.734 20 5 EHBDMO CC(=O)c1cc(NCCCC[N@@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000341520192 1041256143 /nfs/dbraw/zinc/25/61/43/1041256143.db2.gz ACZOJNISNHTZQC-AWEZNQCLSA-N 1 1 333.432 3.721 20 5 EHBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513761 1042250313 /nfs/dbraw/zinc/25/03/13/1042250313.db2.gz FSZHYAAOAMYHLE-LBPRGKRZSA-N 1 1 341.367 3.505 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700805 1042419820 /nfs/dbraw/zinc/41/98/20/1042419820.db2.gz YFBZPXXNOAJOIW-HUUCEWRRSA-N 1 1 347.459 3.530 20 5 EHBDMO Cc1[nH+]c(N)ccc1CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001167786109 1042465849 /nfs/dbraw/zinc/46/58/49/1042465849.db2.gz LBKUNCLIJGDRRJ-UHFFFAOYSA-N 1 1 326.278 3.511 20 5 EHBDMO CCn1nccc1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000278873127 1042792954 /nfs/dbraw/zinc/79/29/54/1042792954.db2.gz MIIXPLGASUBWMT-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO CCC[C@H](NCCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421086 1043157841 /nfs/dbraw/zinc/15/78/41/1043157841.db2.gz FSRYGANXJJIWEW-APWZRJJASA-N 1 1 349.475 3.527 20 5 EHBDMO CCC[C@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421086 1043157842 /nfs/dbraw/zinc/15/78/42/1043157842.db2.gz FSRYGANXJJIWEW-APWZRJJASA-N 1 1 349.475 3.527 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000185879366 1127181800 /nfs/dbraw/zinc/18/18/00/1127181800.db2.gz FQGOENCPHFAELZ-AWEZNQCLSA-N 1 1 349.431 3.587 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491630 1127498862 /nfs/dbraw/zinc/49/88/62/1127498862.db2.gz DLYJTQIFZXOEDH-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO COC(=O)c1csc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000552275258 1127727579 /nfs/dbraw/zinc/72/75/79/1127727579.db2.gz PNLCMCUPRXDAGX-MNOVXSKESA-N 1 1 334.397 3.855 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ncc([N+](=O)[O-])cc1Cl ZINC000301283644 1127729580 /nfs/dbraw/zinc/72/95/80/1127729580.db2.gz PLKPZHMCJXXQEG-LBPRGKRZSA-N 1 1 326.828 3.710 20 5 EHBDMO CCOc1cc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698825 1128730001 /nfs/dbraw/zinc/73/00/01/1128730001.db2.gz UXRHJYUBBJYQNO-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](CCO)c1ccccc1 ZINC000542927501 1128849625 /nfs/dbraw/zinc/84/96/25/1128849625.db2.gz LBOFCNMXDNOKOI-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](CCO)c1ccccc1 ZINC000542927501 1128849630 /nfs/dbraw/zinc/84/96/30/1128849630.db2.gz LBOFCNMXDNOKOI-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000494647235 1120712761 /nfs/dbraw/zinc/71/27/61/1120712761.db2.gz HQHAIDXAADZRPL-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000494647235 1120712765 /nfs/dbraw/zinc/71/27/65/1120712765.db2.gz HQHAIDXAADZRPL-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(F)c3cccnc13)C2 ZINC000153345702 1120974576 /nfs/dbraw/zinc/97/45/76/1120974576.db2.gz MSJKUKSTQIBJSA-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(F)c3cccnc13)C2 ZINC000153345702 1120974580 /nfs/dbraw/zinc/97/45/80/1120974580.db2.gz MSJKUKSTQIBJSA-UHFFFAOYSA-N 1 1 337.354 3.840 20 5 EHBDMO O=c1[nH]c2ccccc2cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130580246 1121097910 /nfs/dbraw/zinc/09/79/10/1121097910.db2.gz MUYCZWNXWVWQPU-UHFFFAOYSA-N 1 1 349.390 3.601 20 5 EHBDMO Cc1cnc(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039588 1128977138 /nfs/dbraw/zinc/97/71/38/1128977138.db2.gz DWZQUFWAEDXCEL-WBVHZDCISA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000487980433 1121423698 /nfs/dbraw/zinc/42/36/98/1121423698.db2.gz LDILULHGNGUCOP-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000487980433 1121423700 /nfs/dbraw/zinc/42/37/00/1121423700.db2.gz LDILULHGNGUCOP-ZDUSSCGKSA-N 1 1 345.374 3.501 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000123715773 1121616382 /nfs/dbraw/zinc/61/63/82/1121616382.db2.gz MFDSOGXBBCIMBD-ZFWWWQNUSA-N 1 1 346.349 3.606 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000123715773 1121616384 /nfs/dbraw/zinc/61/63/84/1121616384.db2.gz MFDSOGXBBCIMBD-ZFWWWQNUSA-N 1 1 346.349 3.606 20 5 EHBDMO O=[N+]([O-])c1c(F)cccc1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000301100848 1121692520 /nfs/dbraw/zinc/69/25/20/1121692520.db2.gz OIRKZNIQPGXCHA-VMPITWQZSA-N 1 1 341.386 3.569 20 5 EHBDMO Cc1c(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609233632 1121836927 /nfs/dbraw/zinc/83/69/27/1121836927.db2.gz FMCLMZOGDWGEHI-LJQANCHMSA-N 1 1 326.396 3.867 20 5 EHBDMO C[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000301741628 1129028357 /nfs/dbraw/zinc/02/83/57/1129028357.db2.gz LGKAYTGFHMYRCF-LBPRGKRZSA-N 1 1 346.818 3.502 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Br)c(F)c1 ZINC000112017973 1122277568 /nfs/dbraw/zinc/27/75/68/1122277568.db2.gz MANYCDZFMFMTOS-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO C[N@H+](CCOc1ccc(Cl)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917024928 1122442828 /nfs/dbraw/zinc/44/28/28/1122442828.db2.gz CQJGTKQSJVNUSI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917024928 1122442832 /nfs/dbraw/zinc/44/28/32/1122442832.db2.gz CQJGTKQSJVNUSI-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000917073206 1122478330 /nfs/dbraw/zinc/47/83/30/1122478330.db2.gz ITROXJYTLRLKGM-ZDUSSCGKSA-N 1 1 336.392 3.570 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394320 1122596437 /nfs/dbraw/zinc/59/64/37/1122596437.db2.gz LYNXKZWHWHWQPB-KRWDZBQOSA-N 1 1 326.352 3.506 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194702592 1122872897 /nfs/dbraw/zinc/87/28/97/1122872897.db2.gz NHURXSODOOLLLV-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194702592 1122872900 /nfs/dbraw/zinc/87/29/00/1122872900.db2.gz NHURXSODOOLLLV-LBPRGKRZSA-N 1 1 333.413 3.505 20 5 EHBDMO Cc1cccc2nc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cn21 ZINC000064350843 1123573644 /nfs/dbraw/zinc/57/36/44/1123573644.db2.gz BSADQMDOSQHJCZ-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO Cc1cccc2nc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cn21 ZINC000064350843 1123573648 /nfs/dbraw/zinc/57/36/48/1123573648.db2.gz BSADQMDOSQHJCZ-UHFFFAOYSA-N 1 1 338.411 3.962 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672699 1123641678 /nfs/dbraw/zinc/64/16/78/1123641678.db2.gz XXCWCCCRXYAPRV-WBVHZDCISA-N 1 1 326.396 3.852 20 5 EHBDMO CCCCC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000609766483 1123663668 /nfs/dbraw/zinc/66/36/68/1123663668.db2.gz VCQTUKMDXSCDDB-UHFFFAOYSA-N 1 1 349.431 3.793 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610002120 1123711465 /nfs/dbraw/zinc/71/14/65/1123711465.db2.gz DTJXHZWCKXIZBQ-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000610002120 1123711468 /nfs/dbraw/zinc/71/14/68/1123711468.db2.gz DTJXHZWCKXIZBQ-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249648 1123752481 /nfs/dbraw/zinc/75/24/81/1123752481.db2.gz CTPDUXWRMYUOHR-GJZGRUSLSA-N 1 1 335.423 3.825 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)c2C1 ZINC000066514994 1129180020 /nfs/dbraw/zinc/18/00/20/1129180020.db2.gz MUTSUWWXJGCBHH-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)c2C1 ZINC000066514994 1129180023 /nfs/dbraw/zinc/18/00/23/1129180023.db2.gz MUTSUWWXJGCBHH-UHFFFAOYSA-N 1 1 339.395 3.881 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301993132 1129505551 /nfs/dbraw/zinc/50/55/51/1129505551.db2.gz GRVFUSKWVFTLFV-GFCCVEGCSA-N 1 1 334.807 3.576 20 5 EHBDMO CC(=O)Nc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000154308880 1129548590 /nfs/dbraw/zinc/54/85/90/1129548590.db2.gz SEBRZTVUYRMYIM-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO CC(=O)Nc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000154308880 1129548593 /nfs/dbraw/zinc/54/85/93/1129548593.db2.gz SEBRZTVUYRMYIM-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cn1 ZINC000390865323 1129638861 /nfs/dbraw/zinc/63/88/61/1129638861.db2.gz NXGAXCJFZZGTTQ-AYHJJNSGSA-N 1 1 338.411 3.597 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000391464439 1129668247 /nfs/dbraw/zinc/66/82/47/1129668247.db2.gz ZDSQZFTUUYPUFJ-BFYDXBDKSA-N 1 1 338.835 3.764 20 5 EHBDMO Cc1ccc(CNc2ncc([N+](=O)[O-])cc2Cl)c(N2CCCC2)[nH+]1 ZINC000302051553 1129765837 /nfs/dbraw/zinc/76/58/37/1129765837.db2.gz OCEJPMLMKNNYBK-UHFFFAOYSA-N 1 1 347.806 3.559 20 5 EHBDMO COc1cccc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000355408454 1129950767 /nfs/dbraw/zinc/95/07/67/1129950767.db2.gz BJYGBUWTZIKBRN-CQSZACIVSA-N 1 1 329.400 3.536 20 5 EHBDMO O=C(C[N@@H+](CC1CCCCC1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000059409080 1129987500 /nfs/dbraw/zinc/98/75/00/1129987500.db2.gz MMNHAPGMKJFKJN-UHFFFAOYSA-N 1 1 331.416 3.578 20 5 EHBDMO Cc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)o1 ZINC000171129187 1130014409 /nfs/dbraw/zinc/01/44/09/1130014409.db2.gz PFYGEWHAHKDXPU-NSHDSACASA-N 1 1 332.356 3.522 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518110 1130228309 /nfs/dbraw/zinc/22/83/09/1130228309.db2.gz HJXJVCGQFUZNQS-UONOGXRCSA-N 1 1 334.416 3.628 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000245923011 1130331519 /nfs/dbraw/zinc/33/15/19/1130331519.db2.gz OEWLRVLEYBEWHV-UTUOFQBUSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000245923011 1130331525 /nfs/dbraw/zinc/33/15/25/1130331525.db2.gz OEWLRVLEYBEWHV-UTUOFQBUSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794890 1131082764 /nfs/dbraw/zinc/08/27/64/1131082764.db2.gz HITFVLDUVBCBSW-CVEARBPZSA-N 1 1 349.450 3.820 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000733992029 1131180488 /nfs/dbraw/zinc/18/04/88/1131180488.db2.gz LNCZXIRPJQYIKR-SFHVURJKSA-N 1 1 326.400 3.724 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1C ZINC000740870791 1131550811 /nfs/dbraw/zinc/55/08/11/1131550811.db2.gz IMMFFGIVLRDOKA-NWDGAFQWSA-N 1 1 334.445 3.514 20 5 EHBDMO C[N@@H+](CCC1CCCCC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742147883 1131691017 /nfs/dbraw/zinc/69/10/17/1131691017.db2.gz KALOZTPVCGBJEY-UHFFFAOYSA-N 1 1 343.431 3.713 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000742153797 1131694299 /nfs/dbraw/zinc/69/42/99/1131694299.db2.gz ZLWBLKCTRMQVJW-QGZVFWFLSA-N 1 1 328.416 3.820 20 5 EHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000742153797 1131694301 /nfs/dbraw/zinc/69/43/01/1131694301.db2.gz ZLWBLKCTRMQVJW-QGZVFWFLSA-N 1 1 328.416 3.820 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000742420128 1131721966 /nfs/dbraw/zinc/72/19/66/1131721966.db2.gz ZGHRLRWKKKDEEM-LBPRGKRZSA-N 1 1 334.445 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC(F)(F)c1ccccn1)CC2 ZINC001172901726 1131885157 /nfs/dbraw/zinc/88/51/57/1131885157.db2.gz JUUKQGCVZDSJGK-HNNXBMFYSA-N 1 1 347.365 3.619 20 5 EHBDMO CCCCC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(=O)OC ZINC001172904966 1131885876 /nfs/dbraw/zinc/88/58/76/1131885876.db2.gz BPTTXTJYHTUVGA-AEFFLSMTSA-N 1 1 348.443 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](F)C(F)(F)CC1)CC2 ZINC001172907902 1131887921 /nfs/dbraw/zinc/88/79/21/1131887921.db2.gz JJPLPXJAMUCTLY-GDBMZVCRSA-N 1 1 342.361 3.911 20 5 EHBDMO Cc1nc2c(s1)C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172914833 1131902564 /nfs/dbraw/zinc/90/25/64/1131902564.db2.gz JTUPKBDAYNEGCL-HNNXBMFYSA-N 1 1 343.452 3.665 20 5 EHBDMO CCC[C@]1(C)CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000743407396 1131916980 /nfs/dbraw/zinc/91/69/80/1131916980.db2.gz SDAYMELTBKNEBL-GOSISDBHSA-N 1 1 343.431 3.713 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000743407396 1131916986 /nfs/dbraw/zinc/91/69/86/1131916986.db2.gz SDAYMELTBKNEBL-GOSISDBHSA-N 1 1 343.431 3.713 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013795 1131935729 /nfs/dbraw/zinc/93/57/29/1131935729.db2.gz FXUFAQPXBPSZKY-LBPRGKRZSA-N 1 1 339.386 3.716 20 5 EHBDMO CCCC[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014625 1131936145 /nfs/dbraw/zinc/93/61/45/1131936145.db2.gz VDCKVEXSGCAKLF-UHFFFAOYSA-N 1 1 327.375 3.574 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2ccsc2)c1F ZINC001173195169 1131995788 /nfs/dbraw/zinc/99/57/88/1131995788.db2.gz CSZNIQRMHFHAIG-LLVKDONJSA-N 1 1 338.404 3.867 20 5 EHBDMO Cc1ccccc1O[C@H]1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226689 1132006534 /nfs/dbraw/zinc/00/65/34/1132006534.db2.gz KWGPDJQXFPUFSZ-LPHOPBHVSA-N 1 1 340.423 3.988 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226553 1132006675 /nfs/dbraw/zinc/00/66/75/1132006675.db2.gz KJSGJZPSVPNKMY-IEBWSBKVSA-N 1 1 345.487 3.866 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001173231906 1132009606 /nfs/dbraw/zinc/00/96/06/1132009606.db2.gz DMDFPERPPXTMGB-AWEZNQCLSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001173232493 1132010632 /nfs/dbraw/zinc/01/06/32/1132010632.db2.gz BSOOPMRUTNGUSX-CABCVRRESA-N 1 1 330.428 3.750 20 5 EHBDMO CCCC[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCCC1 ZINC000746044210 1132352542 /nfs/dbraw/zinc/35/25/42/1132352542.db2.gz KITSPWGKKRMOCP-UHFFFAOYSA-N 1 1 347.415 3.895 20 5 EHBDMO C[NH+]1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3)cc2Cl)CC1 ZINC001174478317 1132382137 /nfs/dbraw/zinc/38/21/37/1132382137.db2.gz UEHQTAXMZKWKRY-UHFFFAOYSA-N 1 1 346.818 3.744 20 5 EHBDMO COCC[N@H+](Cc1ccc(C)cc1C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746152822 1132385899 /nfs/dbraw/zinc/38/58/99/1132385899.db2.gz DLKYLBVHUNRJFM-UHFFFAOYSA-N 1 1 346.402 3.999 20 5 EHBDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746152822 1132385906 /nfs/dbraw/zinc/38/59/06/1132385906.db2.gz DLKYLBVHUNRJFM-UHFFFAOYSA-N 1 1 346.402 3.999 20 5 EHBDMO COc1ccc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)cc1[N+](=O)[O-] ZINC001169110765 1132671738 /nfs/dbraw/zinc/67/17/38/1132671738.db2.gz DMBMXXBGEGEWAC-HNNXBMFYSA-N 1 1 333.413 3.609 20 5 EHBDMO O=[N+]([O-])/C=C/c1ccc(Nc2cccc(C[NH+]3CCOCC3)c2)cc1 ZINC001175902967 1132794222 /nfs/dbraw/zinc/79/42/22/1132794222.db2.gz YYZFOLWMVBZCHN-CMDGGOBGSA-N 1 1 339.395 3.510 20 5 EHBDMO Cc1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000767453207 1133005352 /nfs/dbraw/zinc/00/53/52/1133005352.db2.gz FXLIDKSQWZMESS-LBPRGKRZSA-N 1 1 334.807 3.674 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294665 1133047162 /nfs/dbraw/zinc/04/71/62/1133047162.db2.gz ONJUDYXXJUPIEV-BOLKPDSISA-N 1 1 345.487 3.956 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294665 1133047166 /nfs/dbraw/zinc/04/71/66/1133047166.db2.gz ONJUDYXXJUPIEV-BOLKPDSISA-N 1 1 345.487 3.956 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294665 1133047173 /nfs/dbraw/zinc/04/71/73/1133047173.db2.gz ONJUDYXXJUPIEV-BOLKPDSISA-N 1 1 345.487 3.956 20 5 EHBDMO CC(C)c1ccc(CNC[C@H]2CC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314805 1133243702 /nfs/dbraw/zinc/24/37/02/1133243702.db2.gz FCUVWNXOXZATPU-QGZVFWFLSA-N 1 1 331.460 3.825 20 5 EHBDMO CC(C)c1ccc(CNC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314805 1133243708 /nfs/dbraw/zinc/24/37/08/1133243708.db2.gz FCUVWNXOXZATPU-QGZVFWFLSA-N 1 1 331.460 3.825 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000769445590 1133291643 /nfs/dbraw/zinc/29/16/43/1133291643.db2.gz HIBAJQPRQOVEEL-QGZVFWFLSA-N 1 1 341.411 3.583 20 5 EHBDMO C[N@@H+](Cc1c2ccccc2c(Cl)c2ccccc21)[C@@H]1CCNC1=O ZINC000770378155 1133416273 /nfs/dbraw/zinc/41/62/73/1133416273.db2.gz DPPZPTDFHGZLGY-GOSISDBHSA-N 1 1 338.838 3.967 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001182127293 1133574936 /nfs/dbraw/zinc/57/49/36/1133574936.db2.gz MLFFGXFDULBYJD-AWEZNQCLSA-N 1 1 326.396 3.995 20 5 EHBDMO Cc1ccc(N2CCC(Oc3cc[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000774729163 1133911777 /nfs/dbraw/zinc/91/17/77/1133911777.db2.gz CDMOUUXZHWFFRR-UHFFFAOYSA-N 1 1 327.384 3.654 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC001184252508 1133915429 /nfs/dbraw/zinc/91/54/29/1133915429.db2.gz QEIBLZXQABJSQE-IRXDYDNUSA-N 1 1 332.444 3.850 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000786880483 1133922892 /nfs/dbraw/zinc/92/28/92/1133922892.db2.gz QSCMDQWVTXCZKY-KDOFPFPSSA-N 1 1 346.427 3.914 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671276 1133989770 /nfs/dbraw/zinc/98/97/70/1133989770.db2.gz CBGLDUXAIQHNRI-HNNXBMFYSA-N 1 1 325.840 3.554 20 5 EHBDMO CCC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774821818 1134032595 /nfs/dbraw/zinc/03/25/95/1134032595.db2.gz GPLYVOMOLNNOJA-UHFFFAOYSA-N 1 1 329.356 3.915 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774821818 1134032598 /nfs/dbraw/zinc/03/25/98/1134032598.db2.gz GPLYVOMOLNNOJA-UHFFFAOYSA-N 1 1 329.356 3.915 20 5 EHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774835269 1134037795 /nfs/dbraw/zinc/03/77/95/1134037795.db2.gz ZQIRKAZSBHSBEK-UHFFFAOYSA-N 1 1 329.356 3.568 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)C1CCCCC1 ZINC000788817967 1134176631 /nfs/dbraw/zinc/17/66/31/1134176631.db2.gz OAXOXXOFNIAXDN-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)C1CCCCC1 ZINC000788817967 1134176634 /nfs/dbraw/zinc/17/66/34/1134176634.db2.gz OAXOXXOFNIAXDN-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC001190582184 1134722737 /nfs/dbraw/zinc/72/27/37/1134722737.db2.gz ROVKIAYDYONYFZ-AWEZNQCLSA-N 1 1 346.431 3.582 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)CO)c1ccccc1 ZINC000805820426 1135335399 /nfs/dbraw/zinc/33/53/99/1135335399.db2.gz MWUOZQFAGVZJGL-GJZGRUSLSA-N 1 1 346.402 3.720 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001195084308 1135366740 /nfs/dbraw/zinc/36/67/40/1135366740.db2.gz OERAYSNPTUKYSQ-UHFFFAOYSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1cccc2c1CC(C)(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC001170502254 1135416847 /nfs/dbraw/zinc/41/68/47/1135416847.db2.gz YWSJCSDMZMZRKM-IBGZPJMESA-N 1 1 340.423 3.774 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)cc1 ZINC001197720236 1135730158 /nfs/dbraw/zinc/73/01/58/1135730158.db2.gz QUZLEYIOOQHJTB-XLIONFOSSA-N 1 1 338.407 3.637 20 5 EHBDMO CN(C)c1ccccc1C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000808785587 1135736988 /nfs/dbraw/zinc/73/69/88/1135736988.db2.gz LRJZRVIKTIUHOO-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000808785587 1135736989 /nfs/dbraw/zinc/73/69/89/1135736989.db2.gz LRJZRVIKTIUHOO-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001198707215 1135851572 /nfs/dbraw/zinc/85/15/72/1135851572.db2.gz SRNCGIFDTBMSOU-GOEBONIOSA-N 1 1 345.443 3.824 20 5 EHBDMO Cc1cncc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 ZINC000811485362 1136091856 /nfs/dbraw/zinc/09/18/56/1136091856.db2.gz GVTLTNUJNRTSFW-UHFFFAOYSA-N 1 1 326.183 3.895 20 5 EHBDMO C[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000811484365 1136091897 /nfs/dbraw/zinc/09/18/97/1136091897.db2.gz VJUBXPBZFORUOO-CABZTGNLSA-N 1 1 344.242 3.616 20 5 EHBDMO C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CN1C1CC1 ZINC000811484365 1136091902 /nfs/dbraw/zinc/09/19/02/1136091902.db2.gz VJUBXPBZFORUOO-CABZTGNLSA-N 1 1 344.242 3.616 20 5 EHBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2ccccc21 ZINC000776270561 1136123872 /nfs/dbraw/zinc/12/38/72/1136123872.db2.gz CTNWEHDRUXFYBE-MOPGFXCFSA-N 1 1 326.396 3.638 20 5 EHBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275026 1136129142 /nfs/dbraw/zinc/12/91/42/1136129142.db2.gz FOMIBXORJSPDOV-CVEARBPZSA-N 1 1 332.425 3.699 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279706 1136134849 /nfs/dbraw/zinc/13/48/49/1136134849.db2.gz XENNFJNEXIYUNE-ZWKOTPCHSA-N 1 1 330.359 3.604 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2COc2ccccc2)cc1[N+](=O)[O-] ZINC001170650429 1136154579 /nfs/dbraw/zinc/15/45/79/1136154579.db2.gz LYHYKUVYSKVQRK-KRWDZBQOSA-N 1 1 326.396 3.947 20 5 EHBDMO CCC(CC)[N@@H+](CC)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001170754433 1136484223 /nfs/dbraw/zinc/48/42/23/1136484223.db2.gz BPWCEHRNVNDVBI-UHFFFAOYSA-N 1 1 327.812 3.697 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814641796 1136488480 /nfs/dbraw/zinc/48/84/80/1136488480.db2.gz LEGZXNDZYLDQDG-PKOBYXMFSA-N 1 1 326.396 3.508 20 5 EHBDMO CC(C)[N@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000338959989 1136616115 /nfs/dbraw/zinc/61/61/15/1136616115.db2.gz IGAGXKTVMGTBOG-UHFFFAOYSA-N 1 1 345.365 3.530 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000112659428 1136644062 /nfs/dbraw/zinc/64/40/62/1136644062.db2.gz RMHVWJFCUJPNRJ-NSHDSACASA-N 1 1 327.812 3.553 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818216482 1136866504 /nfs/dbraw/zinc/86/65/04/1136866504.db2.gz IDHYASFTGJSMCY-LBPRGKRZSA-N 1 1 348.374 3.876 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@](C)(O)c1ccccc1 ZINC000822516263 1137064137 /nfs/dbraw/zinc/06/41/37/1137064137.db2.gz JNBNMGQVXPBUIW-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)C1 ZINC000339032784 1137127161 /nfs/dbraw/zinc/12/71/61/1137127161.db2.gz IOGRPSCRPZBSQM-OAHLLOKOSA-N 1 1 340.427 3.834 20 5 EHBDMO C[C@H](CO)C1CC[NH+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000844415124 1137218866 /nfs/dbraw/zinc/21/88/66/1137218866.db2.gz ATCWXYAQSPRGRF-SNVBAGLBSA-N 1 1 347.242 3.742 20 5 EHBDMO Cn1cc[nH+]c1[C@H]1CCN(c2c(Cl)c(Cl)ccc2[N+](=O)[O-])C1 ZINC000865642748 1137301063 /nfs/dbraw/zinc/30/10/63/1137301063.db2.gz ZQAJWIWYGSVTOY-VIFPVBQESA-N 1 1 341.198 3.629 20 5 EHBDMO Cc1ccnc(C2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000865676038 1137304009 /nfs/dbraw/zinc/30/40/09/1137304009.db2.gz ASDPEJQERYBGGU-UHFFFAOYSA-N 1 1 349.394 3.625 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(O)(c4ccccc4)CC3)c2c1 ZINC000865680036 1137304038 /nfs/dbraw/zinc/30/40/38/1137304038.db2.gz NLUUJNBYAOQMJA-UHFFFAOYSA-N 1 1 349.390 3.631 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000845984801 1137323206 /nfs/dbraw/zinc/32/32/06/1137323206.db2.gz RJCOMIOWYZCMIF-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nc2cc(F)ccc2n1C ZINC000772996873 1137446874 /nfs/dbraw/zinc/44/68/74/1137446874.db2.gz HZAHFJIQJGSOIC-LBPRGKRZSA-N 1 1 342.374 3.780 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccns1 ZINC000715995279 1137479177 /nfs/dbraw/zinc/47/91/77/1137479177.db2.gz RORAQIXKGNRIME-QMMMGPOBSA-N 1 1 342.218 3.665 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@H](C)OC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001171636199 1137504104 /nfs/dbraw/zinc/50/41/04/1137504104.db2.gz MALWIOVWWAAQJK-AWEZNQCLSA-N 1 1 334.416 3.527 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@H](C)OC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001171636199 1137504106 /nfs/dbraw/zinc/50/41/06/1137504106.db2.gz MALWIOVWWAAQJK-AWEZNQCLSA-N 1 1 334.416 3.527 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CCO)c1ccco1 ZINC000872062536 1137569062 /nfs/dbraw/zinc/56/90/62/1137569062.db2.gz IDMZOFCWWIKYSX-RISCZKNCSA-N 1 1 336.413 3.684 20 5 EHBDMO CCn1cc([C@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872078606 1137570126 /nfs/dbraw/zinc/57/01/26/1137570126.db2.gz RMAZQGBEFVLKSS-NWDGAFQWSA-N 1 1 334.445 3.945 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279229 1137577673 /nfs/dbraw/zinc/57/76/73/1137577673.db2.gz CXBDOVCVHGONNY-QGZVFWFLSA-N 1 1 348.443 3.917 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000873183513 1137592958 /nfs/dbraw/zinc/59/29/58/1137592958.db2.gz UFFAVESWPZDVDF-NHYWBVRUSA-N 1 1 333.413 3.754 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000877672556 1137685230 /nfs/dbraw/zinc/68/52/30/1137685230.db2.gz HGFVZQWDTFWLSU-CRAIPNDOSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC000877672556 1137685231 /nfs/dbraw/zinc/68/52/31/1137685231.db2.gz HGFVZQWDTFWLSU-CRAIPNDOSA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H]2C2CCCC2)o1 ZINC000877986060 1137698469 /nfs/dbraw/zinc/69/84/69/1137698469.db2.gz KILVPSYZPCFXLG-HNNXBMFYSA-N 1 1 342.399 3.799 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878128345 1137703581 /nfs/dbraw/zinc/70/35/81/1137703581.db2.gz CNZLIJAJKLBCMY-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066647 1137736851 /nfs/dbraw/zinc/73/68/51/1137736851.db2.gz QMBGXUOBVWUHQV-BAABZTOOSA-N 1 1 342.399 3.823 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012607 1137765426 /nfs/dbraw/zinc/76/54/26/1137765426.db2.gz VQNXSDMAYHSVMH-CQSZACIVSA-N 1 1 347.440 3.748 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@H+](CC)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000131470944 1137853766 /nfs/dbraw/zinc/85/37/66/1137853766.db2.gz AZLRNLSRTKSAHE-KRWDZBQOSA-N 1 1 339.399 3.770 20 5 EHBDMO CC[C@@H](c1ccncc1)[N@@H+](CC)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000131470944 1137853767 /nfs/dbraw/zinc/85/37/67/1137853767.db2.gz AZLRNLSRTKSAHE-KRWDZBQOSA-N 1 1 339.399 3.770 20 5 EHBDMO Cc1csc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)n1 ZINC000332259982 1137937527 /nfs/dbraw/zinc/93/75/27/1137937527.db2.gz DSVVMPPUJKPYIU-CYBMUJFWSA-N 1 1 335.404 3.878 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777162 1137960656 /nfs/dbraw/zinc/96/06/56/1137960656.db2.gz BVODMWWGHIFQFK-HKUYNNGSSA-N 1 1 344.386 3.822 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1cccc(Cl)c1)C1CC1 ZINC000135223625 1137964778 /nfs/dbraw/zinc/96/47/78/1137964778.db2.gz RKVNVYNQSYAVRC-GOSISDBHSA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1c(NC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000045960116 1138041417 /nfs/dbraw/zinc/04/14/17/1138041417.db2.gz FYJRAFOHKAXQOD-AWEZNQCLSA-N 1 1 348.447 3.537 20 5 EHBDMO C[N@H+](Cc1cccc2ccccc21)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136954631 1138044376 /nfs/dbraw/zinc/04/43/76/1138044376.db2.gz MGOMJPBEDNMVDL-FQEVSTJZSA-N 1 1 336.391 3.913 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1OC ZINC000886127937 1138050060 /nfs/dbraw/zinc/05/00/60/1138050060.db2.gz XSTLKCYULJRBJK-NSHDSACASA-N 1 1 334.347 3.602 20 5 EHBDMO COc1cc(C[NH2+][C@H]2CCc3c2cccc3F)c([N+](=O)[O-])cc1F ZINC000886923353 1138172769 /nfs/dbraw/zinc/17/27/69/1138172769.db2.gz XYNIEBLKGJWFTN-HNNXBMFYSA-N 1 1 334.322 3.659 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2(CCC2)C1 ZINC000123520293 1138271080 /nfs/dbraw/zinc/27/10/80/1138271080.db2.gz GLQGHIJUJPCACI-LBPRGKRZSA-N 1 1 328.372 3.582 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000131131051 1138497865 /nfs/dbraw/zinc/49/78/65/1138497865.db2.gz CCDBFGWVJDRDRE-KRWDZBQOSA-N 1 1 330.384 3.980 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CC2)C1 ZINC000186994851 1140231242 /nfs/dbraw/zinc/23/12/42/1140231242.db2.gz ILOUAYYCHRRKGB-GFCCVEGCSA-N 1 1 328.372 3.582 20 5 EHBDMO COCC1=CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000187614141 1140264476 /nfs/dbraw/zinc/26/44/76/1140264476.db2.gz KSVNVFSYCKCDBG-UHFFFAOYSA-N 1 1 328.368 3.633 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cn(C(C)(C)C)nc1C ZINC000268932986 1141028290 /nfs/dbraw/zinc/02/82/90/1141028290.db2.gz SXLITDRXOCVWKR-GFCCVEGCSA-N 1 1 346.431 3.714 20 5 EHBDMO C[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCC[C@@H]1O ZINC000270170613 1141187929 /nfs/dbraw/zinc/18/79/29/1141187929.db2.gz UGPBAVRPUOMXHN-YJBOKZPZSA-N 1 1 337.419 3.539 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)Cc1cc(C)[nH]n1 ZINC000271482967 1141378425 /nfs/dbraw/zinc/37/84/25/1141378425.db2.gz JFHSMLHENLXTFT-JSGCOSHPSA-N 1 1 348.472 3.718 20 5 EHBDMO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271624257 1141408052 /nfs/dbraw/zinc/40/80/52/1141408052.db2.gz NHWYGWRNWVUHHK-GJZGRUSLSA-N 1 1 341.411 3.889 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2cc(C)ccc2OC)c([N+](=O)[O-])cc1F ZINC000274268955 1141491200 /nfs/dbraw/zinc/49/12/00/1141491200.db2.gz AJXMJMKRVATNCB-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643637 719204457 /nfs/dbraw/zinc/20/44/57/719204457.db2.gz ZVADVIGMJFPKTK-QWHCGFSZSA-N 1 1 340.858 3.965 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000047964596 1014215162 /nfs/dbraw/zinc/21/51/62/1014215162.db2.gz CWHWFHPIUDNMBC-CQSZACIVSA-N 1 1 342.395 3.963 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000047964596 1014215172 /nfs/dbraw/zinc/21/51/72/1014215172.db2.gz CWHWFHPIUDNMBC-CQSZACIVSA-N 1 1 342.395 3.963 20 5 EHBDMO CC[N@@H+](C)C[C@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302048240 1015036149 /nfs/dbraw/zinc/03/61/49/1015036149.db2.gz WBNDXYWYDRTLAO-SNVBAGLBSA-N 1 1 332.231 3.680 20 5 EHBDMO C[C@]1(CNCc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000311216155 1016392024 /nfs/dbraw/zinc/39/20/24/1016392024.db2.gz RVNBSEBBQMFLNT-HXUWFJFHSA-N 1 1 339.439 3.597 20 5 EHBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)c(CN(C)C)c1 ZINC000449155730 1032257375 /nfs/dbraw/zinc/25/73/75/1032257375.db2.gz QJALSZDIOJRGOX-AWEZNQCLSA-N 1 1 345.418 3.516 20 5 EHBDMO COC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000538281151 1032268079 /nfs/dbraw/zinc/26/80/79/1032268079.db2.gz YHZGRJILQCQTPQ-OAHLLOKOSA-N 1 1 338.766 3.865 20 5 EHBDMO CC[N@@H+](CCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1)CC(C)C ZINC000536896054 1032407008 /nfs/dbraw/zinc/40/70/08/1032407008.db2.gz IEYFSIYDGCMCBU-UHFFFAOYSA-N 1 1 348.491 3.883 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC[N@H+](C)C1CCCCC1 ZINC000597666718 1032600564 /nfs/dbraw/zinc/60/05/64/1032600564.db2.gz LLJJFEAIEHLTQH-UHFFFAOYSA-N 1 1 333.432 3.805 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680406 1032651621 /nfs/dbraw/zinc/65/16/21/1032651621.db2.gz UYUQMSWONFHLRB-UONOGXRCSA-N 1 1 349.431 3.502 20 5 EHBDMO [NH3+]CCC[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000415050588 1017460171 /nfs/dbraw/zinc/46/01/71/1017460171.db2.gz ISGMFVANTPTVAR-KRWDZBQOSA-N 1 1 333.819 3.818 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccccc2)no1 ZINC000549170409 1017486924 /nfs/dbraw/zinc/48/69/24/1017486924.db2.gz CFKJODGLSSNZFP-UHFFFAOYSA-N 1 1 337.379 3.924 20 5 EHBDMO Cc1cnn([C@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)c1 ZINC000365625075 1018087867 /nfs/dbraw/zinc/08/78/67/1018087867.db2.gz UMNYUCVKRUSUPP-INIZCTEOSA-N 1 1 328.416 3.670 20 5 EHBDMO CC(C)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090578 /nfs/dbraw/zinc/09/05/78/1018090578.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 1 1 331.460 3.775 20 5 EHBDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144572 /nfs/dbraw/zinc/14/45/72/1018144572.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144587 /nfs/dbraw/zinc/14/45/87/1018144587.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144594 /nfs/dbraw/zinc/14/45/94/1018144594.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 1 1 343.427 3.627 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371728 1018548904 /nfs/dbraw/zinc/54/89/04/1018548904.db2.gz KNYDTKVMPGRTCO-WBVHZDCISA-N 1 1 338.473 3.970 20 5 EHBDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581964 /nfs/dbraw/zinc/58/19/64/1018581964.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581971 /nfs/dbraw/zinc/58/19/71/1018581971.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 1 1 343.427 3.627 20 5 EHBDMO COc1ccccc1C[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CC1 ZINC000052183701 1018858494 /nfs/dbraw/zinc/85/84/94/1018858494.db2.gz NNGXKOIEKJOGDI-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccccc1C[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CC1 ZINC000052183701 1018858513 /nfs/dbraw/zinc/85/85/13/1018858513.db2.gz NNGXKOIEKJOGDI-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000542702556 1019064146 /nfs/dbraw/zinc/06/41/46/1019064146.db2.gz YQYKPJVCULCLOK-FQEVSTJZSA-N 1 1 340.423 3.737 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000322473398 1019119381 /nfs/dbraw/zinc/11/93/81/1019119381.db2.gz PFBGZDFNODWRKA-VMGRFDJRSA-N 1 1 338.835 3.764 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1nccn1C)C1CC1 ZINC000602440689 1032888869 /nfs/dbraw/zinc/88/88/69/1032888869.db2.gz RQZBDWORYOOVGT-QGZVFWFLSA-N 1 1 328.416 3.690 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1nccn1C)C1CC1 ZINC000602440689 1032888880 /nfs/dbraw/zinc/88/88/80/1032888880.db2.gz RQZBDWORYOOVGT-QGZVFWFLSA-N 1 1 328.416 3.690 20 5 EHBDMO COc1cc2c(cc1OC)[C@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC000602438215 1032890918 /nfs/dbraw/zinc/89/09/18/1032890918.db2.gz CDWBHRQKKYCWQB-QGZVFWFLSA-N 1 1 342.395 3.731 20 5 EHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000610476442 1020397621 /nfs/dbraw/zinc/39/76/21/1020397621.db2.gz JCFNLZBHRGCOHT-PBHICJAKSA-N 1 1 328.416 3.610 20 5 EHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000610476442 1020397630 /nfs/dbraw/zinc/39/76/30/1020397630.db2.gz JCFNLZBHRGCOHT-PBHICJAKSA-N 1 1 328.416 3.610 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000280577322 1020481391 /nfs/dbraw/zinc/48/13/91/1020481391.db2.gz SMIFVZKJEVKUKJ-AWEZNQCLSA-N 1 1 344.415 3.903 20 5 EHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000393853552 1021078846 /nfs/dbraw/zinc/07/88/46/1021078846.db2.gz XBVIWQYUTFVSBC-RDJZCZTQSA-N 1 1 325.412 3.917 20 5 EHBDMO CC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000341221283 1021122498 /nfs/dbraw/zinc/12/24/98/1021122498.db2.gz UNWKFCHGRHMBAM-MRXNPFEDSA-N 1 1 338.367 3.886 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516020 1021171427 /nfs/dbraw/zinc/17/14/27/1021171427.db2.gz VJHPYSSOWHHLOI-UKRRQHHQSA-N 1 1 331.441 3.979 20 5 EHBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270141781 1021365586 /nfs/dbraw/zinc/36/55/86/1021365586.db2.gz WNOHWCBIYXUIHW-OYRHEFFESA-N 1 1 330.431 3.912 20 5 EHBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270141781 1021365600 /nfs/dbraw/zinc/36/56/00/1021365600.db2.gz WNOHWCBIYXUIHW-OYRHEFFESA-N 1 1 330.431 3.912 20 5 EHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613103 1033028676 /nfs/dbraw/zinc/02/86/76/1033028676.db2.gz OVUPSKDMDRLDTL-MLGOLLRUSA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613103 1033028688 /nfs/dbraw/zinc/02/86/88/1033028688.db2.gz OVUPSKDMDRLDTL-MLGOLLRUSA-N 1 1 338.367 3.714 20 5 EHBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)CCO2 ZINC000187545276 1022331734 /nfs/dbraw/zinc/33/17/34/1022331734.db2.gz PXKLPQDUYKCQHK-AWEZNQCLSA-N 1 1 334.397 3.668 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)[C@H](C)O1 ZINC000438371681 1022616585 /nfs/dbraw/zinc/61/65/85/1022616585.db2.gz GSBWAKXEFRFKSM-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)[C@H](C)O1 ZINC000438371681 1022616590 /nfs/dbraw/zinc/61/65/90/1022616590.db2.gz GSBWAKXEFRFKSM-MCIONIFRSA-N 1 1 330.384 3.853 20 5 EHBDMO Cc1ncc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684816 1033085977 /nfs/dbraw/zinc/08/59/77/1033085977.db2.gz IQIBPTJSJWHWRW-WMLDXEAASA-N 1 1 340.427 3.942 20 5 EHBDMO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[nH]1 ZINC000894771499 1022869180 /nfs/dbraw/zinc/86/91/80/1022869180.db2.gz KTMZIXVLRLTDEU-SNVBAGLBSA-N 1 1 343.412 3.601 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000506328571 1022937423 /nfs/dbraw/zinc/93/74/23/1022937423.db2.gz VKJWAQPABMHFGQ-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000506328571 1022937434 /nfs/dbraw/zinc/93/74/34/1022937434.db2.gz VKJWAQPABMHFGQ-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@@H]4CCCC[C@H]43)nc2c1 ZINC000610619596 1023010921 /nfs/dbraw/zinc/01/09/21/1023010921.db2.gz JAAPWJNVWHQAPU-UKRRQHHQSA-N 1 1 333.413 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@@H]4CCCC[C@H]43)nc2c1 ZINC000610619596 1023010933 /nfs/dbraw/zinc/01/09/33/1023010933.db2.gz JAAPWJNVWHQAPU-UKRRQHHQSA-N 1 1 333.413 3.596 20 5 EHBDMO O=C(C[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002492 1023098693 /nfs/dbraw/zinc/09/86/93/1023098693.db2.gz ZFKSRTKKPUJPJE-INIZCTEOSA-N 1 1 344.436 3.936 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(-n3cccn3)c2)C2CC2)cc1 ZINC000507155636 1023162402 /nfs/dbraw/zinc/16/24/02/1023162402.db2.gz PQLRBNVNDNLDJX-UHFFFAOYSA-N 1 1 348.406 3.945 20 5 EHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507315832 1023240479 /nfs/dbraw/zinc/24/04/79/1023240479.db2.gz KRCYFDRZHFAFSE-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507315832 1023240485 /nfs/dbraw/zinc/24/04/85/1023240485.db2.gz KRCYFDRZHFAFSE-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO CCOc1cc(C[NH2+]C(C)(C)c2ncc(C)s2)ccc1[N+](=O)[O-] ZINC000276989168 1023670061 /nfs/dbraw/zinc/67/00/61/1023670061.db2.gz ZQWSKQJJNCPPDA-UHFFFAOYSA-N 1 1 335.429 3.783 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342051337 1023804372 /nfs/dbraw/zinc/80/43/72/1023804372.db2.gz SIZFQDAPMZQEKY-AEFFLSMTSA-N 1 1 334.416 3.525 20 5 EHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000441640571 1024276821 /nfs/dbraw/zinc/27/68/21/1024276821.db2.gz ASHNKZOPIAWWTJ-MRXNPFEDSA-N 1 1 333.432 3.742 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434980406 1024535566 /nfs/dbraw/zinc/53/55/66/1024535566.db2.gz DPMBWIHZICMKBJ-IBGZPJMESA-N 1 1 348.406 3.942 20 5 EHBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CCCCO1 ZINC000435057619 1024586930 /nfs/dbraw/zinc/58/69/30/1024586930.db2.gz QEWHBKSHKKXRQG-CQSZACIVSA-N 1 1 333.388 3.517 20 5 EHBDMO C[C@@H]([NH3+])[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372447 1024857560 /nfs/dbraw/zinc/85/75/60/1024857560.db2.gz RHEHSJHGXYMHCN-NEPJUHHUSA-N 1 1 349.818 3.677 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025423691 1024927552 /nfs/dbraw/zinc/92/75/52/1024927552.db2.gz LERXKDZRKKMYGP-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025423691 1024927559 /nfs/dbraw/zinc/92/75/59/1024927559.db2.gz LERXKDZRKKMYGP-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025423696 1024927733 /nfs/dbraw/zinc/92/77/33/1024927733.db2.gz LERXKDZRKKMYGP-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025423696 1024927745 /nfs/dbraw/zinc/92/77/45/1024927745.db2.gz LERXKDZRKKMYGP-SWLSCSKDSA-N 1 1 345.424 3.820 20 5 EHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174813 1025249496 /nfs/dbraw/zinc/24/94/96/1025249496.db2.gz MXGLGVITLYKVHV-INIZCTEOSA-N 1 1 333.476 3.893 20 5 EHBDMO CC[C@H]1CCCN(C(C)(C)C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174813 1025249502 /nfs/dbraw/zinc/24/95/02/1025249502.db2.gz MXGLGVITLYKVHV-INIZCTEOSA-N 1 1 333.476 3.893 20 5 EHBDMO O=C(CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccc(F)cc1 ZINC000539727831 1025316561 /nfs/dbraw/zinc/31/65/61/1025316561.db2.gz VOOAWMBORSKNFV-UHFFFAOYSA-N 1 1 342.370 3.971 20 5 EHBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccc(F)cc1 ZINC000539727831 1025316573 /nfs/dbraw/zinc/31/65/73/1025316573.db2.gz VOOAWMBORSKNFV-UHFFFAOYSA-N 1 1 342.370 3.971 20 5 EHBDMO COc1ccc(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] ZINC000551439432 1025319025 /nfs/dbraw/zinc/31/90/25/1025319025.db2.gz KAPPNGUUCFBEDN-UHFFFAOYSA-N 1 1 348.349 3.556 20 5 EHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1[N+](=O)[O-] ZINC000255493723 1025452601 /nfs/dbraw/zinc/45/26/01/1025452601.db2.gz DTAUBMIXCSVLFU-TWGQIWQCSA-N 1 1 327.340 3.648 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1[N+](=O)[O-] ZINC000255493723 1025452605 /nfs/dbraw/zinc/45/26/05/1025452605.db2.gz DTAUBMIXCSVLFU-TWGQIWQCSA-N 1 1 327.340 3.648 20 5 EHBDMO Cc1ccccc1CC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000451166170 1025625074 /nfs/dbraw/zinc/62/50/74/1025625074.db2.gz FSXFDZBXJWCOEL-UHFFFAOYSA-N 1 1 325.368 3.719 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000443067264 1025683991 /nfs/dbraw/zinc/68/39/91/1025683991.db2.gz FHGZWFYMPSLDEI-ZIAGYGMSSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000443217779 1025820930 /nfs/dbraw/zinc/82/09/30/1025820930.db2.gz DOOIJPBCNHJQAK-XQQFMLRXSA-N 1 1 330.388 3.502 20 5 EHBDMO C[C@@H](C[NH3+])CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414887144 1025866460 /nfs/dbraw/zinc/86/64/60/1025866460.db2.gz YVBCKKDXPDCHMK-LBPRGKRZSA-N 1 1 349.818 3.725 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2cc(OC)ccc2[N+](=O)[O-])CC1 ZINC000530669264 1026185562 /nfs/dbraw/zinc/18/55/62/1026185562.db2.gz FRXZFBNJOJMOLG-UHFFFAOYSA-N 1 1 335.448 3.552 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000530901690 1026387518 /nfs/dbraw/zinc/38/75/18/1026387518.db2.gz QALZDDPMZPDKGL-WBVHZDCISA-N 1 1 349.475 3.687 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](COC)Cc1ccccc1 ZINC000531104374 1026573702 /nfs/dbraw/zinc/57/37/02/1026573702.db2.gz VMTAVDHFEGGELK-LJQANCHMSA-N 1 1 328.412 3.674 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000531202477 1026684425 /nfs/dbraw/zinc/68/44/25/1026684425.db2.gz ZPWOFXDEQVNEJP-RHSMWYFYSA-N 1 1 326.396 3.981 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2cccs2)CC1 ZINC000075620904 1027181937 /nfs/dbraw/zinc/18/19/37/1027181937.db2.gz NXTWKAUSDNSUTF-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2cccc(Nc3ccccc3[N+](=O)[O-])c2)C[C@H](C)O1 ZINC000523113350 1027764543 /nfs/dbraw/zinc/76/45/43/1027764543.db2.gz MGZUXELTCHZHPQ-GASCZTMLSA-N 1 1 341.411 3.948 20 5 EHBDMO Cc1nc(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781588 1027787089 /nfs/dbraw/zinc/78/70/89/1027787089.db2.gz BQOJWUNUAQKKFM-WMLDXEAASA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186687757 1027862185 /nfs/dbraw/zinc/86/21/85/1027862185.db2.gz BLFMMJZSSHBTGN-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186687757 1027862213 /nfs/dbraw/zinc/86/22/13/1027862213.db2.gz BLFMMJZSSHBTGN-GOSISDBHSA-N 1 1 344.798 3.880 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420954830 1027922791 /nfs/dbraw/zinc/92/27/91/1027922791.db2.gz VMTXDZHAAKRYIR-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420954830 1027922800 /nfs/dbraw/zinc/92/28/00/1027922800.db2.gz VMTXDZHAAKRYIR-LLVKDONJSA-N 1 1 332.322 3.768 20 5 EHBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1Cl ZINC000503620857 1027966827 /nfs/dbraw/zinc/96/68/27/1027966827.db2.gz ZCKJEPACOPREMD-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1Cl ZINC000503620857 1027966839 /nfs/dbraw/zinc/96/68/39/1027966839.db2.gz ZCKJEPACOPREMD-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCC[C@@H]1C ZINC000444667683 1028140198 /nfs/dbraw/zinc/14/01/98/1028140198.db2.gz YYNKLRLIPJNARU-YOEHRIQHSA-N 1 1 333.432 3.742 20 5 EHBDMO [NH3+][C@@H]1C[C@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036614 1028143602 /nfs/dbraw/zinc/14/36/02/1028143602.db2.gz ATJNWJJHZIOVDD-CVEARBPZSA-N 1 1 331.803 3.525 20 5 EHBDMO CCc1ccc([C@H](N[C@@H]2CC[C@@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513805 1028490883 /nfs/dbraw/zinc/49/08/83/1028490883.db2.gz RNQSIBIAACHOPK-ZXYWRSMDSA-N 1 1 343.427 3.557 20 5 EHBDMO C[N@@H+](CCCCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CC1 ZINC000583029555 1028593355 /nfs/dbraw/zinc/59/33/55/1028593355.db2.gz UVGVCLYAVUVATF-HNNXBMFYSA-N 1 1 345.365 3.662 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000533262050 1029542158 /nfs/dbraw/zinc/54/21/58/1029542158.db2.gz WTPZFAQEKCRRIG-HUUCEWRRSA-N 1 1 341.411 3.657 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1cccc(OCC)c1[N+](=O)[O-] ZINC000192235297 1029629875 /nfs/dbraw/zinc/62/98/75/1029629875.db2.gz JHSNXVAXKYYZHI-UHFFFAOYSA-N 1 1 346.431 3.669 20 5 EHBDMO Cc1cc(Cl)ccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446851551 1029819392 /nfs/dbraw/zinc/81/93/92/1029819392.db2.gz DFRVMAYVJKELLN-UHFFFAOYSA-N 1 1 330.775 3.723 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000441172298 1029866534 /nfs/dbraw/zinc/86/65/34/1029866534.db2.gz AEXLDJZZTUAUDF-WFTPILKQSA-N 1 1 340.427 3.786 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000441172298 1029866540 /nfs/dbraw/zinc/86/65/40/1029866540.db2.gz AEXLDJZZTUAUDF-WFTPILKQSA-N 1 1 340.427 3.786 20 5 EHBDMO COc1nc2ccccc2cc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000537627353 1029959762 /nfs/dbraw/zinc/95/97/62/1029959762.db2.gz PXIPGXNWFIMAAO-UHFFFAOYSA-N 1 1 349.390 3.710 20 5 EHBDMO COc1nc2ccccc2cc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000537627353 1029959780 /nfs/dbraw/zinc/95/97/80/1029959780.db2.gz PXIPGXNWFIMAAO-UHFFFAOYSA-N 1 1 349.390 3.710 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCC[N@@H+]3Cc3ccccc3)n2)o1 ZINC000453264617 1029996351 /nfs/dbraw/zinc/99/63/51/1029996351.db2.gz WJQYDEDWZZXLFN-CYBMUJFWSA-N 1 1 340.339 3.575 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCC[N@H+]3Cc3ccccc3)n2)o1 ZINC000453264617 1029996367 /nfs/dbraw/zinc/99/63/67/1029996367.db2.gz WJQYDEDWZZXLFN-CYBMUJFWSA-N 1 1 340.339 3.575 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000159411055 1030179599 /nfs/dbraw/zinc/17/95/99/1030179599.db2.gz NDNRVXJOIFWZPT-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]C1CC(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000550861375 1030749723 /nfs/dbraw/zinc/74/97/23/1030749723.db2.gz YLZFVCXJXVZIRJ-DQPZFDDXSA-N 1 1 342.443 3.832 20 5 EHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623408 1030793324 /nfs/dbraw/zinc/79/33/24/1030793324.db2.gz AFUFJFGCNGIEKP-NHYWBVRUSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247154673 1030917355 /nfs/dbraw/zinc/91/73/55/1030917355.db2.gz LVNYKBKOEYOYGB-DYVFJYSZSA-N 1 1 328.416 3.843 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000483110858 1030974454 /nfs/dbraw/zinc/97/44/54/1030974454.db2.gz MJJITIVEZMLVCQ-AWEZNQCLSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728742 1031658962 /nfs/dbraw/zinc/65/89/62/1031658962.db2.gz CPDQPXJSTPIIGJ-JHJVBQTASA-N 1 1 330.388 3.511 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475728527 1031662688 /nfs/dbraw/zinc/66/26/88/1031662688.db2.gz UAMPBEVZILFAKW-HNNXBMFYSA-N 1 1 348.830 3.938 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475728527 1031662698 /nfs/dbraw/zinc/66/26/98/1031662698.db2.gz UAMPBEVZILFAKW-HNNXBMFYSA-N 1 1 348.830 3.938 20 5 EHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccn(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000537966738 1032052248 /nfs/dbraw/zinc/05/22/48/1032052248.db2.gz BZXFPDSPUBTTTK-OAHLLOKOSA-N 1 1 336.395 3.940 20 5 EHBDMO CCn1cc(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)cn1 ZINC000163520418 1033401947 /nfs/dbraw/zinc/40/19/47/1033401947.db2.gz YQMLQEORMASRQE-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])n1cc(C[N@@H+](C)C2CCCCC2)nn1 ZINC000603220881 1033438377 /nfs/dbraw/zinc/43/83/77/1033438377.db2.gz WNFWWTWQOAGCLH-AWEZNQCLSA-N 1 1 343.431 3.560 20 5 EHBDMO CCC(=O)c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594597637 1033444041 /nfs/dbraw/zinc/44/40/41/1033444041.db2.gz DGOHZZQYLWFVPN-GDBMZVCRSA-N 1 1 331.416 3.616 20 5 EHBDMO CCCC[N@@H+](CC)Cc1cccc(CNc2ncc([N+](=O)[O-])s2)c1 ZINC000409724616 1033446918 /nfs/dbraw/zinc/44/69/18/1033446918.db2.gz CTWIUCPWFNQVHB-UHFFFAOYSA-N 1 1 348.472 3.707 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761290383 1033488092 /nfs/dbraw/zinc/48/80/92/1033488092.db2.gz OTJAYRXUUVAXDJ-INIZCTEOSA-N 1 1 336.395 3.700 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000595019582 1033612763 /nfs/dbraw/zinc/61/27/63/1033612763.db2.gz RSSQLDVRUKJGCA-OLZOCXBDSA-N 1 1 332.404 3.793 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973346 1033618699 /nfs/dbraw/zinc/61/86/99/1033618699.db2.gz WHVICIUZGFIXBE-ZDUSSCGKSA-N 1 1 345.365 3.576 20 5 EHBDMO CCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595009545 1033633067 /nfs/dbraw/zinc/63/30/67/1033633067.db2.gz CKQLJNKTUCTLJA-GFCCVEGCSA-N 1 1 348.374 3.992 20 5 EHBDMO CC[C@@H]([NH2+]Cc1c(OC)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000595073158 1033649493 /nfs/dbraw/zinc/64/94/93/1033649493.db2.gz MSJLVXZGVVQDAM-MRXNPFEDSA-N 1 1 330.384 3.853 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1F ZINC000598996876 1033649954 /nfs/dbraw/zinc/64/99/54/1033649954.db2.gz QQSDUWAYFNLKNV-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599035742 1033663710 /nfs/dbraw/zinc/66/37/10/1033663710.db2.gz NDHSKZNZGQIULZ-CQSZACIVSA-N 1 1 328.416 3.675 20 5 EHBDMO CCC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000595330860 1033728130 /nfs/dbraw/zinc/72/81/30/1033728130.db2.gz MZJZNLQYGHSMGD-DJIMGWMZSA-N 1 1 336.407 3.759 20 5 EHBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489382 1033812324 /nfs/dbraw/zinc/81/23/24/1033812324.db2.gz ABBHJUKMPPXTFV-BZUAXINKSA-N 1 1 327.384 3.659 20 5 EHBDMO Cc1noc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1[N+](=O)[O-] ZINC000595477907 1033824417 /nfs/dbraw/zinc/82/44/17/1033824417.db2.gz WFJHCHFEPHOGFE-MUJYYYPQSA-N 1 1 327.384 3.802 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC([C@@H]4CCCCO4)CC3)nc2c1 ZINC000595787475 1033999854 /nfs/dbraw/zinc/99/98/54/1033999854.db2.gz JDTBABATGBUFCS-INIZCTEOSA-N 1 1 345.399 3.517 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595791010 1034002910 /nfs/dbraw/zinc/00/29/10/1034002910.db2.gz SJIJELZLWRGSCJ-YJBOKZPZSA-N 1 1 348.443 3.775 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000603905620 1034023981 /nfs/dbraw/zinc/02/39/81/1034023981.db2.gz JRYAVEBKPNFMDJ-RYQLBKOJSA-N 1 1 337.423 3.724 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595868058 1034030824 /nfs/dbraw/zinc/03/08/24/1034030824.db2.gz RGXYGGLFIPCEMS-GXTWGEPZSA-N 1 1 330.388 3.798 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059045 1034063997 /nfs/dbraw/zinc/06/39/97/1034063997.db2.gz MCWNNXXUFRHRLP-OUQXZNHLSA-N 1 1 343.471 3.710 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059045 1034064011 /nfs/dbraw/zinc/06/40/11/1034064011.db2.gz MCWNNXXUFRHRLP-OUQXZNHLSA-N 1 1 343.471 3.710 20 5 EHBDMO O=[N+]([O-])c1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1C(F)(F)F ZINC000596082051 1034074794 /nfs/dbraw/zinc/07/47/94/1034074794.db2.gz FIWGYAYUNMGDTK-VXGBXAGGSA-N 1 1 329.322 3.652 20 5 EHBDMO CC[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095278 1034079980 /nfs/dbraw/zinc/07/99/80/1034079980.db2.gz OOSGJCXCQWEPIK-APWZRJJASA-N 1 1 331.460 3.758 20 5 EHBDMO CC[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095278 1034079996 /nfs/dbraw/zinc/07/99/96/1034079996.db2.gz OOSGJCXCQWEPIK-APWZRJJASA-N 1 1 331.460 3.758 20 5 EHBDMO CC[N@@H+](CCCNC(=O)c1c(C)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000593251240 1034478731 /nfs/dbraw/zinc/47/87/31/1034478731.db2.gz RGCHFZJHCQMYPA-UHFFFAOYSA-N 1 1 347.459 3.678 20 5 EHBDMO CC1(C)C[C@H](NCc2ccc(C[NH3+])cc2F)c2cc([N+](=O)[O-])ccc21 ZINC000593320260 1034659675 /nfs/dbraw/zinc/65/96/75/1034659675.db2.gz BTARHFIOIGAARP-SFHVURJKSA-N 1 1 343.402 3.705 20 5 EHBDMO C[N@H+]1CCC[C@H]1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000534608010 1034723125 /nfs/dbraw/zinc/72/31/25/1034723125.db2.gz MCTAGQANPXKBBT-NSHDSACASA-N 1 1 345.262 3.934 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000615835123 1035027914 /nfs/dbraw/zinc/02/79/14/1035027914.db2.gz PURRORKVIFRPAP-RXEWJAMOSA-N 1 1 340.427 3.741 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612584139 1035076752 /nfs/dbraw/zinc/07/67/52/1035076752.db2.gz RSZVAGLVYHLWKK-GOSISDBHSA-N 1 1 330.359 3.696 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000443957677 1035948877 /nfs/dbraw/zinc/94/88/77/1035948877.db2.gz BQHFFAHJHXJFOW-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO CCOc1cc(C[N@@H+](CCc2nccs2)C(C)C)ccc1[N+](=O)[O-] ZINC000492584127 1036031721 /nfs/dbraw/zinc/03/17/21/1036031721.db2.gz UDVUWSIZOYYEIQ-UHFFFAOYSA-N 1 1 349.456 3.903 20 5 EHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687386 1036242430 /nfs/dbraw/zinc/24/24/30/1036242430.db2.gz JCIPZARFMLWMOV-HNAYVOBHSA-N 1 1 328.412 3.938 20 5 EHBDMO Cc1c(C[NH2+][C@@H](c2cnn(C)c2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000376355127 1036257970 /nfs/dbraw/zinc/25/79/70/1036257970.db2.gz SURNHUCQXJCSNS-LJQANCHMSA-N 1 1 336.395 3.516 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589209659 1036311735 /nfs/dbraw/zinc/31/17/35/1036311735.db2.gz QFBIVFKFHBHRAE-INIZCTEOSA-N 1 1 340.427 3.617 20 5 EHBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccn1 ZINC000056495182 1036328949 /nfs/dbraw/zinc/32/89/49/1036328949.db2.gz WRAQLAIXUBQLRJ-UHFFFAOYSA-N 1 1 329.400 3.669 20 5 EHBDMO CC[C@@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777048 1036770314 /nfs/dbraw/zinc/77/03/14/1036770314.db2.gz OMTNRTNBKAGCSV-KDOFPFPSSA-N 1 1 333.432 3.742 20 5 EHBDMO CCOc1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831174 1036913353 /nfs/dbraw/zinc/91/33/53/1036913353.db2.gz YXIIDBRCVPPYJT-INIZCTEOSA-N 1 1 341.411 3.680 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4c(s3)CCC4)C2)cc1 ZINC000590659583 1036996341 /nfs/dbraw/zinc/99/63/41/1036996341.db2.gz JUMNDNOVBOZRCR-CQSZACIVSA-N 1 1 343.452 3.920 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3noc4c3CCCC4)C2)cc1 ZINC000590757333 1037027339 /nfs/dbraw/zinc/02/73/39/1037027339.db2.gz SOUKDKVUWYAJFS-OAHLLOKOSA-N 1 1 341.411 3.841 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C2CC2)ccc1O ZINC000191511418 1037167995 /nfs/dbraw/zinc/16/79/95/1037167995.db2.gz RWRYKJZYYULQRA-UHFFFAOYSA-N 1 1 342.395 3.782 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000493282111 1037218105 /nfs/dbraw/zinc/21/81/05/1037218105.db2.gz SDXYCQBBINWWBQ-QWHCGFSZSA-N 1 1 325.840 3.553 20 5 EHBDMO CC(C)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000170908568 1037263988 /nfs/dbraw/zinc/26/39/88/1037263988.db2.gz HFSIMOHOFIENMC-UHFFFAOYSA-N 1 1 329.400 3.913 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000462694305 1037290010 /nfs/dbraw/zinc/29/00/10/1037290010.db2.gz AVQMATLJEZOLHH-LBPRGKRZSA-N 1 1 335.404 3.679 20 5 EHBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000539891521 1037313304 /nfs/dbraw/zinc/31/33/04/1037313304.db2.gz ORDHHUFNZVLPDS-SJORKVTESA-N 1 1 331.460 3.777 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000046037860 1037729408 /nfs/dbraw/zinc/72/94/08/1037729408.db2.gz PLKDVUQYJARRFF-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO CC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CCC1 ZINC000592132186 1037844078 /nfs/dbraw/zinc/84/40/78/1037844078.db2.gz AGBFGEJIZHZZDE-QAQDUYKDSA-N 1 1 332.444 3.891 20 5 EHBDMO CCC[C@H](O)C[NH2+][C@@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000542474375 1037847810 /nfs/dbraw/zinc/84/78/10/1037847810.db2.gz FFLYAIBJMHXYQH-MAUKXSAKSA-N 1 1 332.400 3.590 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000251926359 1037882915 /nfs/dbraw/zinc/88/29/15/1037882915.db2.gz STHCQQPZNJQXQX-WMLDXEAASA-N 1 1 347.459 3.521 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@H]3C3CCC3)n2)cc1 ZINC000592198939 1037943735 /nfs/dbraw/zinc/94/37/35/1037943735.db2.gz MTWLXNQUWKXYPE-INIZCTEOSA-N 1 1 342.399 3.799 20 5 EHBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072578045 1038160073 /nfs/dbraw/zinc/16/00/73/1038160073.db2.gz ALQNHHWHRQAAGQ-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072578045 1038160078 /nfs/dbraw/zinc/16/00/78/1038160078.db2.gz ALQNHHWHRQAAGQ-OAHLLOKOSA-N 1 1 341.411 3.843 20 5 EHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCO1 ZINC000511540508 1038362280 /nfs/dbraw/zinc/36/22/80/1038362280.db2.gz HZQZSCOMOVGRDH-CQSZACIVSA-N 1 1 330.384 3.856 20 5 EHBDMO Cc1cc(N2CC[N@H+]3CCCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461781478 1038608143 /nfs/dbraw/zinc/60/81/43/1038608143.db2.gz XMWHSSFSZXAHMN-LBPRGKRZSA-N 1 1 343.349 3.597 20 5 EHBDMO Cc1cc(N2CC[N@H+]3CCCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461781477 1038608442 /nfs/dbraw/zinc/60/84/42/1038608442.db2.gz XMWHSSFSZXAHMN-GFCCVEGCSA-N 1 1 343.349 3.597 20 5 EHBDMO CCc1oc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1C(=O)OC ZINC000569942513 1038775453 /nfs/dbraw/zinc/77/54/53/1038775453.db2.gz PALSIJBWFCEVSS-UHFFFAOYSA-N 1 1 346.383 3.562 20 5 EHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036464 1039138686 /nfs/dbraw/zinc/13/86/86/1039138686.db2.gz KXFXPUSGZAADQS-CRAIPNDOSA-N 1 1 328.416 3.573 20 5 EHBDMO Cc1nn(C[NH+]2CCC(CCc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000028736391 1039592932 /nfs/dbraw/zinc/59/29/32/1039592932.db2.gz NDBGOCGDKJXSNB-UHFFFAOYSA-N 1 1 342.443 3.710 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000480527915 1039666390 /nfs/dbraw/zinc/66/63/90/1039666390.db2.gz PKSSLRCHZYSYQU-SFHVURJKSA-N 1 1 340.427 3.621 20 5 EHBDMO Cc1cc(NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555158259 1040242380 /nfs/dbraw/zinc/24/23/80/1040242380.db2.gz DTGFLKDAPHBJAI-UHFFFAOYSA-N 1 1 329.322 3.596 20 5 EHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1OC ZINC000479559535 1040382171 /nfs/dbraw/zinc/38/21/71/1040382171.db2.gz UXHNLKCJQUOSBN-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1OC ZINC000479559535 1040382198 /nfs/dbraw/zinc/38/21/98/1040382198.db2.gz UXHNLKCJQUOSBN-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069278 1040430507 /nfs/dbraw/zinc/43/05/07/1040430507.db2.gz GNHRALPPEIRXMF-GOEBONIOSA-N 1 1 333.432 3.824 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000512677953 1040497108 /nfs/dbraw/zinc/49/71/08/1040497108.db2.gz NJHWUTKDBDNDDS-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@H]1O ZINC000555420385 1040556145 /nfs/dbraw/zinc/55/61/45/1040556145.db2.gz GXVWRWVKWOIUED-IAQYHMDHSA-N 1 1 346.349 3.597 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000600197038 1040811687 /nfs/dbraw/zinc/81/16/87/1040811687.db2.gz QDSCQURWABUJNA-YOEHRIQHSA-N 1 1 348.443 3.703 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)c1ccccc1 ZINC000491130571 1040938941 /nfs/dbraw/zinc/93/89/41/1040938941.db2.gz ACPRTENRSADODX-CQSZACIVSA-N 1 1 332.375 3.944 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)c1ccccc1 ZINC000491130571 1040938959 /nfs/dbraw/zinc/93/89/59/1040938959.db2.gz ACPRTENRSADODX-CQSZACIVSA-N 1 1 332.375 3.944 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)cs1 ZINC000555685348 1041010270 /nfs/dbraw/zinc/01/02/70/1041010270.db2.gz HZIQNBJOHXNJQP-AWEZNQCLSA-N 1 1 338.816 3.963 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)cs1 ZINC000555685348 1041010282 /nfs/dbraw/zinc/01/02/82/1041010282.db2.gz HZIQNBJOHXNJQP-AWEZNQCLSA-N 1 1 338.816 3.963 20 5 EHBDMO C[C@H](C1CCCCC1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000566666687 1041093804 /nfs/dbraw/zinc/09/38/04/1041093804.db2.gz WYYOLKVIMCONRR-CQSZACIVSA-N 1 1 333.432 3.824 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000585756375 1043025282 /nfs/dbraw/zinc/02/52/82/1043025282.db2.gz GZTONAHSDYSATH-OXQOHEQNSA-N 1 1 339.439 3.515 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C)[C@H](Cc2ccccc2)C1 ZINC000585756375 1043025286 /nfs/dbraw/zinc/02/52/86/1043025286.db2.gz GZTONAHSDYSATH-OXQOHEQNSA-N 1 1 339.439 3.515 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2cc([N+](=O)[O-])ccc21 ZINC000279118018 1043380261 /nfs/dbraw/zinc/38/02/61/1043380261.db2.gz PVMVCVNBTGCICP-CVEARBPZSA-N 1 1 326.400 3.708 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@H]2CCCc3c[nH]nc32)c2cc([N+](=O)[O-])ccc21 ZINC000279118026 1043380894 /nfs/dbraw/zinc/38/08/94/1043380894.db2.gz PVMVCVNBTGCICP-JKSUJKDBSA-N 1 1 326.400 3.708 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@@H](CCO)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279223038 1043598357 /nfs/dbraw/zinc/59/83/57/1043598357.db2.gz ZEPJFHIEHOPZCD-JKSUJKDBSA-N 1 1 330.384 3.624 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788566 1127148116 /nfs/dbraw/zinc/14/81/16/1127148116.db2.gz XRQODSBVBBMGEA-NWDGAFQWSA-N 1 1 343.349 3.961 20 5 EHBDMO CCC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000185879348 1127182281 /nfs/dbraw/zinc/18/22/81/1127182281.db2.gz FQGOENCPHFAELZ-CQSZACIVSA-N 1 1 349.431 3.587 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000765087257 1127572268 /nfs/dbraw/zinc/57/22/68/1127572268.db2.gz JNXARYQVWPKKSG-LBPRGKRZSA-N 1 1 335.404 3.679 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438419 1127743987 /nfs/dbraw/zinc/74/39/87/1127743987.db2.gz HRVTZKZLNKTKDS-STQMWFEESA-N 1 1 337.420 3.501 20 5 EHBDMO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1c([N+](=O)[O-])ncn1C ZINC000338590680 1127871758 /nfs/dbraw/zinc/87/17/58/1127871758.db2.gz SJQIOZRZOADNMF-UHFFFAOYSA-N 1 1 336.461 3.971 20 5 EHBDMO CCCC(C)(C)[N@@H+](Cc1cccs1)Cc1c([N+](=O)[O-])ncn1C ZINC000338590680 1127871764 /nfs/dbraw/zinc/87/17/64/1127871764.db2.gz SJQIOZRZOADNMF-UHFFFAOYSA-N 1 1 336.461 3.971 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571449 1128105251 /nfs/dbraw/zinc/10/52/51/1128105251.db2.gz REQQJRMIDGTPNJ-WDEREUQCSA-N 1 1 344.358 3.683 20 5 EHBDMO CS(=O)(=O)[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000282256059 1128132702 /nfs/dbraw/zinc/13/27/02/1128132702.db2.gz BMRGFSQXPPQGAM-QGZVFWFLSA-N 1 1 339.460 3.612 20 5 EHBDMO Cc1cc2nc3ccc(N(C)C)cc3nc2cc1Nc1ccc[nH+]c1N ZINC001212402229 1128443958 /nfs/dbraw/zinc/44/39/58/1128443958.db2.gz WPMLKUKJYJFIGH-UHFFFAOYSA-N 1 1 344.422 3.878 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508530 1128483929 /nfs/dbraw/zinc/48/39/29/1128483929.db2.gz AQIKWZGFWHYRPZ-RDJZCZTQSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819741 1128661395 /nfs/dbraw/zinc/66/13/95/1128661395.db2.gz AQBUEXDDIUHGNW-UKRRQHHQSA-N 1 1 346.452 3.916 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000153854096 1128776261 /nfs/dbraw/zinc/77/62/61/1128776261.db2.gz PKBPIBWZFMSCIR-GOSISDBHSA-N 1 1 327.384 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1C(F)(F)F ZINC000301117823 1121952337 /nfs/dbraw/zinc/95/23/37/1121952337.db2.gz WIJNNLUEHXPMQI-TZMCWYRMSA-N 1 1 329.322 3.652 20 5 EHBDMO C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000301741627 1129026031 /nfs/dbraw/zinc/02/60/31/1129026031.db2.gz LGKAYTGFHMYRCF-GFCCVEGCSA-N 1 1 346.818 3.502 20 5 EHBDMO C[N@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000255210802 1129046161 /nfs/dbraw/zinc/04/61/61/1129046161.db2.gz GOLUCJWDQHUKSH-CLFYSBASSA-N 1 1 329.444 3.558 20 5 EHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154339023 1122564579 /nfs/dbraw/zinc/56/45/79/1122564579.db2.gz VMMZNGBALPVJJB-AZOIQLNYSA-N 1 1 344.386 3.645 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000917841941 1122691850 /nfs/dbraw/zinc/69/18/50/1122691850.db2.gz QDQAOXPGDCXRDN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000917841941 1122691853 /nfs/dbraw/zinc/69/18/53/1122691853.db2.gz QDQAOXPGDCXRDN-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000556896393 1123173428 /nfs/dbraw/zinc/17/34/28/1123173428.db2.gz VWVFKWYFGVRFAG-KBAYOESNSA-N 1 1 332.444 3.929 20 5 EHBDMO CC[C@@H]1CCCCN1C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350211 1123573765 /nfs/dbraw/zinc/57/37/65/1123573765.db2.gz OGGZUESRXNGCOZ-QGZVFWFLSA-N 1 1 347.459 3.596 20 5 EHBDMO CC[C@@H]1CCCCN1C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350211 1123573767 /nfs/dbraw/zinc/57/37/67/1123573767.db2.gz OGGZUESRXNGCOZ-QGZVFWFLSA-N 1 1 347.459 3.596 20 5 EHBDMO CC(C)C[C@@H](C)N(C)C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350749 1123573831 /nfs/dbraw/zinc/57/38/31/1123573831.db2.gz XOFFNXQTBOPOBM-MRXNPFEDSA-N 1 1 349.475 3.698 20 5 EHBDMO CC(C)C[C@@H](C)N(C)C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350749 1123573833 /nfs/dbraw/zinc/57/38/33/1123573833.db2.gz XOFFNXQTBOPOBM-MRXNPFEDSA-N 1 1 349.475 3.698 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672477 1123636444 /nfs/dbraw/zinc/63/64/44/1123636444.db2.gz CGFYWZZDTLYOOJ-NVXWUHKLSA-N 1 1 326.396 3.852 20 5 EHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672476 1123636580 /nfs/dbraw/zinc/63/65/80/1123636580.db2.gz CGFYWZZDTLYOOJ-DOTOQJQBSA-N 1 1 326.396 3.852 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOCC2(CCCC2)C1 ZINC000615838774 1123885246 /nfs/dbraw/zinc/88/52/46/1123885246.db2.gz CHYYPNGXYRDDJB-LFIBNONCSA-N 1 1 330.428 3.891 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c1 ZINC000735492273 1131353340 /nfs/dbraw/zinc/35/33/40/1131353340.db2.gz HJBRUYXWSHZURH-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](CCO)[C@H]2CCc3ccccc32)c1 ZINC000735492273 1131353345 /nfs/dbraw/zinc/35/33/45/1131353345.db2.gz HJBRUYXWSHZURH-SFHVURJKSA-N 1 1 346.814 3.730 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493207 1131353722 /nfs/dbraw/zinc/35/37/22/1131353722.db2.gz YGTATWMVBNCDRH-VBQJREDUSA-N 1 1 335.423 3.571 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000067472093 1129277140 /nfs/dbraw/zinc/27/71/40/1129277140.db2.gz UNIDWUMMLPSRED-QWRGUYRKSA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000170954608 1129449299 /nfs/dbraw/zinc/44/92/99/1129449299.db2.gz XEMIJZWTBFUMDX-CYBMUJFWSA-N 1 1 340.379 3.581 20 5 EHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000170954608 1129449302 /nfs/dbraw/zinc/44/93/02/1129449302.db2.gz XEMIJZWTBFUMDX-CYBMUJFWSA-N 1 1 340.379 3.581 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)s2)cc1 ZINC000543413226 1129473483 /nfs/dbraw/zinc/47/34/83/1129473483.db2.gz ZUKMGJDZOAPXOS-XKQJLSEDSA-N 1 1 344.436 3.526 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430033077 1129485931 /nfs/dbraw/zinc/48/59/31/1129485931.db2.gz IXUNDSIQSUVCQC-HWKANZROSA-N 1 1 340.276 3.954 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000154701932 1129582057 /nfs/dbraw/zinc/58/20/57/1129582057.db2.gz AOPSAHQKQDCWTK-CQSZACIVSA-N 1 1 329.400 3.938 20 5 EHBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093324611 1129584828 /nfs/dbraw/zinc/58/48/28/1129584828.db2.gz TUXPZXDSCXWWDG-KEDPEKRHSA-N 1 1 326.396 3.877 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000331075871 1129652747 /nfs/dbraw/zinc/65/27/47/1129652747.db2.gz WDVWGTMYWVFDSU-LSDHHAIUSA-N 1 1 348.447 3.548 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000391464450 1129668122 /nfs/dbraw/zinc/66/81/22/1129668122.db2.gz ZDSQZFTUUYPUFJ-ZMSDIMECSA-N 1 1 338.835 3.764 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000302268887 1129774846 /nfs/dbraw/zinc/77/48/46/1129774846.db2.gz GPNOAGSTHSFZQL-IINYFYTJSA-N 1 1 344.242 3.822 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302718247 1129787741 /nfs/dbraw/zinc/78/77/41/1129787741.db2.gz YZAXAGQYCRPKEZ-CYBMUJFWSA-N 1 1 325.840 3.725 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000429157470 1129900408 /nfs/dbraw/zinc/90/04/08/1129900408.db2.gz VHIZCHYLFJJIGK-HWPZZCPQSA-N 1 1 336.388 3.588 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000133587954 1129953759 /nfs/dbraw/zinc/95/37/59/1129953759.db2.gz NDFLOTNZLVAZKD-RISCZKNCSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000245528183 1130230464 /nfs/dbraw/zinc/23/04/64/1130230464.db2.gz QJIXSGDGBJIGTC-CVEARBPZSA-N 1 1 342.443 3.652 20 5 EHBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000732190292 1130892536 /nfs/dbraw/zinc/89/25/36/1130892536.db2.gz BWOKUBIABNFPJW-UHFFFAOYSA-N 1 1 345.399 3.507 20 5 EHBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000732190292 1130892542 /nfs/dbraw/zinc/89/25/42/1130892542.db2.gz BWOKUBIABNFPJW-UHFFFAOYSA-N 1 1 345.399 3.507 20 5 EHBDMO CO[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(F)(F)F ZINC000733330003 1131027064 /nfs/dbraw/zinc/02/70/64/1131027064.db2.gz NTSTWMZYBVRCDI-AWEZNQCLSA-N 1 1 344.289 3.522 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000733332422 1131028584 /nfs/dbraw/zinc/02/85/84/1131028584.db2.gz XMBDULDALJQFRE-UHFFFAOYSA-N 1 1 340.408 3.712 20 5 EHBDMO Cc1cc([C@H]2CCC[N@H+]2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910419 1131916979 /nfs/dbraw/zinc/91/69/79/1131916979.db2.gz ZFIDFAGNRXRWQF-VQIMIIECSA-N 1 1 341.411 3.976 20 5 EHBDMO CC(C)N1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909654 1131917103 /nfs/dbraw/zinc/91/71/03/1131917103.db2.gz UTFRZSUOMSHIGI-ZTNFWEORSA-N 1 1 345.487 3.551 20 5 EHBDMO CO[C@H]1CCC[C@@H]2C[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910548 1131917130 /nfs/dbraw/zinc/91/71/30/1131917130.db2.gz LVERWRJPTAWPSX-JYBIWHBTSA-N 1 1 344.455 3.589 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](CCO)c1ccccc1 ZINC000743857060 1131987589 /nfs/dbraw/zinc/98/75/89/1131987589.db2.gz SRVLHGDRJUEVPX-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](CCO)c1ccccc1 ZINC000743857060 1131987596 /nfs/dbraw/zinc/98/75/96/1131987596.db2.gz SRVLHGDRJUEVPX-KRWDZBQOSA-N 1 1 334.803 3.804 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001173181978 1131993210 /nfs/dbraw/zinc/99/32/10/1131993210.db2.gz RCLLQPDCPFFCGW-MNOVXSKESA-N 1 1 346.349 3.651 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)c1F ZINC001173181978 1131993214 /nfs/dbraw/zinc/99/32/14/1131993214.db2.gz RCLLQPDCPFFCGW-MNOVXSKESA-N 1 1 346.349 3.651 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001173228225 1132007966 /nfs/dbraw/zinc/00/79/66/1132007966.db2.gz UQFRABYZHQUGCF-ZBFHGGJFSA-N 1 1 348.443 3.580 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001173232495 1132010503 /nfs/dbraw/zinc/01/05/03/1132010503.db2.gz BSOOPMRUTNGUSX-GJZGRUSLSA-N 1 1 330.428 3.750 20 5 EHBDMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236659 1132025699 /nfs/dbraw/zinc/02/56/99/1132025699.db2.gz DQVIUSGKYFOMKW-AWEZNQCLSA-N 1 1 342.395 3.777 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009403 1132631836 /nfs/dbraw/zinc/63/18/36/1132631836.db2.gz WCMXKLXGHJCEBU-HKUYNNGSSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037128 1132636711 /nfs/dbraw/zinc/63/67/11/1132636711.db2.gz JBPHTXISHRIDJD-WQVCFCJDSA-N 1 1 340.876 3.875 20 5 EHBDMO CC[N@@H+](Cc1cccc(Br)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035072 1132637384 /nfs/dbraw/zinc/63/73/84/1132637384.db2.gz ADLOSRCAFXEMDG-UKRRQHHQSA-N 1 1 341.249 3.716 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038402 1132638215 /nfs/dbraw/zinc/63/82/15/1132638215.db2.gz YLFGDRTXIUVSHS-XNRPHZJLSA-N 1 1 342.361 3.940 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234819 1132883618 /nfs/dbraw/zinc/88/36/18/1132883618.db2.gz IOYLJBAHHHHOKK-CQSZACIVSA-N 1 1 343.452 3.920 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000804357268 1133007749 /nfs/dbraw/zinc/00/77/49/1133007749.db2.gz BPCRBLZVQBMDJU-JKIFEVAISA-N 1 1 345.443 3.639 20 5 EHBDMO CCCCC[C@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000767762441 1133049038 /nfs/dbraw/zinc/04/90/38/1133049038.db2.gz PFSGIFUWGJTOHS-ZDUSSCGKSA-N 1 1 333.388 3.505 20 5 EHBDMO CCCCC[C@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000767762441 1133049044 /nfs/dbraw/zinc/04/90/44/1133049044.db2.gz PFSGIFUWGJTOHS-ZDUSSCGKSA-N 1 1 333.388 3.505 20 5 EHBDMO CC(C)CC[C@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766834 1133050023 /nfs/dbraw/zinc/05/00/23/1133050023.db2.gz XWISEZADOXSUPF-MRXNPFEDSA-N 1 1 343.431 3.711 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541961 1133079363 /nfs/dbraw/zinc/07/93/63/1133079363.db2.gz GYRNHKJGWYSPAE-HNNXBMFYSA-N 1 1 343.427 3.676 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000768541018 1133153196 /nfs/dbraw/zinc/15/31/96/1133153196.db2.gz CXWBDFVGTZWWJI-CQSZACIVSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000768541018 1133153200 /nfs/dbraw/zinc/15/32/00/1133153200.db2.gz CXWBDFVGTZWWJI-CQSZACIVSA-N 1 1 346.818 3.726 20 5 EHBDMO C[N@@H+](CC(=O)Nc1cc2cccnc2c2ncccc12)C1CCCC1 ZINC001180628791 1133400899 /nfs/dbraw/zinc/40/08/99/1133400899.db2.gz AOWBKDGKWUKVDU-UHFFFAOYSA-N 1 1 334.423 3.596 20 5 EHBDMO C[C@@H]([N@H+](C)Cc1c(Br)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000770288121 1133405273 /nfs/dbraw/zinc/40/52/73/1133405273.db2.gz FVFAJOXKQXRZMK-SNVBAGLBSA-N 1 1 327.222 3.978 20 5 EHBDMO C[C@@H]([N@@H+](C)Cc1c(Br)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000770288121 1133405276 /nfs/dbraw/zinc/40/52/76/1133405276.db2.gz FVFAJOXKQXRZMK-SNVBAGLBSA-N 1 1 327.222 3.978 20 5 EHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccc(N)cc1[N+](=O)[O-] ZINC000786574959 1133876599 /nfs/dbraw/zinc/87/65/99/1133876599.db2.gz HFASKOKOUWQNAD-UHFFFAOYSA-N 1 1 328.416 3.629 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC001183909634 1133876576 /nfs/dbraw/zinc/87/65/76/1133876576.db2.gz PNYLEVBGJWHODZ-ROUUACIJSA-N 1 1 337.423 3.675 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000746667671 1133988446 /nfs/dbraw/zinc/98/84/46/1133988446.db2.gz ZVXRSWFEJTYKPH-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1CCCC[C@@H]1C ZINC001184856780 1133999545 /nfs/dbraw/zinc/99/95/45/1133999545.db2.gz LQXLJTGQOXGAQO-QWRGUYRKSA-N 1 1 346.353 3.683 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479728 1134130670 /nfs/dbraw/zinc/13/06/70/1134130670.db2.gz AAOQNCBNVAVBAF-RDJZCZTQSA-N 1 1 349.450 3.820 20 5 EHBDMO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCCC2(F)F)c([N+](=O)[O-])c1 ZINC001170305813 1134739454 /nfs/dbraw/zinc/73/94/54/1134739454.db2.gz QERXGBVDCCXFGI-NHYWBVRUSA-N 1 1 328.359 3.702 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330108 1134749795 /nfs/dbraw/zinc/74/97/95/1134749795.db2.gz YVPDKJGSVZBVNA-HNNXBMFYSA-N 1 1 340.423 3.901 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344944 1134758205 /nfs/dbraw/zinc/75/82/05/1134758205.db2.gz FSOCCLMTBDCXFX-WCQYABFASA-N 1 1 328.359 3.512 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191821515 1134930473 /nfs/dbraw/zinc/93/04/73/1134930473.db2.gz NYJCRNZHEWKYCZ-UHFFFAOYSA-N 1 1 346.818 3.542 20 5 EHBDMO CC[N@@H+](CCCNC(=O)c1ccc([N+](=O)[O-])cc1C)C1CCCCC1 ZINC001130589312 1135425148 /nfs/dbraw/zinc/42/51/48/1135425148.db2.gz UTTUHJDYHIWMET-UHFFFAOYSA-N 1 1 347.459 3.678 20 5 EHBDMO Cc1c(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)cccc1[N+](=O)[O-] ZINC000806616985 1135471181 /nfs/dbraw/zinc/47/11/81/1135471181.db2.gz OIUXPYQGGYXBMZ-HNNXBMFYSA-N 1 1 336.395 3.940 20 5 EHBDMO C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939165 1135486757 /nfs/dbraw/zinc/48/67/57/1135486757.db2.gz WXYJXKKZGOANJM-IINYFYTJSA-N 1 1 347.242 3.885 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939165 1135486760 /nfs/dbraw/zinc/48/67/60/1135486760.db2.gz WXYJXKKZGOANJM-IINYFYTJSA-N 1 1 347.242 3.885 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC001196254034 1135536223 /nfs/dbraw/zinc/53/62/23/1135536223.db2.gz JBBYXFMZQSIDIE-MRXNPFEDSA-N 1 1 345.443 3.744 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)c(F)c1 ZINC001196899319 1135628460 /nfs/dbraw/zinc/62/84/60/1135628460.db2.gz UMWJSTFDUBNEIG-NXHRZFHOSA-N 1 1 326.371 3.969 20 5 EHBDMO CC(C)c1ccc2c(c1)CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845364 1135859934 /nfs/dbraw/zinc/85/99/34/1135859934.db2.gz ZKYHRQHJZABMAR-HXUWFJFHSA-N 1 1 340.423 3.810 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2cc(C)cc(C)c2C1 ZINC001198853273 1135860560 /nfs/dbraw/zinc/86/05/60/1135860560.db2.gz WGEKMVUPWXATNK-UHFFFAOYSA-N 1 1 326.396 3.779 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2cc(C)cc(C)c2C1 ZINC001198853273 1135860564 /nfs/dbraw/zinc/86/05/64/1135860564.db2.gz WGEKMVUPWXATNK-UHFFFAOYSA-N 1 1 326.396 3.779 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000809934487 1135901552 /nfs/dbraw/zinc/90/15/52/1135901552.db2.gz DFCRPKCULCULOX-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000809934487 1135901553 /nfs/dbraw/zinc/90/15/53/1135901553.db2.gz DFCRPKCULCULOX-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000809946435 1135903501 /nfs/dbraw/zinc/90/35/01/1135903501.db2.gz DOMZWWIBEFOCJG-ZDUSSCGKSA-N 1 1 344.242 3.570 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1cccc(O)c1 ZINC000811476598 1136096327 /nfs/dbraw/zinc/09/63/27/1136096327.db2.gz OEMYKYHKXHUHMT-UHFFFAOYSA-N 1 1 327.167 3.897 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812853798 1136261917 /nfs/dbraw/zinc/26/19/17/1136261917.db2.gz KGVWDAXGXDUWDJ-LIRRHRJNSA-N 1 1 344.411 3.547 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000850464139 1136263916 /nfs/dbraw/zinc/26/39/16/1136263916.db2.gz BRUDUCRWUPUWQE-LBPRGKRZSA-N 1 1 345.355 3.671 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000850470595 1136265983 /nfs/dbraw/zinc/26/59/83/1136265983.db2.gz FGQSLAJAQBMUIX-NWDGAFQWSA-N 1 1 345.355 3.923 20 5 EHBDMO Cc1ccc(C[N@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC001170722915 1136395416 /nfs/dbraw/zinc/39/54/16/1136395416.db2.gz MQMOGJQBBQIKJN-HNNXBMFYSA-N 1 1 343.402 3.753 20 5 EHBDMO Cc1ccc(C[N@@H+]2CCN(c3cccc(F)c3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC001170722915 1136395420 /nfs/dbraw/zinc/39/54/20/1136395420.db2.gz MQMOGJQBBQIKJN-HNNXBMFYSA-N 1 1 343.402 3.753 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000851832828 1136412195 /nfs/dbraw/zinc/41/21/95/1136412195.db2.gz DXRBVBHQSGKEDX-PKOBYXMFSA-N 1 1 344.386 3.822 20 5 EHBDMO CCC[N@H+](Cc1ccc(C)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575495 1136438763 /nfs/dbraw/zinc/43/87/63/1136438763.db2.gz RODRITJXFKKGNT-IBGZPJMESA-N 1 1 328.412 3.849 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000776586828 1136449051 /nfs/dbraw/zinc/44/90/51/1136449051.db2.gz ISDGNUZBTPJYCA-UXHICEINSA-N 1 1 338.407 3.780 20 5 EHBDMO Cc1c(COC(=O)[C@@H]2CCCC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000815445468 1136596300 /nfs/dbraw/zinc/59/63/00/1136596300.db2.gz ZJWBRMGIBOBACX-SFHVURJKSA-N 1 1 346.427 3.744 20 5 EHBDMO C[N@@H+](CCCCNc1cccc(Br)c1[N+](=O)[O-])C1CC1 ZINC000856763651 1136808102 /nfs/dbraw/zinc/80/81/02/1136808102.db2.gz HGKLSNVOCXWPGU-UHFFFAOYSA-N 1 1 342.237 3.644 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586367 1137021425 /nfs/dbraw/zinc/02/14/25/1137021425.db2.gz NNUFMVNEJLHNMS-BEFAXECRSA-N 1 1 326.396 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1 ZINC000862540693 1137149039 /nfs/dbraw/zinc/14/90/39/1137149039.db2.gz JWBRSHJWBYJPBM-CYBMUJFWSA-N 1 1 332.787 3.943 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707003 1137239252 /nfs/dbraw/zinc/23/92/52/1137239252.db2.gz SBKSBRWXHGQUMZ-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nonc2c1 ZINC000846783286 1137365408 /nfs/dbraw/zinc/36/54/08/1137365408.db2.gz NKSDQUGAOSGJNB-UHFFFAOYSA-N 1 1 326.356 3.542 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1cncc(F)c1 ZINC000339081174 1137411920 /nfs/dbraw/zinc/41/19/20/1137411920.db2.gz IXZSOPKSVLGJNV-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO Cc1c([C@@H](C)[NH2+]Cc2nc3cc(F)ccc3n2C)cccc1[N+](=O)[O-] ZINC000772994489 1137434386 /nfs/dbraw/zinc/43/43/86/1137434386.db2.gz ALHXCXXBRHYGBZ-GFCCVEGCSA-N 1 1 342.374 3.780 20 5 EHBDMO CC[C@@]1(CO)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100397 1137483031 /nfs/dbraw/zinc/48/30/31/1137483031.db2.gz YSTMNSZSNCYSHO-OAHLLOKOSA-N 1 1 346.349 3.598 20 5 EHBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100397 1137483033 /nfs/dbraw/zinc/48/30/33/1137483033.db2.gz YSTMNSZSNCYSHO-OAHLLOKOSA-N 1 1 346.349 3.598 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(C2CC2)CC1 ZINC000872018665 1137564826 /nfs/dbraw/zinc/56/48/26/1137564826.db2.gz OGQFIDCFFDMDCM-LBPRGKRZSA-N 1 1 335.473 3.594 20 5 EHBDMO COCCOc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872025282 1137565674 /nfs/dbraw/zinc/56/56/74/1137565674.db2.gz JRSDYQJSGVOGRX-CYBMUJFWSA-N 1 1 348.374 3.610 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000872076607 1137569987 /nfs/dbraw/zinc/56/99/87/1137569987.db2.gz OCKAUYOBVUEJJG-RLAWYHOSSA-N 1 1 335.473 3.593 20 5 EHBDMO C[C@@H]([NH2+]CCOC(F)(F)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872110970 1137571782 /nfs/dbraw/zinc/57/17/82/1137571782.db2.gz VWPZSBDWTORIHD-SSDOTTSWSA-N 1 1 346.227 3.556 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000873081320 1137589757 /nfs/dbraw/zinc/58/97/57/1137589757.db2.gz BAAHTLWWBBMFCY-UHFFFAOYSA-N 1 1 328.416 3.813 20 5 EHBDMO Cc1c(C[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000873139492 1137591224 /nfs/dbraw/zinc/59/12/24/1137591224.db2.gz BYPOKWCBTJCGNU-QGZVFWFLSA-N 1 1 348.406 3.866 20 5 EHBDMO CCN(CC)c1ncc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000873183734 1137592981 /nfs/dbraw/zinc/59/29/81/1137592981.db2.gz FLQYQPCGKJTVMO-LBPRGKRZSA-N 1 1 334.445 3.748 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000877819661 1137691433 /nfs/dbraw/zinc/69/14/33/1137691433.db2.gz HHQPLHCOQRCQSX-LMRWQKIVSA-N 1 1 344.333 3.651 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000877819661 1137691434 /nfs/dbraw/zinc/69/14/34/1137691434.db2.gz HHQPLHCOQRCQSX-LMRWQKIVSA-N 1 1 344.333 3.651 20 5 EHBDMO CC[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878045251 1137700588 /nfs/dbraw/zinc/70/05/88/1137700588.db2.gz HFMUOZCEGXIAIC-LLVKDONJSA-N 1 1 336.779 3.673 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCCC23CCCCC3)o1 ZINC000878306459 1137710534 /nfs/dbraw/zinc/71/05/34/1137710534.db2.gz AXALMBYFYOYHKT-UHFFFAOYSA-N 1 1 342.399 3.944 20 5 EHBDMO CC(=O)Oc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000131010191 1137844970 /nfs/dbraw/zinc/84/49/70/1137844970.db2.gz QDJDAOLZGKQCBL-UHFFFAOYSA-N 1 1 340.379 3.685 20 5 EHBDMO COc1ccc(C[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000885964927 1138029007 /nfs/dbraw/zinc/02/90/07/1138029007.db2.gz GVCHCHBAVVKSOQ-CQSZACIVSA-N 1 1 341.411 3.799 20 5 EHBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136983647 1138044929 /nfs/dbraw/zinc/04/49/29/1138044929.db2.gz FIMICOGEEJEPRP-MOPGFXCFSA-N 1 1 326.396 3.774 20 5 EHBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000886105184 1138047105 /nfs/dbraw/zinc/04/71/05/1138047105.db2.gz UFPGWIJABSFBCJ-JTQLQIEISA-N 1 1 325.290 3.859 20 5 EHBDMO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000886107105 1138047379 /nfs/dbraw/zinc/04/73/79/1138047379.db2.gz KMGKRZUDJLEECT-ZDUSSCGKSA-N 1 1 337.326 3.832 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(C)C)c1ccccn1 ZINC000122399273 1138257506 /nfs/dbraw/zinc/25/75/06/1138257506.db2.gz QYMYNJYHWNPSBY-QGZVFWFLSA-N 1 1 329.400 3.875 20 5 EHBDMO O=C(CC[N@@H+](Cc1ccccc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000336961494 1138435502 /nfs/dbraw/zinc/43/55/02/1138435502.db2.gz DAHYUTKMFWRNTK-UHFFFAOYSA-N 1 1 339.395 3.588 20 5 EHBDMO CCOc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)ccc1O ZINC000264407844 1138503584 /nfs/dbraw/zinc/50/35/84/1138503584.db2.gz YOUXFIOAPUUFMY-UHFFFAOYSA-N 1 1 336.775 3.642 20 5 EHBDMO CC[N@@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C1CC1 ZINC000338447898 1138919519 /nfs/dbraw/zinc/91/95/19/1138919519.db2.gz LSISROOMSAFSDN-UHFFFAOYSA-N 1 1 333.435 3.602 20 5 EHBDMO CC[C@@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000174499463 1139424090 /nfs/dbraw/zinc/42/40/90/1139424090.db2.gz BHLFNSKVIWVUFG-MRXNPFEDSA-N 1 1 335.429 3.783 20 5 EHBDMO COCC1=CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000185847466 1140173893 /nfs/dbraw/zinc/17/38/93/1140173893.db2.gz SUJRPOABSQBBJE-UHFFFAOYSA-N 1 1 335.403 3.725 20 5 EHBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000192499825 1140535746 /nfs/dbraw/zinc/53/57/46/1140535746.db2.gz QBXJDCLSDVUENW-UHFFFAOYSA-N 1 1 345.447 3.572 20 5 EHBDMO C[C@@H]1C[C@@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000193466571 1140577257 /nfs/dbraw/zinc/57/72/57/1140577257.db2.gz QSFUNHPZOXRQHC-PBHICJAKSA-N 1 1 340.427 3.642 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000269635590 1141129963 /nfs/dbraw/zinc/12/99/63/1141129963.db2.gz HJBHHNZIJWSCTR-DLBZAZTESA-N 1 1 332.787 3.729 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC000269635590 1141129967 /nfs/dbraw/zinc/12/99/67/1141129967.db2.gz HJBHHNZIJWSCTR-DLBZAZTESA-N 1 1 332.787 3.729 20 5 EHBDMO CC[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)CC(C)(C)O ZINC000270684892 1141255780 /nfs/dbraw/zinc/25/57/80/1141255780.db2.gz APUNQUVTMCVNGC-UHFFFAOYSA-N 1 1 325.408 3.539 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C2CCN(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025749 1141296631 /nfs/dbraw/zinc/29/66/31/1141296631.db2.gz BCQKHZXNUIZQRZ-AWEZNQCLSA-N 1 1 347.459 3.661 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000271558778 1141397297 /nfs/dbraw/zinc/39/72/97/1141397297.db2.gz WIBDAPHEKCVWEI-KGLIPLIRSA-N 1 1 346.456 3.856 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000055448935 214324170 /nfs/dbraw/zinc/32/41/70/214324170.db2.gz AETHVUGYKZYFNS-CYBMUJFWSA-N 1 1 343.383 3.815 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ncccc1C)C(C)C ZINC000430209222 1014969048 /nfs/dbraw/zinc/96/90/48/1014969048.db2.gz QPPUOIYBRXIGAM-KRWDZBQOSA-N 1 1 329.400 3.794 20 5 EHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000536672115 1032107157 /nfs/dbraw/zinc/10/71/57/1032107157.db2.gz ABRRICAXJBPNFX-RHSMWYFYSA-N 1 1 326.396 3.981 20 5 EHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1cccc(O)c1 ZINC000430212113 1015008115 /nfs/dbraw/zinc/00/81/15/1015008115.db2.gz ZKFPKLJJSGXFFL-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1cccc(O)c1 ZINC000430212113 1015008128 /nfs/dbraw/zinc/00/81/28/1015008128.db2.gz ZKFPKLJJSGXFFL-CYBMUJFWSA-N 1 1 330.384 3.892 20 5 EHBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1ccccc1 ZINC000430216009 1015043459 /nfs/dbraw/zinc/04/34/59/1015043459.db2.gz DRGINQHRIWZJGD-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1ccccc1 ZINC000430216009 1015043472 /nfs/dbraw/zinc/04/34/72/1015043472.db2.gz DRGINQHRIWZJGD-OAHLLOKOSA-N 1 1 344.411 3.813 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000157668299 1015183887 /nfs/dbraw/zinc/18/38/87/1015183887.db2.gz FNKYSVFIBUGZAY-AWEZNQCLSA-N 1 1 348.786 3.607 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC[C@@H]1C ZINC000129724517 1120150836 /nfs/dbraw/zinc/15/08/36/1120150836.db2.gz OTENNZRWTPXREB-QWRGUYRKSA-N 1 1 327.222 3.835 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC[C@@H]1C ZINC000129724517 1120150839 /nfs/dbraw/zinc/15/08/39/1120150839.db2.gz OTENNZRWTPXREB-QWRGUYRKSA-N 1 1 327.222 3.835 20 5 EHBDMO CC1=C[C@@H](C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430273574 1015691165 /nfs/dbraw/zinc/69/11/65/1015691165.db2.gz BBBOWWIAFRGCBM-CYBMUJFWSA-N 1 1 327.384 3.690 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000189475882 1016520531 /nfs/dbraw/zinc/52/05/31/1016520531.db2.gz WFCKXBZQHBOFTH-OAHLLOKOSA-N 1 1 347.459 3.568 20 5 EHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414537033 1016963767 /nfs/dbraw/zinc/96/37/67/1016963767.db2.gz KNQIXLGXFHHONB-INIZCTEOSA-N 1 1 338.835 3.885 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOCC34CCCC4)o2)cc1 ZINC000536708595 1032184241 /nfs/dbraw/zinc/18/42/41/1032184241.db2.gz IEBQKBKBXODGIH-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000449494101 1032659986 /nfs/dbraw/zinc/65/99/86/1032659986.db2.gz GFXIFHWQHFFRBN-DYVFJYSZSA-N 1 1 330.384 3.712 20 5 EHBDMO CO[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000449509977 1032696658 /nfs/dbraw/zinc/69/66/58/1032696658.db2.gz WZTLOCVPCRFTSB-BLLLJJGKSA-N 1 1 347.440 3.575 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000336928834 1017958618 /nfs/dbraw/zinc/95/86/18/1017958618.db2.gz NYNQEPGNVZYHIS-OAHLLOKOSA-N 1 1 340.427 3.820 20 5 EHBDMO C[C@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018146991 /nfs/dbraw/zinc/14/69/91/1018146991.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147005 /nfs/dbraw/zinc/14/70/05/1018147005.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 1 1 343.427 3.627 20 5 EHBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147016 /nfs/dbraw/zinc/14/70/16/1018147016.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 1 1 343.427 3.627 20 5 EHBDMO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893069856 1018335544 /nfs/dbraw/zinc/33/55/44/1018335544.db2.gz SGJZENDZOQSSPA-OAHLLOKOSA-N 1 1 348.786 3.870 20 5 EHBDMO Cc1ccc(-c2csc([C@H]3C[N@H+]4CCC[C@@H]4CO3)n2)cc1[N+](=O)[O-] ZINC000102662598 1018571632 /nfs/dbraw/zinc/57/16/32/1018571632.db2.gz KCCPFLCSZRECDA-CZUORRHYSA-N 1 1 345.424 3.562 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190851 1018989359 /nfs/dbraw/zinc/98/93/59/1018989359.db2.gz MNHFIYNNJLNKRB-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190851 1018989369 /nfs/dbraw/zinc/98/93/69/1018989369.db2.gz MNHFIYNNJLNKRB-LPHOPBHVSA-N 1 1 339.439 3.595 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093558564 1019044673 /nfs/dbraw/zinc/04/46/73/1019044673.db2.gz NYOJIZGKLVMDLU-CYBMUJFWSA-N 1 1 348.472 3.569 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](CC(C)C)C1 ZINC000469068255 1019095998 /nfs/dbraw/zinc/09/59/98/1019095998.db2.gz UHORURHJMPVPRY-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](CC(C)C)C1 ZINC000469068255 1019096014 /nfs/dbraw/zinc/09/60/14/1019096014.db2.gz UHORURHJMPVPRY-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO Cc1ncc([C@@H](C)[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)n1 ZINC000602439727 1032889566 /nfs/dbraw/zinc/88/95/66/1032889566.db2.gz MCNRSXIRFTZETJ-CYBMUJFWSA-N 1 1 326.400 3.727 20 5 EHBDMO Cc1ncc([C@@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(C)n1 ZINC000602439727 1032889583 /nfs/dbraw/zinc/88/95/83/1032889583.db2.gz MCNRSXIRFTZETJ-CYBMUJFWSA-N 1 1 326.400 3.727 20 5 EHBDMO C[C@@H]1C[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000602476363 1032897932 /nfs/dbraw/zinc/89/79/32/1032897932.db2.gz OLGYSPIGJQYKQT-BXUZGUMPSA-N 1 1 345.365 3.528 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000255959093 1020404540 /nfs/dbraw/zinc/40/45/40/1020404540.db2.gz SXGIJDZJSXCZNN-CZUORRHYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@H](c2ccccc2F)[C@H](C)O)cccc1[N+](=O)[O-] ZINC000581196322 1020513108 /nfs/dbraw/zinc/51/31/08/1020513108.db2.gz RTXLGSUNXNJKQH-LXIYXOSZSA-N 1 1 332.375 3.815 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000326000039 1020667924 /nfs/dbraw/zinc/66/79/24/1020667924.db2.gz FPJKKVDKPRFDTG-QRQLOZEOSA-N 1 1 332.444 3.809 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000360875586 1020846427 /nfs/dbraw/zinc/84/64/27/1020846427.db2.gz XDGKIXCRSZLXRC-PBHICJAKSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000393853550 1021078052 /nfs/dbraw/zinc/07/80/52/1021078052.db2.gz XBVIWQYUTFVSBC-NVXWUHKLSA-N 1 1 325.412 3.917 20 5 EHBDMO COc1cc(C)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276357402 1021093298 /nfs/dbraw/zinc/09/32/98/1021093298.db2.gz XRLKHZWXWKCBAF-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276357402 1021093305 /nfs/dbraw/zinc/09/33/05/1021093305.db2.gz XRLKHZWXWKCBAF-UHFFFAOYSA-N 1 1 348.374 3.692 20 5 EHBDMO COc1cccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000341230116 1021134664 /nfs/dbraw/zinc/13/46/64/1021134664.db2.gz QXUXVJIFYQEBIW-LLVKDONJSA-N 1 1 327.340 3.595 20 5 EHBDMO Cc1cnc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000477169458 1021223213 /nfs/dbraw/zinc/22/32/13/1021223213.db2.gz JRBHEIVLXXTWDH-MRXNPFEDSA-N 1 1 346.475 3.779 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000120889372 1021478129 /nfs/dbraw/zinc/47/81/29/1021478129.db2.gz UIYKGCGAQAASDV-CYBMUJFWSA-N 1 1 330.388 3.657 20 5 EHBDMO CN(C)C1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000437113681 1021569171 /nfs/dbraw/zinc/56/91/71/1021569171.db2.gz KGOJNLPCTFNNBF-LJQANCHMSA-N 1 1 339.439 3.758 20 5 EHBDMO CCCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H](C)CC ZINC000172895307 1033001126 /nfs/dbraw/zinc/00/11/26/1033001126.db2.gz HILLBUJZHDGFTR-AWEZNQCLSA-N 1 1 331.420 3.711 20 5 EHBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602625563 1033018136 /nfs/dbraw/zinc/01/81/36/1033018136.db2.gz STADXSWOUYYPLC-OAHLLOKOSA-N 1 1 346.349 3.598 20 5 EHBDMO CC(C)OC(=O)C[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184454900 1022340893 /nfs/dbraw/zinc/34/08/93/1022340893.db2.gz JWGNADFEJGZPTM-LSDHHAIUSA-N 1 1 334.416 3.710 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCN3CCCCCC3)o2)c1 ZINC000517538920 1022421927 /nfs/dbraw/zinc/42/19/27/1022421927.db2.gz SROIPPNRAYBWSO-UHFFFAOYSA-N 1 1 343.427 3.820 20 5 EHBDMO COc1c(O)ccc(C[NH2+]Cc2cc(C3CC3)ccc2F)c1[N+](=O)[O-] ZINC000894665989 1022681356 /nfs/dbraw/zinc/68/13/56/1022681356.db2.gz DFHCLUGYXDBNAG-UHFFFAOYSA-N 1 1 346.358 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719610 1022791081 /nfs/dbraw/zinc/79/10/81/1022791081.db2.gz PEHRBYNKUVQWSP-KRWDZBQOSA-N 1 1 340.427 3.896 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccnn3C3CCC3)C2)cc1 ZINC000894719946 1022791102 /nfs/dbraw/zinc/79/11/02/1022791102.db2.gz QYVIVXNNYSPANS-MRXNPFEDSA-N 1 1 340.427 3.896 20 5 EHBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000602685390 1033085206 /nfs/dbraw/zinc/08/52/06/1033085206.db2.gz NWZHCOYIIBFXBL-ABAIWWIYSA-N 1 1 346.349 3.861 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCN(c2ccccc2)CC1 ZINC000439010415 1023205728 /nfs/dbraw/zinc/20/57/28/1023205728.db2.gz ZTPRAZLYYYGWFE-UHFFFAOYSA-N 1 1 339.439 3.738 20 5 EHBDMO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000507260826 1023215959 /nfs/dbraw/zinc/21/59/59/1023215959.db2.gz JNEOSWXBKWMHIJ-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1c(F)cccc1F ZINC000507260826 1023215969 /nfs/dbraw/zinc/21/59/69/1023215969.db2.gz JNEOSWXBKWMHIJ-UHFFFAOYSA-N 1 1 336.338 3.774 20 5 EHBDMO Cc1cc(Cc2noc([C@H](C)[N@@H+]3[C@H](C)CC[C@@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957899 1023475937 /nfs/dbraw/zinc/47/59/37/1023475937.db2.gz RLZMSMCAIJCYDB-MJBXVCDLSA-N 1 1 344.415 3.811 20 5 EHBDMO COCC[C@H](c1ccccc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000535822705 1023787133 /nfs/dbraw/zinc/78/71/33/1023787133.db2.gz PSQAVTCVVWMLOY-LJQANCHMSA-N 1 1 326.396 3.731 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H](C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000063308445 1033201344 /nfs/dbraw/zinc/20/13/44/1033201344.db2.gz XQXZAWKQNIDBOJ-NSHDSACASA-N 1 1 344.358 3.827 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614189 1024659192 /nfs/dbraw/zinc/65/91/92/1024659192.db2.gz QORSMNVXIGWMGJ-ZIAGYGMSSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614189 1024659202 /nfs/dbraw/zinc/65/92/02/1024659202.db2.gz QORSMNVXIGWMGJ-ZIAGYGMSSA-N 1 1 330.384 3.854 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310338873 1024849379 /nfs/dbraw/zinc/84/93/79/1024849379.db2.gz CGQRSWDKDLUIQU-QGZVFWFLSA-N 1 1 325.412 3.837 20 5 EHBDMO CC(C)c1[nH+]ccn1CCNc1ncc([N+](=O)[O-])c2ccccc12 ZINC000895988995 1025046629 /nfs/dbraw/zinc/04/66/29/1025046629.db2.gz IEAORFYYNIMJQK-UHFFFAOYSA-N 1 1 325.372 3.575 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000185457957 1025119912 /nfs/dbraw/zinc/11/99/12/1025119912.db2.gz DAPOMNZMZFLLAT-ZDUSSCGKSA-N 1 1 349.431 3.674 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)cc1[N+](=O)[O-] ZINC000521083815 1025193030 /nfs/dbraw/zinc/19/30/30/1025193030.db2.gz XCKFYDNRMLBWTC-IBGZPJMESA-N 1 1 334.460 3.949 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000119819467 1025267569 /nfs/dbraw/zinc/26/75/69/1025267569.db2.gz MZLDCUQMVJTIIJ-OAHLLOKOSA-N 1 1 348.447 3.550 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(CO)CC1 ZINC000515557202 1025352383 /nfs/dbraw/zinc/35/23/83/1025352383.db2.gz UIOGPLBIZOTJMD-UHFFFAOYSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000135 1025381498 /nfs/dbraw/zinc/38/14/98/1025381498.db2.gz WDUWNJURNCTRCJ-XCLNPWKQSA-N 1 1 346.471 3.789 20 5 EHBDMO Cc1c(C[N@H+](C)Cc2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000051476269 1025473992 /nfs/dbraw/zinc/47/39/92/1025473992.db2.gz YFURXSXEWYKLQW-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO Cc1c(C[N@@H+](C)Cc2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000051476269 1025473997 /nfs/dbraw/zinc/47/39/97/1025473997.db2.gz YFURXSXEWYKLQW-UHFFFAOYSA-N 1 1 336.395 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c(Cl)c1 ZINC000934332848 1025483961 /nfs/dbraw/zinc/48/39/61/1025483961.db2.gz MDKXFJSKDUIWGR-NSHDSACASA-N 1 1 337.832 3.769 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)C1 ZINC000338747786 1026178789 /nfs/dbraw/zinc/17/87/89/1026178789.db2.gz VAJZKJMYIIKJPS-OAHLLOKOSA-N 1 1 343.349 3.536 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000475150856 1026255918 /nfs/dbraw/zinc/25/59/18/1026255918.db2.gz KWNQTXFVBNBOMB-LJQANCHMSA-N 1 1 328.412 3.593 20 5 EHBDMO Cc1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)c(N2CCCC2)[nH+]1 ZINC000302069407 1026311501 /nfs/dbraw/zinc/31/15/01/1026311501.db2.gz XMCLOQDEHYLQAZ-UHFFFAOYSA-N 1 1 348.353 3.789 20 5 EHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000475289815 1026446569 /nfs/dbraw/zinc/44/65/69/1026446569.db2.gz DRFHGDJKNPVPDK-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CCN(CC)[C@H](C)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475356532 1026510220 /nfs/dbraw/zinc/51/02/20/1026510220.db2.gz ZMYKMRKJASMWQK-CQSZACIVSA-N 1 1 331.416 3.675 20 5 EHBDMO CC(=O)c1ccc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318100 1026580969 /nfs/dbraw/zinc/58/09/69/1026580969.db2.gz RKXZWMLXMKUJCN-CQSZACIVSA-N 1 1 341.411 3.730 20 5 EHBDMO Cc1cc(Nc2ccc([N+](=O)[O-])nc2)c[nH+]c1N1CCCC[C@H]1C ZINC000503277898 1027700634 /nfs/dbraw/zinc/70/06/34/1027700634.db2.gz ZSFYUFGNKUMSTL-CYBMUJFWSA-N 1 1 327.388 3.816 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000347332007 1027724985 /nfs/dbraw/zinc/72/49/85/1027724985.db2.gz IPPGQLARFYNDTN-DOTOQJQBSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1 ZINC000347332007 1027725002 /nfs/dbraw/zinc/72/50/02/1027725002.db2.gz IPPGQLARFYNDTN-DOTOQJQBSA-N 1 1 344.436 3.596 20 5 EHBDMO [NH3+][C@H]1C[C@@H](NCCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036617 1028143811 /nfs/dbraw/zinc/14/38/11/1028143811.db2.gz ATJNWJJHZIOVDD-JKSUJKDBSA-N 1 1 331.803 3.525 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(F)c(C)c2)c([N+](=O)[O-])c1 ZINC000444739467 1028226623 /nfs/dbraw/zinc/22/66/23/1028226623.db2.gz RSMQBVRLWQWGHY-UHFFFAOYSA-N 1 1 348.374 3.562 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](CCO)CC2)o1 ZINC000421391202 1028366315 /nfs/dbraw/zinc/36/63/15/1028366315.db2.gz AANQSGQXYLPFKY-HNNXBMFYSA-N 1 1 344.411 3.839 20 5 EHBDMO O=[N+]([O-])c1cccc(SCc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC000421833743 1028823307 /nfs/dbraw/zinc/82/33/07/1028823307.db2.gz BAPCKZQZEMYKNS-UHFFFAOYSA-N 1 1 344.436 3.719 20 5 EHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000524236645 1029014976 /nfs/dbraw/zinc/01/49/76/1029014976.db2.gz YZWNNPKZDZPTHA-LBPRGKRZSA-N 1 1 326.828 3.710 20 5 EHBDMO C[C@H]1CCSCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819312 1029028560 /nfs/dbraw/zinc/02/85/60/1029028560.db2.gz KZUZSGRDVWVGFU-JTQLQIEISA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819312 1029028577 /nfs/dbraw/zinc/02/85/77/1029028577.db2.gz KZUZSGRDVWVGFU-JTQLQIEISA-N 1 1 332.372 3.524 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923543 1029108748 /nfs/dbraw/zinc/10/87/48/1029108748.db2.gz BKHPYAMWTHGORM-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000614923543 1029108756 /nfs/dbraw/zinc/10/87/56/1029108756.db2.gz BKHPYAMWTHGORM-RISCZKNCSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CC(C)C)C1CCCC1 ZINC000533254748 1029534089 /nfs/dbraw/zinc/53/40/89/1029534089.db2.gz BOGUALFFKPREFA-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000533263476 1029563893 /nfs/dbraw/zinc/56/38/93/1029563893.db2.gz HVAQPCMSVJZZHV-HUUCEWRRSA-N 1 1 341.411 3.657 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])s2)[C@@H]1c1cccs1 ZINC000192464436 1029674899 /nfs/dbraw/zinc/67/48/99/1029674899.db2.gz DFJGXVDATKCAFT-ZWNOBZJWSA-N 1 1 338.458 3.608 20 5 EHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271802 1029767492 /nfs/dbraw/zinc/76/74/92/1029767492.db2.gz RUVNFWYNTYLZFP-IBGZPJMESA-N 1 1 325.412 3.998 20 5 EHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000441190317 1029916852 /nfs/dbraw/zinc/91/68/52/1029916852.db2.gz RKPGYEMODUMNJM-HNNXBMFYSA-N 1 1 348.424 3.881 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](CCCc3ccccc3)C2)n1 ZINC000441221586 1030011425 /nfs/dbraw/zinc/01/14/25/1030011425.db2.gz AIBBNIOIHWYCCE-SFHVURJKSA-N 1 1 342.443 3.526 20 5 EHBDMO COc1cc(C[NH+]2[C@H](C)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000525996556 1030292615 /nfs/dbraw/zinc/29/26/15/1030292615.db2.gz CXGIVQKTJJOELU-NXEZZACHSA-N 1 1 348.321 3.527 20 5 EHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1CCCC1 ZINC000064021343 1030397091 /nfs/dbraw/zinc/39/70/91/1030397091.db2.gz LYOBQJFISICCKL-LLVKDONJSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000343480812 1031060627 /nfs/dbraw/zinc/06/06/27/1031060627.db2.gz ZWIBCAIETKYGFA-AWEZNQCLSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(C2CC2)nc1 ZINC000459302631 1031377074 /nfs/dbraw/zinc/37/70/74/1031377074.db2.gz NJIJRRRYZGSKQC-UHFFFAOYSA-N 1 1 326.400 3.673 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(C2CC2)nc1 ZINC000459302631 1031377088 /nfs/dbraw/zinc/37/70/88/1031377088.db2.gz NJIJRRRYZGSKQC-UHFFFAOYSA-N 1 1 326.400 3.673 20 5 EHBDMO CC(C)Oc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278604999 1031604397 /nfs/dbraw/zinc/60/43/97/1031604397.db2.gz GAKJHYQMOLEYSA-UHFFFAOYSA-N 1 1 340.383 3.548 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737336 1031720057 /nfs/dbraw/zinc/72/00/57/1031720057.db2.gz CLQCLWLIKHFSAP-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000475737336 1031720071 /nfs/dbraw/zinc/72/00/71/1031720071.db2.gz CLQCLWLIKHFSAP-GRYCIOLGSA-N 1 1 339.823 3.553 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365245 1031902114 /nfs/dbraw/zinc/90/21/14/1031902114.db2.gz SZUBITLGGQRBPE-RCBBPTIPSA-N 1 1 342.399 3.569 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898067667 1033310707 /nfs/dbraw/zinc/31/07/07/1033310707.db2.gz HGHGPALUTAZFCT-AWEZNQCLSA-N 1 1 331.441 3.733 20 5 EHBDMO CCOc1cncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000598674994 1033391454 /nfs/dbraw/zinc/39/14/54/1033391454.db2.gz BRYXSGJKSNZOLS-KRWDZBQOSA-N 1 1 341.411 3.768 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)n1cc(C[N@@H+](C)C2CCCCC2)nn1 ZINC000603185809 1033424871 /nfs/dbraw/zinc/42/48/71/1033424871.db2.gz NPYSGVIYFRXQIF-AWEZNQCLSA-N 1 1 343.431 3.560 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC2(CC1)C(F)(F)C2(F)F ZINC000593659616 1033635486 /nfs/dbraw/zinc/63/54/86/1033635486.db2.gz WYKRJOHEBFZSPG-HWKANZROSA-N 1 1 344.308 3.974 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000595040487 1033661538 /nfs/dbraw/zinc/66/15/38/1033661538.db2.gz LJURFBSCEGBZMU-ZBEGNZNMSA-N 1 1 346.358 3.917 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000595085646 1033698299 /nfs/dbraw/zinc/69/82/99/1033698299.db2.gz SPLNLFYTVABTAP-GTNSWQLSSA-N 1 1 328.368 3.647 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000599064279 1033703905 /nfs/dbraw/zinc/70/39/05/1033703905.db2.gz LXEGXCNRDGFZFE-YJBOKZPZSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599064279 1033703919 /nfs/dbraw/zinc/70/39/19/1033703919.db2.gz LXEGXCNRDGFZFE-YJBOKZPZSA-N 1 1 329.444 3.579 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000595330988 1033729330 /nfs/dbraw/zinc/72/93/30/1033729330.db2.gz GXUWIPXFDQODRF-GOEBONIOSA-N 1 1 329.400 3.907 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000595340931 1033731596 /nfs/dbraw/zinc/73/15/96/1033731596.db2.gz ZFYGJECLAFRVSL-GOSISDBHSA-N 1 1 344.386 3.568 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000595321762 1033740264 /nfs/dbraw/zinc/74/02/64/1033740264.db2.gz ZABRQSYLWHHHRS-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000595321762 1033740279 /nfs/dbraw/zinc/74/02/79/1033740279.db2.gz ZABRQSYLWHHHRS-UHFFFAOYSA-N 1 1 330.359 3.852 20 5 EHBDMO CC(=O)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599126248 1033744956 /nfs/dbraw/zinc/74/49/56/1033744956.db2.gz FERUDIXYDRCYLP-INIZCTEOSA-N 1 1 331.416 3.616 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000595467665 1033822178 /nfs/dbraw/zinc/82/21/78/1033822178.db2.gz SPTZADJTEBLXAR-LZLYRXPVSA-N 1 1 336.407 3.640 20 5 EHBDMO CC(C)N1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000061309949 1033980583 /nfs/dbraw/zinc/98/05/83/1033980583.db2.gz OQWLTKNYPDIOPM-UHFFFAOYSA-N 1 1 345.468 3.849 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC000603859173 1033982754 /nfs/dbraw/zinc/98/27/54/1033982754.db2.gz JCGKWRKYHIIEFE-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]([C@@H]4CCCCO4)C3)nc2c1 ZINC000595788870 1033998969 /nfs/dbraw/zinc/99/89/69/1033998969.db2.gz KLCBQPZGWDYROW-BBRMVZONSA-N 1 1 345.399 3.517 20 5 EHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CCc2ccccc21 ZINC000595881793 1034017740 /nfs/dbraw/zinc/01/77/40/1034017740.db2.gz WSSMANCLKGFVCX-AWEZNQCLSA-N 1 1 337.379 3.898 20 5 EHBDMO COc1cc(N2CCC[N@H+](C(C)(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596097527 1034060216 /nfs/dbraw/zinc/06/02/16/1034060216.db2.gz YRRJXODWJRFGRR-UHFFFAOYSA-N 1 1 341.839 3.567 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688047 1034114924 /nfs/dbraw/zinc/11/49/24/1034114924.db2.gz BNGUZGQGSJRJAW-PYLYLYNFSA-N 1 1 342.399 3.823 20 5 EHBDMO Cc1cc(N2CCC(Oc3cc[nH+]cc3C)CC2)c([N+](=O)[O-])s1 ZINC000596213808 1034119621 /nfs/dbraw/zinc/11/96/21/1034119621.db2.gz HCYBYPGXQQQBIT-UHFFFAOYSA-N 1 1 333.413 3.716 20 5 EHBDMO COc1cc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596308839 1034165989 /nfs/dbraw/zinc/16/59/89/1034165989.db2.gz WMXKRKQTIDMZNB-NSHDSACASA-N 1 1 341.839 3.789 20 5 EHBDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620060 1034196523 /nfs/dbraw/zinc/19/65/23/1034196523.db2.gz OTKPILRHYDIZJA-OAHLLOKOSA-N 1 1 328.412 3.914 20 5 EHBDMO C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000534270985 1034333437 /nfs/dbraw/zinc/33/34/37/1034333437.db2.gz KHFSMFYMFUGRCN-LJQANCHMSA-N 1 1 348.406 3.636 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411282934 1034851413 /nfs/dbraw/zinc/85/14/13/1034851413.db2.gz JYDPLLREBZSANA-CQSZACIVSA-N 1 1 349.431 3.587 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492510718 1035921426 /nfs/dbraw/zinc/92/14/26/1035921426.db2.gz HYUZUTOLYGEGJX-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](C)c2cccs2)c1 ZINC000589496329 1036440436 /nfs/dbraw/zinc/44/04/36/1036440436.db2.gz NSWFPBVGQAAJBM-NSHDSACASA-N 1 1 334.397 3.636 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)c2cccs2)c1 ZINC000589496329 1036440441 /nfs/dbraw/zinc/44/04/41/1036440441.db2.gz NSWFPBVGQAAJBM-NSHDSACASA-N 1 1 334.397 3.636 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1NC[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000310892210 1036694337 /nfs/dbraw/zinc/69/43/37/1036694337.db2.gz KXYIFINVRKEYLD-IBGZPJMESA-N 1 1 340.427 3.622 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761512792 1037086383 /nfs/dbraw/zinc/08/63/83/1037086383.db2.gz XECGQDBPGNRQBR-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1CCCC[C@@H]1C ZINC000761520404 1037097553 /nfs/dbraw/zinc/09/75/53/1037097553.db2.gz FAYVCUCMLRBQLX-QWHCGFSZSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N1CCCC[C@@H]1C ZINC000761520404 1037097573 /nfs/dbraw/zinc/09/75/73/1037097573.db2.gz FAYVCUCMLRBQLX-QWHCGFSZSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000180842872 1037259641 /nfs/dbraw/zinc/25/96/41/1037259641.db2.gz YRBBPGRTLSUWMZ-CYBMUJFWSA-N 1 1 340.358 3.770 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)o1 ZINC000539891719 1037315733 /nfs/dbraw/zinc/31/57/33/1037315733.db2.gz ZJAGFPLPTUJVIX-WMLDXEAASA-N 1 1 342.395 3.856 20 5 EHBDMO C[C@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@H+]1C1CC1 ZINC000177185160 1037410534 /nfs/dbraw/zinc/41/05/34/1037410534.db2.gz CRTWYUFDTRZXTO-GOEBONIOSA-N 1 1 345.446 3.743 20 5 EHBDMO CC[N@H+]1CCC[C@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423959 1037451164 /nfs/dbraw/zinc/45/11/64/1037451164.db2.gz QGJNIIPLHOMHMM-VQTJNVASSA-N 1 1 339.439 3.758 20 5 EHBDMO CCN1CCC[C@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423959 1037451166 /nfs/dbraw/zinc/45/11/66/1037451166.db2.gz QGJNIIPLHOMHMM-VQTJNVASSA-N 1 1 339.439 3.758 20 5 EHBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789392 1037536765 /nfs/dbraw/zinc/53/67/65/1037536765.db2.gz MCQOUCOXQPPUKP-GLJUWKHASA-N 1 1 344.411 3.836 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000491667716 1037627376 /nfs/dbraw/zinc/62/73/76/1037627376.db2.gz LRYZGDJTHCYKGE-INIZCTEOSA-N 1 1 347.440 3.999 20 5 EHBDMO COc1ccc([C@H](NCc2cc([O-])ccc2[N+](=O)[O-])C(C)C)cc1 ZINC000549927867 1037641785 /nfs/dbraw/zinc/64/17/85/1037641785.db2.gz HPAZZDGTMCUDGJ-GOSISDBHSA-N 1 1 330.384 3.796 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000341220459 1037784767 /nfs/dbraw/zinc/78/47/67/1037784767.db2.gz NDARNKACNAVDPM-LLVKDONJSA-N 1 1 327.340 3.595 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000595296304 1037955628 /nfs/dbraw/zinc/95/56/28/1037955628.db2.gz ZRPKGWABZNXCHB-ZDUSSCGKSA-N 1 1 335.791 3.752 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1SC ZINC000058528708 1038073816 /nfs/dbraw/zinc/07/38/16/1038073816.db2.gz XJJAKAKZTPJCRA-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1SC ZINC000058528708 1038073839 /nfs/dbraw/zinc/07/38/39/1038073839.db2.gz XJJAKAKZTPJCRA-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104673458 1038451333 /nfs/dbraw/zinc/45/13/33/1038451333.db2.gz GLUFCWJTGIKWFU-CQSZACIVSA-N 1 1 329.400 3.914 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000538703346 1038476999 /nfs/dbraw/zinc/47/69/99/1038476999.db2.gz CHGRVUMKJLFKTJ-AWEZNQCLSA-N 1 1 342.395 3.867 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000549424132 1038522018 /nfs/dbraw/zinc/52/20/18/1038522018.db2.gz AGOXOXJZAQVCDL-UHFFFAOYSA-N 1 1 348.443 3.847 20 5 EHBDMO Cc1cc(N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461730021 1038589852 /nfs/dbraw/zinc/58/98/52/1038589852.db2.gz JRYHDNXUQMOLHJ-GOSISDBHSA-N 1 1 329.375 3.535 20 5 EHBDMO Cc1cc(N2CC[N@H+](C)C[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461730021 1038589864 /nfs/dbraw/zinc/58/98/64/1038589864.db2.gz JRYHDNXUQMOLHJ-GOSISDBHSA-N 1 1 329.375 3.535 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1cc(C)c([N+](=O)[O-])cc1F ZINC000461943754 1038676733 /nfs/dbraw/zinc/67/67/33/1038676733.db2.gz TWCPYNFCIIVRGW-UHFFFAOYSA-N 1 1 334.395 3.718 20 5 EHBDMO Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)[nH+]c1 ZINC000078305479 1038722829 /nfs/dbraw/zinc/72/28/29/1038722829.db2.gz XAPVVUCIEDCLHP-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000500478120 1038791051 /nfs/dbraw/zinc/79/10/51/1038791051.db2.gz FYLCSDRKEADSSL-LBPRGKRZSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000500478120 1038791066 /nfs/dbraw/zinc/79/10/66/1038791066.db2.gz FYLCSDRKEADSSL-LBPRGKRZSA-N 1 1 339.823 3.697 20 5 EHBDMO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000539376788 1038866815 /nfs/dbraw/zinc/86/68/15/1038866815.db2.gz KJOHZKHXLZVPRC-KBPBESRZSA-N 1 1 341.411 3.835 20 5 EHBDMO CC[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000015308944 1039105682 /nfs/dbraw/zinc/10/56/82/1039105682.db2.gz BHXYZDZYWVRGKN-UHFFFAOYSA-N 1 1 334.397 3.545 20 5 EHBDMO CC[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000015308944 1039105693 /nfs/dbraw/zinc/10/56/93/1039105693.db2.gz BHXYZDZYWVRGKN-UHFFFAOYSA-N 1 1 334.397 3.545 20 5 EHBDMO C[N@@H+](CCNc1ccc2ncccc2c1[N+](=O)[O-])C1CCCCC1 ZINC000480483740 1039587589 /nfs/dbraw/zinc/58/75/89/1039587589.db2.gz NJYBOOMTRWVWFR-UHFFFAOYSA-N 1 1 328.416 3.819 20 5 EHBDMO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349285 1039701174 /nfs/dbraw/zinc/70/11/74/1039701174.db2.gz KOAYLJNKVCKFEV-SUMWQHHRSA-N 1 1 328.416 3.930 20 5 EHBDMO CC(=O)c1cc(NC[C@@H]2CCCC[N@@H+]2CC(C)C)ccc1[N+](=O)[O-] ZINC000553506518 1040132723 /nfs/dbraw/zinc/13/27/23/1040132723.db2.gz CQGUTUMOCDJUQP-INIZCTEOSA-N 1 1 333.432 3.720 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000486805190 1040474029 /nfs/dbraw/zinc/47/40/29/1040474029.db2.gz YWIPFGDGGREUQI-OAHLLOKOSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)c(F)c1 ZINC000490376008 1040530953 /nfs/dbraw/zinc/53/09/53/1040530953.db2.gz VVPSSOWETBSLDK-LJQANCHMSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)c(F)c1 ZINC000490376008 1040530975 /nfs/dbraw/zinc/53/09/75/1040530975.db2.gz VVPSSOWETBSLDK-LJQANCHMSA-N 1 1 344.386 3.606 20 5 EHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@H]1O ZINC000555420388 1040557225 /nfs/dbraw/zinc/55/72/25/1040557225.db2.gz GXVWRWVKWOIUED-XHDPSFHLSA-N 1 1 346.349 3.597 20 5 EHBDMO CCn1nccc1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000278830253 1040613452 /nfs/dbraw/zinc/61/34/52/1040613452.db2.gz IHYFMOCJAUELIN-UHFFFAOYSA-N 1 1 348.834 3.844 20 5 EHBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593286 1040620846 /nfs/dbraw/zinc/62/08/46/1040620846.db2.gz VJJPCHYUCBINMU-XIKOKIGWSA-N 1 1 330.359 3.558 20 5 EHBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593286 1040620848 /nfs/dbraw/zinc/62/08/48/1040620848.db2.gz VJJPCHYUCBINMU-XIKOKIGWSA-N 1 1 330.359 3.558 20 5 EHBDMO O[C@@H]1CC[N@H+](Cc2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211789159 1040890603 /nfs/dbraw/zinc/89/06/03/1040890603.db2.gz HSLXGUSIXJILFO-OAHLLOKOSA-N 1 1 345.402 3.610 20 5 EHBDMO O[C@@H]1CC[N@@H+](Cc2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211789159 1040890619 /nfs/dbraw/zinc/89/06/19/1040890619.db2.gz HSLXGUSIXJILFO-OAHLLOKOSA-N 1 1 345.402 3.610 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854519 1041241848 /nfs/dbraw/zinc/24/18/48/1041241848.db2.gz QCVNWMDOXGJSKO-CQSZACIVSA-N 1 1 342.395 3.697 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C(C)(C)c1ccccc1 ZINC000585754533 1043024813 /nfs/dbraw/zinc/02/48/13/1043024813.db2.gz QJWBLISGUBEADL-UHFFFAOYSA-N 1 1 341.411 3.709 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@H](c4ccccc4)C3)c2)cc1 ZINC000728899653 1043716115 /nfs/dbraw/zinc/71/61/15/1043716115.db2.gz KJHDMFZDWITBAS-SFHVURJKSA-N 1 1 348.406 3.905 20 5 EHBDMO O=c1cc(C[N@H+]2CCC3(C2)CCOCC3)c2c(ccc3ccccc32)o1 ZINC000072898870 1126917039 /nfs/dbraw/zinc/91/70/39/1126917039.db2.gz BUFVMITTWJKEPB-UHFFFAOYSA-N 1 1 349.430 3.949 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@@H+]1CCc2ccccc2C1 ZINC000301283645 1127729647 /nfs/dbraw/zinc/72/96/47/1127729647.db2.gz PLLCCRPPRQEKQR-GFCCVEGCSA-N 1 1 346.818 3.502 20 5 EHBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@H+]1CCc2ccccc2C1 ZINC000301283645 1127729650 /nfs/dbraw/zinc/72/96/50/1127729650.db2.gz PLLCCRPPRQEKQR-GFCCVEGCSA-N 1 1 346.818 3.502 20 5 EHBDMO C[C@H]1C[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301398460 1127740808 /nfs/dbraw/zinc/74/08/08/1127740808.db2.gz ARWFIRQVVHLYJM-CMPLNLGQSA-N 1 1 331.338 3.533 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)c1OC ZINC000347590377 1128125137 /nfs/dbraw/zinc/12/51/37/1128125137.db2.gz OCOOFLKAAMWEGP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)c1OC ZINC000347590377 1128125141 /nfs/dbraw/zinc/12/51/41/1128125141.db2.gz OCOOFLKAAMWEGP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H]1c1cccs1 ZINC000301580676 1128499606 /nfs/dbraw/zinc/49/96/06/1128499606.db2.gz LERXKDZRKKMYGP-DOMZBBRYSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000301580676 1128499609 /nfs/dbraw/zinc/49/96/09/1128499609.db2.gz LERXKDZRKKMYGP-DOMZBBRYSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@@H+](C)C1CC1 ZINC000057707640 1128661757 /nfs/dbraw/zinc/66/17/57/1128661757.db2.gz FAIMQMJLLYBQMJ-AWEZNQCLSA-N 1 1 333.435 3.601 20 5 EHBDMO COC(=O)c1oc([C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847836 1128717043 /nfs/dbraw/zinc/71/70/43/1128717043.db2.gz GDQKFPSWKAVNOK-CYBMUJFWSA-N 1 1 346.383 3.518 20 5 EHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1c(F)cccc1[N+](=O)[O-] ZINC000338718135 1128748863 /nfs/dbraw/zinc/74/88/63/1128748863.db2.gz PSGJNSFSSZHRCD-UHFFFAOYSA-N 1 1 326.331 3.840 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673405 1128898261 /nfs/dbraw/zinc/89/82/61/1128898261.db2.gz RJWAONUPVYSHLT-YOEHRIQHSA-N 1 1 340.427 3.763 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000252212274 1120819372 /nfs/dbraw/zinc/81/93/72/1120819372.db2.gz WRRBBFCFKMLGID-AEFFLSMTSA-N 1 1 331.460 3.681 20 5 EHBDMO C[C@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272380207 1121597830 /nfs/dbraw/zinc/59/78/30/1121597830.db2.gz BRNLJXUGSOIIOA-QFBILLFUSA-N 1 1 339.439 3.595 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000301735107 1129014444 /nfs/dbraw/zinc/01/44/44/1129014444.db2.gz ZPKKDYFANIYQHD-WCQYABFASA-N 1 1 343.349 3.534 20 5 EHBDMO CC(=O)c1c(NC[C@@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000763206894 1121875091 /nfs/dbraw/zinc/87/50/91/1121875091.db2.gz NNILMQMFLGFBHL-INIZCTEOSA-N 1 1 343.383 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)cc1 ZINC000301119805 1121948796 /nfs/dbraw/zinc/94/87/96/1121948796.db2.gz ZJFIIBJPEQUHHC-UHFFFAOYSA-N 1 1 347.365 3.950 20 5 EHBDMO CC(=O)c1ccc(NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301111355 1121964849 /nfs/dbraw/zinc/96/48/49/1121964849.db2.gz RMMYBHUUNGWJCV-OKILXGFUSA-N 1 1 333.432 3.577 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000301153165 1122166791 /nfs/dbraw/zinc/16/67/91/1122166791.db2.gz DYHKDVFPVCYXST-UHFFFAOYSA-N 1 1 336.395 3.803 20 5 EHBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154170864 1122343684 /nfs/dbraw/zinc/34/36/84/1122343684.db2.gz HEUKEVXIPHZVNU-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1ccc(F)cc1Cl)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154170864 1122343687 /nfs/dbraw/zinc/34/36/87/1122343687.db2.gz HEUKEVXIPHZVNU-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCC[C@@H]1O ZINC000497144533 1122351336 /nfs/dbraw/zinc/35/13/36/1122351336.db2.gz KMWNSQBAZLRDGV-YJBOKZPZSA-N 1 1 344.411 3.838 20 5 EHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000065958746 1129115487 /nfs/dbraw/zinc/11/54/87/1129115487.db2.gz CMIXAUDSMNPHAB-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO O=[N+]([O-])c1c(N[C@@H]2CC[N@H+](C3CCCC3)C2)ccc2ncccc21 ZINC000301235808 1123602311 /nfs/dbraw/zinc/60/23/11/1123602311.db2.gz LTGRFQPKRPTWTE-CYBMUJFWSA-N 1 1 326.400 3.572 20 5 EHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609625623 1123628201 /nfs/dbraw/zinc/62/82/01/1123628201.db2.gz CXKDLVUASJAOFQ-QGZVFWFLSA-N 1 1 326.396 3.983 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000609672670 1123641645 /nfs/dbraw/zinc/64/16/45/1123641645.db2.gz WAOXMCXHAVGYLV-HOCLYGCPSA-N 1 1 326.396 3.981 20 5 EHBDMO C[C@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610003991 1123711565 /nfs/dbraw/zinc/71/15/65/1123711565.db2.gz WXJLZTDKVMKZEJ-ZDUSSCGKSA-N 1 1 330.359 3.732 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301886395 1129261991 /nfs/dbraw/zinc/26/19/91/1129261991.db2.gz QDLXAORJQGXZPF-HNNXBMFYSA-N 1 1 340.427 3.801 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+](CCCO)[C@H]2CCCc3ccccc32)cs1 ZINC000081549066 1129428024 /nfs/dbraw/zinc/42/80/24/1129428024.db2.gz ZDZIGQODDDUZTL-KRWDZBQOSA-N 1 1 346.452 3.918 20 5 EHBDMO CCc1nn(C)c(CC)c1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154301125 1129548247 /nfs/dbraw/zinc/54/82/47/1129548247.db2.gz JSYCHXYZQSHUQU-UHFFFAOYSA-N 1 1 342.443 3.618 20 5 EHBDMO CCc1nn(C)c(CC)c1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154301125 1129548248 /nfs/dbraw/zinc/54/82/48/1129548248.db2.gz JSYCHXYZQSHUQU-UHFFFAOYSA-N 1 1 342.443 3.618 20 5 EHBDMO C[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955481 1129593587 /nfs/dbraw/zinc/59/35/87/1129593587.db2.gz YJLYJYGKEMUJSL-BONVTDFDSA-N 1 1 338.766 3.772 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000155064278 1129610094 /nfs/dbraw/zinc/61/00/94/1129610094.db2.gz DKXCNFMJRDSZBC-HNNXBMFYSA-N 1 1 342.395 3.602 20 5 EHBDMO C[C@H]1C[C@@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000330631492 1129642211 /nfs/dbraw/zinc/64/22/11/1129642211.db2.gz POCOBDQWDGNPKD-STQMWFEESA-N 1 1 333.432 3.561 20 5 EHBDMO Cc1ccc(CNc2ccc(F)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302071790 1129766323 /nfs/dbraw/zinc/76/63/23/1129766323.db2.gz YVMJAOUXELVPIY-UHFFFAOYSA-N 1 1 330.363 3.650 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2cccs2)CC1 ZINC000028726036 1129820849 /nfs/dbraw/zinc/82/08/49/1129820849.db2.gz OPHBNYAYILKYHF-AWEZNQCLSA-N 1 1 331.441 3.535 20 5 EHBDMO CC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000030142122 1129913034 /nfs/dbraw/zinc/91/30/34/1129913034.db2.gz HRKGAWUOOAMQHH-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000030142122 1129913036 /nfs/dbraw/zinc/91/30/36/1129913036.db2.gz HRKGAWUOOAMQHH-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO CC(C)([NH2+]CC(=O)Nc1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000429232185 1130122991 /nfs/dbraw/zinc/12/29/91/1130122991.db2.gz ARGZVLRPLQOXJN-UHFFFAOYSA-N 1 1 347.802 3.712 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446253 1130208349 /nfs/dbraw/zinc/20/83/49/1130208349.db2.gz KZVOWUFJBFCTGU-VXGBXAGGSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1c(F)cccc1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446253 1130208354 /nfs/dbraw/zinc/20/83/54/1130208354.db2.gz KZVOWUFJBFCTGU-VXGBXAGGSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802489 1130414388 /nfs/dbraw/zinc/41/43/88/1130414388.db2.gz SUSAXAMKTUKPHK-STQMWFEESA-N 1 1 330.388 3.513 20 5 EHBDMO CC[NH+](CC)[C@H](C(=O)OCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000731908655 1130860159 /nfs/dbraw/zinc/86/01/59/1130860159.db2.gz OXOLYTHDUGOKDG-SFHVURJKSA-N 1 1 342.395 3.721 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc(C(F)F)c3)C2)nc1 ZINC000348061576 1131145713 /nfs/dbraw/zinc/14/57/13/1131145713.db2.gz TYYXWDPXRVDKHY-CQSZACIVSA-N 1 1 348.353 3.614 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905331 1131886931 /nfs/dbraw/zinc/88/69/31/1131886931.db2.gz RFKALELCSMBZLM-GDBMZVCRSA-N 1 1 342.361 3.911 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](OCc2ccccc2)C1 ZINC001173225454 1132006241 /nfs/dbraw/zinc/00/62/41/1132006241.db2.gz CGAYBEKHFCWWEH-JXFKEZNVSA-N 1 1 340.423 3.817 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]1COCc1ccccc1 ZINC001173225936 1132006817 /nfs/dbraw/zinc/00/68/17/1132006817.db2.gz GTJQWEGJIAHDJY-OXJNMPFZSA-N 1 1 340.423 3.817 20 5 EHBDMO C[C@H]([NH2+]Cc1nc(-c2ccncc2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000746046889 1132354666 /nfs/dbraw/zinc/35/46/66/1132354666.db2.gz GHZOWYHBKQGIKI-LBPRGKRZSA-N 1 1 340.408 3.964 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009703 1132631516 /nfs/dbraw/zinc/63/15/16/1132631516.db2.gz XHOMEXLSPXELQL-OALUTQOASA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037127 1132636651 /nfs/dbraw/zinc/63/66/51/1132636651.db2.gz JBPHTXISHRIDJD-UHOFOFEASA-N 1 1 340.876 3.875 20 5 EHBDMO CC(C)[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@H+]1C ZINC001175473735 1132676482 /nfs/dbraw/zinc/67/64/82/1132676482.db2.gz XGPJMNKQNFZMSY-CQSZACIVSA-N 1 1 346.258 3.674 20 5 EHBDMO CSC[C@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000767772813 1133051839 /nfs/dbraw/zinc/05/18/39/1133051839.db2.gz ZQESZQQYOAFHCC-LLVKDONJSA-N 1 1 339.442 3.657 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000767772813 1133051844 /nfs/dbraw/zinc/05/18/44/1133051844.db2.gz ZQESZQQYOAFHCC-LLVKDONJSA-N 1 1 339.442 3.657 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000768542363 1133153528 /nfs/dbraw/zinc/15/35/28/1133153528.db2.gz VOVFQTGBSGTCHM-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO CC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1OC ZINC000769767576 1133338782 /nfs/dbraw/zinc/33/87/82/1133338782.db2.gz XAZWJNIFZCITLX-AWEZNQCLSA-N 1 1 340.383 3.721 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954223 1133365224 /nfs/dbraw/zinc/36/52/24/1133365224.db2.gz QJRIHCWEQBEFPK-NQCMUKECSA-N 1 1 344.386 3.775 20 5 EHBDMO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839180 1133996431 /nfs/dbraw/zinc/99/64/31/1133996431.db2.gz DIWOTZCYRAENNB-ZIAGYGMSSA-N 1 1 328.416 3.675 20 5 EHBDMO C[C@@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001184839177 1133996773 /nfs/dbraw/zinc/99/67/73/1133996773.db2.gz DIWOTZCYRAENNB-KBPBESRZSA-N 1 1 328.416 3.675 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+](C/C=C\c3ccccc3)CC2)c1 ZINC001185116916 1134038116 /nfs/dbraw/zinc/03/81/16/1134038116.db2.gz NMBLKOSZAXZJKZ-YVMONPNESA-N 1 1 337.423 3.739 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC001185263140 1134058843 /nfs/dbraw/zinc/05/88/43/1134058843.db2.gz LXVIANAKTNOSBS-SFHVURJKSA-N 1 1 339.439 3.880 20 5 EHBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC001186626164 1134237889 /nfs/dbraw/zinc/23/78/89/1134237889.db2.gz FGFKTXMKUVWROY-ZDUSSCGKSA-N 1 1 346.406 3.937 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584988 1134299050 /nfs/dbraw/zinc/29/90/50/1134299050.db2.gz UKPYNFTYIXXTTK-MRXNPFEDSA-N 1 1 348.830 3.938 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000790081761 1134363858 /nfs/dbraw/zinc/36/38/58/1134363858.db2.gz NQANLHVSRZLALY-ZDUSSCGKSA-N 1 1 349.431 3.674 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1OC ZINC000792877162 1134811169 /nfs/dbraw/zinc/81/11/69/1134811169.db2.gz QCPZKBHJOASQTN-HNNXBMFYSA-N 1 1 345.355 3.753 20 5 EHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792924894 1134828560 /nfs/dbraw/zinc/82/85/60/1134828560.db2.gz JHSDZHXNVNOIIR-UHFFFAOYSA-N 1 1 329.356 3.870 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792924894 1134828563 /nfs/dbraw/zinc/82/85/63/1134828563.db2.gz JHSDZHXNVNOIIR-UHFFFAOYSA-N 1 1 329.356 3.870 20 5 EHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001191477519 1134870287 /nfs/dbraw/zinc/87/02/87/1134870287.db2.gz YKELYKGMQXSLFG-CQSZACIVSA-N 1 1 339.395 3.543 20 5 EHBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001195795708 1135470566 /nfs/dbraw/zinc/47/05/66/1135470566.db2.gz AJWWFPGEQATJEB-MRXNPFEDSA-N 1 1 348.443 3.990 20 5 EHBDMO COc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])cc1F ZINC001197647888 1135715872 /nfs/dbraw/zinc/71/58/72/1135715872.db2.gz WGMNZHAPWCXDCY-SNVBAGLBSA-N 1 1 349.318 3.502 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965234 1135904212 /nfs/dbraw/zinc/90/42/12/1135904212.db2.gz FUGYVOLCQFZBPS-LBPRGKRZSA-N 1 1 333.215 3.637 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965234 1135904213 /nfs/dbraw/zinc/90/42/13/1135904213.db2.gz FUGYVOLCQFZBPS-LBPRGKRZSA-N 1 1 333.215 3.637 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000776278236 1136133651 /nfs/dbraw/zinc/13/36/51/1136133651.db2.gz SNLZEMVLZFQEEO-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000776278236 1136133654 /nfs/dbraw/zinc/13/36/54/1136133654.db2.gz SNLZEMVLZFQEEO-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO CCCCC(N)=[NH+]OCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000814264653 1136429728 /nfs/dbraw/zinc/42/97/28/1136429728.db2.gz ABOBVRBLKJRUIQ-UHFFFAOYSA-N 1 1 330.182 3.546 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cccc(F)n3)o2)cc1 ZINC000747936256 1136443799 /nfs/dbraw/zinc/44/37/99/1136443799.db2.gz SGMCDKKIGGQVSW-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581322 1136444566 /nfs/dbraw/zinc/44/45/66/1136444566.db2.gz CLIOXAAXPCXIEO-MOPGFXCFSA-N 1 1 328.412 3.957 20 5 EHBDMO CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000776591401 1136453428 /nfs/dbraw/zinc/45/34/28/1136453428.db2.gz MECOHKIAHSLRCG-ROUUACIJSA-N 1 1 326.396 3.711 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000852759604 1136483951 /nfs/dbraw/zinc/48/39/51/1136483951.db2.gz QJTVHSLOYQVZGB-CALCHBBNSA-N 1 1 336.819 3.641 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000814641927 1136488332 /nfs/dbraw/zinc/48/83/32/1136488332.db2.gz MGISQZGIWNSWHZ-HNNXBMFYSA-N 1 1 341.367 3.883 20 5 EHBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000814667689 1136492371 /nfs/dbraw/zinc/49/23/71/1136492371.db2.gz VDVXLLXOYROSNY-CRAIPNDOSA-N 1 1 346.814 3.771 20 5 EHBDMO Cc1cc([NH+]2CCCC2)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819398978 1136936087 /nfs/dbraw/zinc/93/60/87/1136936087.db2.gz XJIXFKLGHJWUSX-LJQANCHMSA-N 1 1 341.411 3.649 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCc3cccc(Cl)c3C2)cc1 ZINC001171007695 1137087568 /nfs/dbraw/zinc/08/75/68/1137087568.db2.gz PEMVFADCVVLJQG-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCc3cccc(Cl)c3C2)cc1 ZINC001171007695 1137087569 /nfs/dbraw/zinc/08/75/69/1137087569.db2.gz PEMVFADCVVLJQG-UHFFFAOYSA-N 1 1 332.787 3.685 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC4(CC4(F)F)CC3)c2)c1 ZINC000844727434 1137248058 /nfs/dbraw/zinc/24/80/58/1137248058.db2.gz DRJAOYNSUGIGKX-UHFFFAOYSA-N 1 1 348.353 3.537 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@]4(CC4(F)F)C3)c2c1 ZINC000844755771 1137250157 /nfs/dbraw/zinc/25/01/57/1137250157.db2.gz GMHHHJJUOKRGBA-ZDUSSCGKSA-N 1 1 341.339 3.561 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@]4(CC4(F)F)C3)c2c1 ZINC000844755771 1137250158 /nfs/dbraw/zinc/25/01/58/1137250158.db2.gz GMHHHJJUOKRGBA-ZDUSSCGKSA-N 1 1 341.339 3.561 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC3(Br)CC3)C2)cc1 ZINC000846962410 1137379450 /nfs/dbraw/zinc/37/94/50/1137379450.db2.gz ZUVQQKSTCIJQSW-CYBMUJFWSA-N 1 1 339.233 3.702 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001171539019 1137494139 /nfs/dbraw/zinc/49/41/39/1137494139.db2.gz WIDPMFALOHEEEI-INIZCTEOSA-N 1 1 332.787 3.902 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001171539019 1137494140 /nfs/dbraw/zinc/49/41/40/1137494140.db2.gz WIDPMFALOHEEEI-INIZCTEOSA-N 1 1 332.787 3.902 20 5 EHBDMO C[C@@H](NC[C@H](c1ccsc1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017903 1137564760 /nfs/dbraw/zinc/56/47/60/1137564760.db2.gz GUWQZFMHHLPXOD-IAQYHMDHSA-N 1 1 337.420 3.749 20 5 EHBDMO C[C@H](NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086663 1137570576 /nfs/dbraw/zinc/57/05/76/1137570576.db2.gz BNHWWAMYWLCMDV-DZGCQCFKSA-N 1 1 335.423 3.507 20 5 EHBDMO COc1ccc([C@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C2CC2)cn1 ZINC000872090960 1137570791 /nfs/dbraw/zinc/57/07/91/1137570791.db2.gz GHBAGEIXHQUDTQ-ADLMAVQZSA-N 1 1 345.374 3.939 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC[C@H]1C=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000872107692 1137571495 /nfs/dbraw/zinc/57/14/95/1137571495.db2.gz QYEDLAMGXLZEBR-MAUKXSAKSA-N 1 1 340.427 3.754 20 5 EHBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842446 1137624622 /nfs/dbraw/zinc/62/46/22/1137624622.db2.gz HMSGIULCUUKMML-WOJBJXKFSA-N 1 1 345.446 3.697 20 5 EHBDMO CC(C)[N@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000876581675 1137656260 /nfs/dbraw/zinc/65/62/60/1137656260.db2.gz BWIWHBWEDXEXFT-UHFFFAOYSA-N 1 1 341.367 3.852 20 5 EHBDMO CC(C)[N@@H+](Cc1cc2c(cc[nH]c2=O)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000876581675 1137656261 /nfs/dbraw/zinc/65/62/61/1137656261.db2.gz BWIWHBWEDXEXFT-UHFFFAOYSA-N 1 1 341.367 3.852 20 5 EHBDMO C[NH+]1CCC2(CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)CC1 ZINC000877685041 1137685777 /nfs/dbraw/zinc/68/57/77/1137685777.db2.gz JCBOIVOKIMPSEL-UHFFFAOYSA-N 1 1 337.851 3.556 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+](CC2CC2)CC2CCC2)o1 ZINC000878544200 1137719495 /nfs/dbraw/zinc/71/94/95/1137719495.db2.gz NVKQQTOZYXQJBM-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1noc(C[N@@H+]2CCCSC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000880388120 1137777609 /nfs/dbraw/zinc/77/76/09/1137777609.db2.gz IDOBHHMYPLBJLS-CQSZACIVSA-N 1 1 333.413 3.571 20 5 EHBDMO Cc1noc(C[N@H+]2CCCSC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000880388120 1137777610 /nfs/dbraw/zinc/77/76/10/1137777610.db2.gz IDOBHHMYPLBJLS-CQSZACIVSA-N 1 1 333.413 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2ccc(F)cc2F)C2CC2)cc1 ZINC000130557162 1137839244 /nfs/dbraw/zinc/83/92/44/1137839244.db2.gz HYSFHKBOVBXGQV-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1c2ccccc2NC1(C)C ZINC000883462575 1137861195 /nfs/dbraw/zinc/86/11/95/1137861195.db2.gz URMWECJKMKXTLL-QGZVFWFLSA-N 1 1 327.384 3.638 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCc4ccccc4C3)o2)c1 ZINC000104661113 1137878931 /nfs/dbraw/zinc/87/89/31/1137878931.db2.gz QLNDYRJYVOCYDH-UHFFFAOYSA-N 1 1 349.390 3.851 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000885973469 1138029496 /nfs/dbraw/zinc/02/94/96/1138029496.db2.gz SXRSJVMZDUQPHW-WMZOPIPTSA-N 1 1 341.411 3.590 20 5 EHBDMO CCCOc1ccc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1OC ZINC000886106819 1138047331 /nfs/dbraw/zinc/04/73/31/1138047331.db2.gz DLIADILWJLQLPA-ZDUSSCGKSA-N 1 1 345.399 3.638 20 5 EHBDMO COC[C@H](C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886302814 1138065913 /nfs/dbraw/zinc/06/59/13/1138065913.db2.gz WYEPYRYQHWDJIV-KSSFIOAISA-N 1 1 341.411 3.514 20 5 EHBDMO COC[C@H](C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000886302814 1138065915 /nfs/dbraw/zinc/06/59/15/1138065915.db2.gz WYEPYRYQHWDJIV-KSSFIOAISA-N 1 1 341.411 3.514 20 5 EHBDMO C[C@H]1SCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1C ZINC000089902798 1138207504 /nfs/dbraw/zinc/20/75/04/1138207504.db2.gz LWRAYLOORGJUGR-VXGBXAGGSA-N 1 1 333.413 3.576 20 5 EHBDMO C[C@H]1SCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1C ZINC000089902798 1138207506 /nfs/dbraw/zinc/20/75/06/1138207506.db2.gz LWRAYLOORGJUGR-VXGBXAGGSA-N 1 1 333.413 3.576 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCCO1 ZINC000092427356 1138227651 /nfs/dbraw/zinc/22/76/51/1138227651.db2.gz XDOGJAGISOLXRM-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCCO1 ZINC000092427356 1138227653 /nfs/dbraw/zinc/22/76/53/1138227653.db2.gz XDOGJAGISOLXRM-INIZCTEOSA-N 1 1 347.440 3.719 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCSC1 ZINC000130489615 1138458015 /nfs/dbraw/zinc/45/80/15/1138458015.db2.gz IETNNCGKPUNESE-CQSZACIVSA-N 1 1 335.454 3.656 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCSC1 ZINC000130489615 1138458017 /nfs/dbraw/zinc/45/80/17/1138458017.db2.gz IETNNCGKPUNESE-CQSZACIVSA-N 1 1 335.454 3.656 20 5 EHBDMO C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130656186 1138467637 /nfs/dbraw/zinc/46/76/37/1138467637.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130656186 1138467639 /nfs/dbraw/zinc/46/76/39/1138467639.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130656186 1138467642 /nfs/dbraw/zinc/46/76/42/1138467642.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 1 1 343.427 3.769 20 5 EHBDMO CCCO[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177064655 1139595842 /nfs/dbraw/zinc/59/58/42/1139595842.db2.gz IQOLHRSGUBKRQP-CQSZACIVSA-N 1 1 333.388 3.517 20 5 EHBDMO CCCC(=O)NC[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736962 1139989243 /nfs/dbraw/zinc/98/92/43/1139989243.db2.gz ZFPVKUUNPBDOFW-JKSUJKDBSA-N 1 1 347.459 3.593 20 5 EHBDMO Cc1[nH+]ccn1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000268352257 1140925348 /nfs/dbraw/zinc/92/53/48/1140925348.db2.gz VEIGQXATALLANP-UHFFFAOYSA-N 1 1 342.218 3.655 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633877 1141130148 /nfs/dbraw/zinc/13/01/48/1141130148.db2.gz GNBCBKDESGSINQ-SJORKVTESA-N 1 1 330.384 3.839 20 5 EHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CCO2 ZINC000274240276 1141488406 /nfs/dbraw/zinc/48/84/06/1141488406.db2.gz HBNIRFDMQPZMIN-INIZCTEOSA-N 1 1 348.786 3.870 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CC=C(c3ccnn3C)CC2)cc1[N+](=O)[O-] ZINC000348639261 1141559409 /nfs/dbraw/zinc/55/94/09/1141559409.db2.gz YNDMRVJJWAEKLZ-UHFFFAOYSA-N 1 1 340.427 3.741 20 5 EHBDMO CC(C)c1ccc(C[N@@H+]2CC=C(c3ccnn3C)CC2)cc1[N+](=O)[O-] ZINC000348639261 1141559412 /nfs/dbraw/zinc/55/94/12/1141559412.db2.gz YNDMRVJJWAEKLZ-UHFFFAOYSA-N 1 1 340.427 3.741 20 5 EHBDMO CN(CCC[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccco1 ZINC000348819053 1141587182 /nfs/dbraw/zinc/58/71/82/1141587182.db2.gz VRAGQUXJJOLYPR-UITAMQMPSA-N 1 1 343.427 3.655 20 5 EHBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])CCC[N@H+](C)Cc1ccco1 ZINC000348819053 1141587186 /nfs/dbraw/zinc/58/71/86/1141587186.db2.gz VRAGQUXJJOLYPR-UITAMQMPSA-N 1 1 343.427 3.655 20 5 EHBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])CCC[N@@H+](C)Cc1ccco1 ZINC000348819053 1141587189 /nfs/dbraw/zinc/58/71/89/1141587189.db2.gz VRAGQUXJJOLYPR-UITAMQMPSA-N 1 1 343.427 3.655 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000055448938 214324403 /nfs/dbraw/zinc/32/44/03/214324403.db2.gz AETHVUGYKZYFNS-ZDUSSCGKSA-N 1 1 343.383 3.815 20 5 EHBDMO Cc1cc(NCc2ccccc2C[N@H+](C)C(C)C)ncc1[N+](=O)[O-] ZINC000074740897 1032214581 /nfs/dbraw/zinc/21/45/81/1032214581.db2.gz BDEUITYUIRQYBK-UHFFFAOYSA-N 1 1 328.416 3.751 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000157753347 1032347756 /nfs/dbraw/zinc/34/77/56/1032347756.db2.gz YOPMODCAYYCJJT-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO O=[N+]([O-])c1ccc(NCC[NH+]2Cc3ccccc3C2)cc1OC(F)F ZINC000610274652 1017273372 /nfs/dbraw/zinc/27/33/72/1017273372.db2.gz ZSJNLLFQEKMSIW-UHFFFAOYSA-N 1 1 349.337 3.624 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000340993064 1017396229 /nfs/dbraw/zinc/39/62/29/1017396229.db2.gz HNWRTLRIKNNNAF-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000340993064 1017396239 /nfs/dbraw/zinc/39/62/39/1017396239.db2.gz HNWRTLRIKNNNAF-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000449517447 1032708265 /nfs/dbraw/zinc/70/82/65/1032708265.db2.gz KFUMKZKARGBSIE-LRSLKPCPSA-N 1 1 342.439 3.889 20 5 EHBDMO C[N@@H+](CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCC1 ZINC000321670461 1018424926 /nfs/dbraw/zinc/42/49/26/1018424926.db2.gz UMJBALHJWDMUMP-UHFFFAOYSA-N 1 1 331.338 3.900 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000331175019 1018644389 /nfs/dbraw/zinc/64/43/89/1018644389.db2.gz PJUZZYCEIPSLEN-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000331175019 1018644394 /nfs/dbraw/zinc/64/43/94/1018644394.db2.gz PJUZZYCEIPSLEN-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1F ZINC000594019626 1032791283 /nfs/dbraw/zinc/79/12/83/1032791283.db2.gz PXUHUHAWJBBZPC-QGZVFWFLSA-N 1 1 346.358 3.841 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000052210054 1018869627 /nfs/dbraw/zinc/86/96/27/1018869627.db2.gz XEGOKKMQJRUAIK-UHFFFAOYSA-N 1 1 337.439 3.678 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](Oc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001225505376 1019452966 /nfs/dbraw/zinc/45/29/66/1019452966.db2.gz KSYIMZUPVAVYDS-GFCCVEGCSA-N 1 1 343.221 3.609 20 5 EHBDMO Cc1c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000326000042 1020667414 /nfs/dbraw/zinc/66/74/14/1020667414.db2.gz FPJKKVDKPRFDTG-QXAKKESOSA-N 1 1 332.444 3.809 20 5 EHBDMO CC(C)CC1CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000760399629 1032930296 /nfs/dbraw/zinc/93/02/96/1032930296.db2.gz YMKPMZPTOVKZDY-UHFFFAOYSA-N 1 1 343.431 3.569 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403173 1020767310 /nfs/dbraw/zinc/76/73/10/1020767310.db2.gz UDIOURXSBPUGRQ-RDTXWAMCSA-N 1 1 336.395 3.953 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000360875588 1020846719 /nfs/dbraw/zinc/84/67/19/1020846719.db2.gz XDGKIXCRSZLXRC-WMLDXEAASA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610505563 1020869112 /nfs/dbraw/zinc/86/91/12/1020869112.db2.gz PKUINJYQCACINJ-SFHVURJKSA-N 1 1 330.359 3.950 20 5 EHBDMO CC[N@@H+](CCOc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1 ZINC000051086032 1021116751 /nfs/dbraw/zinc/11/67/51/1021116751.db2.gz WYYCNTZEPOWULT-UHFFFAOYSA-N 1 1 330.384 3.504 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@H](C)O1 ZINC000438365681 1021358043 /nfs/dbraw/zinc/35/80/43/1021358043.db2.gz CUVSAQUJKCCMJB-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@H](C)O1 ZINC000438365681 1021358054 /nfs/dbraw/zinc/35/80/54/1021358054.db2.gz CUVSAQUJKCCMJB-RDBSUJKOSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000120878254 1021437246 /nfs/dbraw/zinc/43/72/46/1021437246.db2.gz SMIVESIBAYNJRX-SUMWQHHRSA-N 1 1 332.425 3.661 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccsc2)O1 ZINC000120878254 1021437256 /nfs/dbraw/zinc/43/72/56/1021437256.db2.gz SMIVESIBAYNJRX-SUMWQHHRSA-N 1 1 332.425 3.661 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1nc2ccccc2cc1[N+](=O)[O-] ZINC000276577470 1021885204 /nfs/dbraw/zinc/88/52/04/1021885204.db2.gz IDIWPGKPPBMFON-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468218 1033055132 /nfs/dbraw/zinc/05/51/32/1033055132.db2.gz UUHSYJINJVXCEZ-DGCLKSJQSA-N 1 1 339.823 3.697 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000602656826 1033056657 /nfs/dbraw/zinc/05/66/57/1033056657.db2.gz YNZXFUBVIRLZCU-HIFRSBDPSA-N 1 1 344.333 3.757 20 5 EHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226093 1022587587 /nfs/dbraw/zinc/58/75/87/1022587587.db2.gz WFRQDXZGIGODBT-QWHCGFSZSA-N 1 1 342.436 3.849 20 5 EHBDMO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266489131 1022666252 /nfs/dbraw/zinc/66/62/52/1022666252.db2.gz RUIDUSKUUNXZBS-CHWSQXEVSA-N 1 1 327.384 3.965 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C[NH+](CC)CC)CC1 ZINC000506862934 1022956884 /nfs/dbraw/zinc/95/68/84/1022956884.db2.gz UPXUSWLVKUDMRK-UHFFFAOYSA-N 1 1 349.475 3.547 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000248392859 1023015647 /nfs/dbraw/zinc/01/56/47/1023015647.db2.gz DKNFGLYDYGIMST-ZOBUZTSGSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@H](N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000248392859 1023015662 /nfs/dbraw/zinc/01/56/62/1023015662.db2.gz DKNFGLYDYGIMST-ZOBUZTSGSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000248392859 1023015666 /nfs/dbraw/zinc/01/56/66/1023015666.db2.gz DKNFGLYDYGIMST-ZOBUZTSGSA-N 1 1 331.460 3.898 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000507180880 1023165661 /nfs/dbraw/zinc/16/56/61/1023165661.db2.gz OSZLZQVJNGERBD-HNNXBMFYSA-N 1 1 326.396 3.901 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000507180881 1023165743 /nfs/dbraw/zinc/16/57/43/1023165743.db2.gz OSZLZQVJNGERBD-OAHLLOKOSA-N 1 1 326.396 3.901 20 5 EHBDMO CSC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000602724968 1033112274 /nfs/dbraw/zinc/11/22/74/1033112274.db2.gz GJUNPLFNXQAUHO-UHFFFAOYSA-N 1 1 332.372 3.524 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232557 /nfs/dbraw/zinc/23/25/57/1023232557.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 1 1 345.487 3.724 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000518374215 1023262300 /nfs/dbraw/zinc/26/23/00/1023262300.db2.gz TXNBCMSYFVRLIO-CYBMUJFWSA-N 1 1 346.818 3.526 20 5 EHBDMO COc1ccc(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000065208954 1023916349 /nfs/dbraw/zinc/91/63/49/1023916349.db2.gz ZBXRBUHLZKPNGF-UHFFFAOYSA-N 1 1 342.395 3.647 20 5 EHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000441640570 1024277129 /nfs/dbraw/zinc/27/71/29/1024277129.db2.gz ASHNKZOPIAWWTJ-INIZCTEOSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](c2ccccc2)[NH+](C)C)n1 ZINC000520655899 1024355758 /nfs/dbraw/zinc/35/57/58/1024355758.db2.gz ANYSPRNQMIDZRZ-INIZCTEOSA-N 1 1 338.367 3.604 20 5 EHBDMO CCc1ccc(C[N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000505601289 1024615823 /nfs/dbraw/zinc/61/58/23/1024615823.db2.gz DRWWELDTZFVLAX-UHFFFAOYSA-N 1 1 344.411 3.806 20 5 EHBDMO CCc1ccc(C[N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000505601289 1024615830 /nfs/dbraw/zinc/61/58/30/1024615830.db2.gz DRWWELDTZFVLAX-UHFFFAOYSA-N 1 1 344.411 3.806 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)c1cncs1 ZINC000934194397 1024644798 /nfs/dbraw/zinc/64/47/98/1024644798.db2.gz WQZKALFIHYTMAY-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1n1ccnc1 ZINC000248447538 1024684406 /nfs/dbraw/zinc/68/44/06/1024684406.db2.gz XDLMQMURFWXHGX-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1n1ccnc1 ZINC000248447538 1024684415 /nfs/dbraw/zinc/68/44/15/1024684415.db2.gz XDLMQMURFWXHGX-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO CCC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001167958631 1024771843 /nfs/dbraw/zinc/77/18/43/1024771843.db2.gz KQMBHQGZCRUYLR-GFCCVEGCSA-N 1 1 339.823 3.699 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000025424233 1024927902 /nfs/dbraw/zinc/92/79/02/1024927902.db2.gz MLAVLXUQLUPQKO-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H]1c1cccs1 ZINC000025424233 1024927911 /nfs/dbraw/zinc/92/79/11/1024927911.db2.gz MLAVLXUQLUPQKO-IUODEOHRSA-N 1 1 345.424 3.820 20 5 EHBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000185464397 1025148020 /nfs/dbraw/zinc/14/80/20/1025148020.db2.gz CPERTRVBBXUJEG-LBPRGKRZSA-N 1 1 337.470 3.597 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C2CC2)O1 ZINC000475291888 1026436913 /nfs/dbraw/zinc/43/69/13/1026436913.db2.gz QJWQXMRRUCFXRF-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C2CC2)O1 ZINC000475291888 1026436918 /nfs/dbraw/zinc/43/69/18/1026436918.db2.gz QJWQXMRRUCFXRF-YJYMSZOUSA-N 1 1 342.395 3.854 20 5 EHBDMO Cc1cccc([C@@H]2CCCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000472239346 1026889627 /nfs/dbraw/zinc/88/96/27/1026889627.db2.gz IHTKVTNXNINRMI-SFHVURJKSA-N 1 1 328.416 3.717 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531587374 1027077025 /nfs/dbraw/zinc/07/70/25/1027077025.db2.gz BLPDUFXNSJORRC-BEFAXECRSA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000531587374 1027077032 /nfs/dbraw/zinc/07/70/32/1027077032.db2.gz BLPDUFXNSJORRC-BEFAXECRSA-N 1 1 326.396 3.903 20 5 EHBDMO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CC[N@@H+](C)CC1 ZINC000272949628 1027192185 /nfs/dbraw/zinc/19/21/85/1027192185.db2.gz MRAIMZSQIOPHEJ-OAHLLOKOSA-N 1 1 345.446 3.768 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704610 1027345948 /nfs/dbraw/zinc/34/59/48/1027345948.db2.gz XSIABJYVBMFKRT-CJNGLKHVSA-N 1 1 330.384 3.590 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000302755987 1027454192 /nfs/dbraw/zinc/45/41/92/1027454192.db2.gz GDPGUKBJAMHOOU-OAHLLOKOSA-N 1 1 331.803 3.935 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccccc2SC)c1[N+](=O)[O-] ZINC000894251460 1027613954 /nfs/dbraw/zinc/61/39/54/1027613954.db2.gz LYRHFRCHTYMJHF-NSHDSACASA-N 1 1 348.424 3.882 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000420954100 1027917994 /nfs/dbraw/zinc/91/79/94/1027917994.db2.gz UGMQSGMJZKEDPF-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000420954100 1027918010 /nfs/dbraw/zinc/91/80/10/1027918010.db2.gz UGMQSGMJZKEDPF-GFCCVEGCSA-N 1 1 332.322 3.768 20 5 EHBDMO CCC[N@@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444684048 1028154887 /nfs/dbraw/zinc/15/48/87/1028154887.db2.gz KDCNKWCAJNRVTK-UHFFFAOYSA-N 1 1 344.440 3.987 20 5 EHBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc2[nH]ccc21 ZINC000444694280 1028170447 /nfs/dbraw/zinc/17/04/47/1028170447.db2.gz BPKOZORSBIJRFM-UHFFFAOYSA-N 1 1 335.367 3.584 20 5 EHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc2[nH]ccc21 ZINC000444694280 1028170452 /nfs/dbraw/zinc/17/04/52/1028170452.db2.gz BPKOZORSBIJRFM-UHFFFAOYSA-N 1 1 335.367 3.584 20 5 EHBDMO CCc1ccc([C@@H](N[C@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456738 1028448453 /nfs/dbraw/zinc/44/84/53/1028448453.db2.gz OEPGIVILPAXUCI-ACJLOTCBSA-N 1 1 331.416 3.557 20 5 EHBDMO CC(C)(C)OC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000162512953 1028917878 /nfs/dbraw/zinc/91/78/78/1028917878.db2.gz VTDYEPVFMWEFTK-UHFFFAOYSA-N 1 1 333.388 3.516 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630563 1028924608 /nfs/dbraw/zinc/92/46/08/1028924608.db2.gz GVUDRGNISXPOED-HNNXBMFYSA-N 1 1 334.416 3.719 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899740 1029042017 /nfs/dbraw/zinc/04/20/17/1029042017.db2.gz LISZDSVWIXGMLD-GOEBONIOSA-N 1 1 337.464 3.620 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)C3CCCC3)o2)cc1 ZINC000505276153 1029432704 /nfs/dbraw/zinc/43/27/04/1029432704.db2.gz AUBPHYUKLRRJLO-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122505 1029694987 /nfs/dbraw/zinc/69/49/87/1029694987.db2.gz IIDXBUDFIRTVRO-CYBMUJFWSA-N 1 1 349.456 3.994 20 5 EHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525409896 1029839705 /nfs/dbraw/zinc/83/97/05/1029839705.db2.gz WRJHQJGHRPQAEU-KZNAEPCWSA-N 1 1 332.444 3.663 20 5 EHBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890942 1029842292 /nfs/dbraw/zinc/84/22/92/1029842292.db2.gz RKEAYSJBNSWOIL-GXVATQTDSA-N 1 1 346.427 3.519 20 5 EHBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)n[nH]1 ZINC000447075158 1029922587 /nfs/dbraw/zinc/92/25/87/1029922587.db2.gz BNUCVAQRDRZPHC-VQHVLOKHSA-N 1 1 328.416 3.761 20 5 EHBDMO C[N@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cc(C(C)(C)C)n[nH]1 ZINC000447075158 1029922578 /nfs/dbraw/zinc/92/25/78/1029922578.db2.gz BNUCVAQRDRZPHC-VQHVLOKHSA-N 1 1 328.416 3.761 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000525634474 1029986158 /nfs/dbraw/zinc/98/61/58/1029986158.db2.gz WYMAJKACHXSDHN-QGZVFWFLSA-N 1 1 326.396 3.538 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453294042 1030039588 /nfs/dbraw/zinc/03/95/88/1030039588.db2.gz WBHJMPLYWWQCEY-AEFFLSMTSA-N 1 1 330.384 3.608 20 5 EHBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CC[C@H](C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453405602 1030215210 /nfs/dbraw/zinc/21/52/10/1030215210.db2.gz JLWGSEAGZBVLNA-BOFPYLFWSA-N 1 1 344.411 3.997 20 5 EHBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1nccs1 ZINC000159864658 1030396876 /nfs/dbraw/zinc/39/68/76/1030396876.db2.gz SICKNUQXQUKTKG-UHFFFAOYSA-N 1 1 349.456 3.773 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(Oc3cc[nH+]cc3C)CC2)c1 ZINC000447689100 1030423208 /nfs/dbraw/zinc/42/32/08/1030423208.db2.gz NVEFRPMXDYUSEF-UHFFFAOYSA-N 1 1 327.384 3.654 20 5 EHBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267981 1030514652 /nfs/dbraw/zinc/51/46/52/1030514652.db2.gz PLWBTDCXRCYIBG-SUMWQHHRSA-N 1 1 334.416 3.862 20 5 EHBDMO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000343392117 1030663628 /nfs/dbraw/zinc/66/36/28/1030663628.db2.gz VYIBMTSLTZSCFI-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000343392117 1030663635 /nfs/dbraw/zinc/66/36/35/1030663635.db2.gz VYIBMTSLTZSCFI-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247154662 1030917306 /nfs/dbraw/zinc/91/73/06/1030917306.db2.gz LVNYKBKOEYOYGB-CXAGYDPISA-N 1 1 328.416 3.843 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1F ZINC000340499836 1031305200 /nfs/dbraw/zinc/30/52/00/1031305200.db2.gz OFYQEVQYGWQYAV-VIFPVBQESA-N 1 1 343.280 3.999 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000484359536 1031543897 /nfs/dbraw/zinc/54/38/97/1031543897.db2.gz WACYWFRJKSSSNJ-CQSZACIVSA-N 1 1 346.349 3.884 20 5 EHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728740 1031659055 /nfs/dbraw/zinc/65/90/55/1031659055.db2.gz CPDQPXJSTPIIGJ-FRRDWIJNSA-N 1 1 330.388 3.511 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccccc1[N+](=O)[O-] ZINC000278616980 1031666103 /nfs/dbraw/zinc/66/61/03/1031666103.db2.gz FUJVGHDNSJNOCV-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nc(C)no2)C1 ZINC000347365246 1031900175 /nfs/dbraw/zinc/90/01/75/1031900175.db2.gz SZUBITLGGQRBPE-WQMJKPAKSA-N 1 1 342.399 3.569 20 5 EHBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1C ZINC000063497305 1033405643 /nfs/dbraw/zinc/40/56/43/1033405643.db2.gz UXKNCOXTMATHIU-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1C ZINC000063497305 1033405657 /nfs/dbraw/zinc/40/56/57/1033405657.db2.gz UXKNCOXTMATHIU-UHFFFAOYSA-N 1 1 341.411 3.672 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1COc2ccc(C)cc21 ZINC000595022883 1033617541 /nfs/dbraw/zinc/61/75/41/1033617541.db2.gz QDWJLKHZQJMGCF-BLLLJJGKSA-N 1 1 328.368 3.696 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000595085644 1033699086 /nfs/dbraw/zinc/69/90/86/1033699086.db2.gz SPLNLFYTVABTAP-APPDUMDISA-N 1 1 328.368 3.647 20 5 EHBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599127994 1033748435 /nfs/dbraw/zinc/74/84/35/1033748435.db2.gz TXGVADRGIUEQMM-QGZVFWFLSA-N 1 1 333.432 3.560 20 5 EHBDMO Cc1noc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000595359380 1033780061 /nfs/dbraw/zinc/78/00/61/1033780061.db2.gz FEOKENLLZQSNEI-MRXNPFEDSA-N 1 1 327.384 3.933 20 5 EHBDMO Cc1noc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000595359380 1033780072 /nfs/dbraw/zinc/78/00/72/1033780072.db2.gz FEOKENLLZQSNEI-MRXNPFEDSA-N 1 1 327.384 3.933 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000595389158 1033787272 /nfs/dbraw/zinc/78/72/72/1033787272.db2.gz LWQQTGLXLNKICL-IBGZPJMESA-N 1 1 344.386 3.507 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCSc1cccc(Cl)c1)CC2 ZINC000595424455 1033795443 /nfs/dbraw/zinc/79/54/43/1033795443.db2.gz MWVIKFKWBDFSJU-UHFFFAOYSA-N 1 1 349.843 3.794 20 5 EHBDMO COC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000595489011 1033811849 /nfs/dbraw/zinc/81/18/49/1033811849.db2.gz IZVIDAKMNZHWTG-OAHLLOKOSA-N 1 1 338.766 3.865 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000593714632 1033820729 /nfs/dbraw/zinc/82/07/29/1033820729.db2.gz IODILSKDWOLKSC-JCGVRSQUSA-N 1 1 332.375 3.815 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(OC(C)C)ccn2)cc1[N+](=O)[O-] ZINC000593021329 1033834719 /nfs/dbraw/zinc/83/47/19/1033834719.db2.gz VRKGXKPATGQYPL-AWEZNQCLSA-N 1 1 329.400 3.936 20 5 EHBDMO CC1(C)C[C@@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000595908047 1034025296 /nfs/dbraw/zinc/02/52/96/1034025296.db2.gz FACBMWPHJDFUGV-LJQANCHMSA-N 1 1 336.395 3.886 20 5 EHBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000603936114 1034052459 /nfs/dbraw/zinc/05/24/59/1034052459.db2.gz FVQFIFJQMKFMRD-OAHLLOKOSA-N 1 1 332.425 3.872 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059041 1034064264 /nfs/dbraw/zinc/06/42/64/1034064264.db2.gz MCWNNXXUFRHRLP-LZOLKVDOSA-N 1 1 343.471 3.710 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596059041 1034064273 /nfs/dbraw/zinc/06/42/73/1034064273.db2.gz MCWNNXXUFRHRLP-LZOLKVDOSA-N 1 1 343.471 3.710 20 5 EHBDMO O=[N+]([O-])c1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1C(F)(F)F ZINC000596079346 1034070391 /nfs/dbraw/zinc/07/03/91/1034070391.db2.gz OUZAZLXXZAJNAL-JTQLQIEISA-N 1 1 329.322 3.510 20 5 EHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](CC)c1ccccc1 ZINC000534134929 1034177541 /nfs/dbraw/zinc/17/75/41/1034177541.db2.gz YJQGTJREBCSQGT-GOSISDBHSA-N 1 1 343.427 3.620 20 5 EHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484186 1034388652 /nfs/dbraw/zinc/38/86/52/1034388652.db2.gz CNHSJGNVLHAVGU-GOSISDBHSA-N 1 1 328.368 3.516 20 5 EHBDMO COc1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000075831757 1034443271 /nfs/dbraw/zinc/44/32/71/1034443271.db2.gz GACXHYSQPWCTEE-MRXNPFEDSA-N 1 1 334.416 3.527 20 5 EHBDMO C[N@H+]1CCC[C@@H]1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000534608009 1034724172 /nfs/dbraw/zinc/72/41/72/1034724172.db2.gz MCTAGQANPXKBBT-LLVKDONJSA-N 1 1 345.262 3.934 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000045004340 1035600909 /nfs/dbraw/zinc/60/09/09/1035600909.db2.gz BTFLIHAKJSPYJL-MRXNPFEDSA-N 1 1 342.395 3.949 20 5 EHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1Cc2ccccc2C1 ZINC000534810267 1035618348 /nfs/dbraw/zinc/61/83/48/1035618348.db2.gz SLASOYLFZPJNBY-UHFFFAOYSA-N 1 1 349.390 3.849 20 5 EHBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180154130 1035919771 /nfs/dbraw/zinc/91/97/71/1035919771.db2.gz XDDRNGFZXLRDQO-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1c(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cccc1[N+](=O)[O-] ZINC000535091580 1036017640 /nfs/dbraw/zinc/01/76/40/1036017640.db2.gz FYFVCLQVJAQYRW-HXUWFJFHSA-N 1 1 340.423 3.676 20 5 EHBDMO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000180215049 1036271375 /nfs/dbraw/zinc/27/13/75/1036271375.db2.gz PKJLWTDPXPSEPD-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000180215049 1036271393 /nfs/dbraw/zinc/27/13/93/1036271393.db2.gz PKJLWTDPXPSEPD-UHFFFAOYSA-N 1 1 332.375 3.507 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200177 1036305306 /nfs/dbraw/zinc/30/53/06/1036305306.db2.gz VQUVAWFZZFZSGV-YQIFSTGGSA-N 1 1 330.428 3.747 20 5 EHBDMO Cc1cc(N[C@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140313 1036786738 /nfs/dbraw/zinc/78/67/38/1036786738.db2.gz ZFYREXTUHVEOBS-JTQLQIEISA-N 1 1 340.305 3.545 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000152826433 1036825923 /nfs/dbraw/zinc/82/59/23/1036825923.db2.gz RYDFEDLLZVVWBG-UHFFFAOYSA-N 1 1 345.374 3.585 20 5 EHBDMO CCC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000464842664 1036880654 /nfs/dbraw/zinc/88/06/54/1036880654.db2.gz KGIZDQKFFCSGJJ-GOSISDBHSA-N 1 1 333.432 3.826 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1cnn(CC2CCC2)c1 ZINC000897433111 1036911156 /nfs/dbraw/zinc/91/11/56/1036911156.db2.gz QFHUXHMBERVPAB-UHFFFAOYSA-N 1 1 334.807 3.535 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c(Cl)c1 ZINC000542003242 1036953582 /nfs/dbraw/zinc/95/35/82/1036953582.db2.gz XCUDHENNOVTNPY-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c(Cl)c1 ZINC000542003242 1036953596 /nfs/dbraw/zinc/95/35/96/1036953596.db2.gz XCUDHENNOVTNPY-GOSISDBHSA-N 1 1 346.814 3.730 20 5 EHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000539826868 1037252107 /nfs/dbraw/zinc/25/21/07/1037252107.db2.gz CTVPUZGPAFOGBW-RLGIIYIFSA-N 1 1 326.396 3.664 20 5 EHBDMO Cc1ccnc(NCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000348350803 1037292952 /nfs/dbraw/zinc/29/29/52/1037292952.db2.gz OYMMHRXSAFRNBT-HNNXBMFYSA-N 1 1 328.416 3.621 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591267707 1037311379 /nfs/dbraw/zinc/31/13/79/1037311379.db2.gz DEKCYEXBJJWOMD-MRXNPFEDSA-N 1 1 340.427 3.617 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCC[NH2+]CC3)s2)cc1 ZINC000591278460 1037316476 /nfs/dbraw/zinc/31/64/76/1037316476.db2.gz DMJRJUQDMHGJPU-AWEZNQCLSA-N 1 1 331.441 3.555 20 5 EHBDMO Cc1ccc(NC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000045951303 1037581071 /nfs/dbraw/zinc/58/10/71/1037581071.db2.gz XMCSYCHBGJTHLI-AWEZNQCLSA-N 1 1 348.447 3.537 20 5 EHBDMO Cc1ccccc1C1([NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000592139895 1037859430 /nfs/dbraw/zinc/85/94/30/1037859430.db2.gz OIWAAZTXRJSQAI-UHFFFAOYSA-N 1 1 340.379 3.549 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000592144325 1037861824 /nfs/dbraw/zinc/86/18/24/1037861824.db2.gz DVBMQUHXFKWTKO-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO C[C@@H]1CCCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000187926205 1037872536 /nfs/dbraw/zinc/87/25/36/1037872536.db2.gz UHRRCUJYQQGKEZ-CQSZACIVSA-N 1 1 329.400 3.914 20 5 EHBDMO Cc1cnc(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000573961445 1037978265 /nfs/dbraw/zinc/97/82/65/1037978265.db2.gz ROPCJEMWBQIIQP-UHFFFAOYSA-N 1 1 325.412 3.814 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961576 1038698373 /nfs/dbraw/zinc/69/83/73/1038698373.db2.gz XUMUGMBNYAFZQO-GHMZBOCLSA-N 1 1 331.338 3.817 20 5 EHBDMO COc1cc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185530 1038723288 /nfs/dbraw/zinc/72/32/88/1038723288.db2.gz DYBSKHLKUGOSBA-YOEHRIQHSA-N 1 1 341.411 3.851 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2c(C)noc2CC)cc1[N+](=O)[O-] ZINC000927139592 1039343150 /nfs/dbraw/zinc/34/31/50/1039343150.db2.gz LUTXMRPAUCNQRC-NSHDSACASA-N 1 1 333.388 3.703 20 5 EHBDMO C[C@@H](c1ccc(F)cc1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000015417996 1039493273 /nfs/dbraw/zinc/49/32/73/1039493273.db2.gz PRKJLACWVBLFTI-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053233617 1039523179 /nfs/dbraw/zinc/52/31/79/1039523179.db2.gz OLJCJUUBXUPHNI-NSHDSACASA-N 1 1 347.802 3.540 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053233617 1039523198 /nfs/dbraw/zinc/52/31/98/1039523198.db2.gz OLJCJUUBXUPHNI-NSHDSACASA-N 1 1 347.802 3.540 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128418824 1039628712 /nfs/dbraw/zinc/62/87/12/1039628712.db2.gz PREWWBXGVWTJEJ-CYBMUJFWSA-N 1 1 337.395 3.573 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC(N3CCCCC3)C1)CCCC2 ZINC000417328098 1039675423 /nfs/dbraw/zinc/67/54/23/1039675423.db2.gz HYHZWDWLIICTKV-OUNSHVDWSA-N 1 1 343.471 3.969 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC(C)(C)C[NH+]1CCCC1 ZINC000480927667 1040179214 /nfs/dbraw/zinc/17/92/14/1040179214.db2.gz BPOIRSWGCLYQLC-LFIBNONCSA-N 1 1 331.460 3.710 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@H]2CCCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000489954074 1040254564 /nfs/dbraw/zinc/25/45/64/1040254564.db2.gz DOLQZJKHPDBOGI-KBXCAEBGSA-N 1 1 330.384 3.608 20 5 EHBDMO CCCCC[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486813416 1040466552 /nfs/dbraw/zinc/46/65/52/1040466552.db2.gz UXQAOUTWWIDHHB-OAHLLOKOSA-N 1 1 333.432 3.886 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490340286 1040502183 /nfs/dbraw/zinc/50/21/83/1040502183.db2.gz MHFKEPDJOAERMK-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000588492061 1040688183 /nfs/dbraw/zinc/68/81/83/1040688183.db2.gz XJQWKXHIDJBSRI-DASIIQCKSA-N 1 1 336.391 3.739 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000555584063 1040878717 /nfs/dbraw/zinc/87/87/17/1040878717.db2.gz ZGNNDZNUISQMIW-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078764 1040886257 /nfs/dbraw/zinc/88/62/57/1040886257.db2.gz QATRPIVWONYKFH-HOTGVXAUSA-N 1 1 349.450 3.820 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCCO1 ZINC000511665843 1041448646 /nfs/dbraw/zinc/44/86/46/1041448646.db2.gz STGRGVROAOWALT-CQSZACIVSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837882 1041684743 /nfs/dbraw/zinc/68/47/43/1041684743.db2.gz JZMPEAWVCHWUJS-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837882 1041684746 /nfs/dbraw/zinc/68/47/46/1041684746.db2.gz JZMPEAWVCHWUJS-CJNGLKHVSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@@H](C)C1 ZINC000248557217 1042526799 /nfs/dbraw/zinc/52/67/99/1042526799.db2.gz LJGJAQVSCLQIHB-CHWSQXEVSA-N 1 1 330.388 3.828 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979139 1042829978 /nfs/dbraw/zinc/82/99/78/1042829978.db2.gz RUAGUVIYCFUGTI-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979139 1042829983 /nfs/dbraw/zinc/82/99/83/1042829983.db2.gz RUAGUVIYCFUGTI-ZDUSSCGKSA-N 1 1 330.384 3.854 20 5 EHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585743449 1043017912 /nfs/dbraw/zinc/01/79/12/1043017912.db2.gz OEVJXOZZUKGPRO-ZROIWOOFSA-N 1 1 336.395 3.707 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754490 1043024330 /nfs/dbraw/zinc/02/43/30/1043024330.db2.gz PQHCPTFLPBZZDV-UHFFFAOYSA-N 1 1 341.411 3.791 20 5 EHBDMO Cc1cccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728898253 1043633042 /nfs/dbraw/zinc/63/30/42/1043633042.db2.gz DPJLFDAMIOEHIV-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO Cc1cccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728898253 1043633046 /nfs/dbraw/zinc/63/30/46/1043633046.db2.gz DPJLFDAMIOEHIV-UHFFFAOYSA-N 1 1 336.395 3.856 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000072556525 1126760892 /nfs/dbraw/zinc/76/08/92/1126760892.db2.gz UHOQYAYACOFMPA-ZDUSSCGKSA-N 1 1 328.368 3.559 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000072556525 1126760895 /nfs/dbraw/zinc/76/08/95/1126760895.db2.gz UHOQYAYACOFMPA-ZDUSSCGKSA-N 1 1 328.368 3.559 20 5 EHBDMO CCC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000552300179 1127729331 /nfs/dbraw/zinc/72/93/31/1127729331.db2.gz ZKWIKHOYMONOID-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CCC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000552300179 1127729332 /nfs/dbraw/zinc/72/93/32/1127729332.db2.gz ZKWIKHOYMONOID-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000301426067 1127875950 /nfs/dbraw/zinc/87/59/50/1127875950.db2.gz PBMBNLHBQZRWOB-WBMJQRKESA-N 1 1 332.429 3.546 20 5 EHBDMO CC[N@@H+](C)Cc1cccc(CNc2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000338657320 1128002971 /nfs/dbraw/zinc/00/29/71/1128002971.db2.gz QDUIBJMRHBYOTE-UHFFFAOYSA-N 1 1 329.400 3.667 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301472321 1128468161 /nfs/dbraw/zinc/46/81/61/1128468161.db2.gz KQTGRDLHRXZFOZ-CYBMUJFWSA-N 1 1 325.840 3.725 20 5 EHBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301603657 1128521463 /nfs/dbraw/zinc/52/14/63/1128521463.db2.gz LFPCLLHSHBNHKS-CQSZACIVSA-N 1 1 328.416 3.533 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Br)C(C1CC1)C1CC1 ZINC001116650596 1128705977 /nfs/dbraw/zinc/70/59/77/1128705977.db2.gz BJZBPIVQAGJJCF-UHFFFAOYSA-N 1 1 339.233 3.978 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000494634828 1120708534 /nfs/dbraw/zinc/70/85/34/1120708534.db2.gz DWNOQROPNMWIIZ-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO CC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000915220020 1121256223 /nfs/dbraw/zinc/25/62/23/1121256223.db2.gz KTJMERZETVNBJG-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000915220020 1121256229 /nfs/dbraw/zinc/25/62/29/1121256229.db2.gz KTJMERZETVNBJG-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@@H](c2ccccc2)C1 ZINC000301066219 1121298356 /nfs/dbraw/zinc/29/83/56/1121298356.db2.gz JTHGGNYVZYEQCQ-HXUWFJFHSA-N 1 1 348.406 3.636 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1 ZINC000763202865 1121860585 /nfs/dbraw/zinc/86/05/85/1121860585.db2.gz JCOHXVLTYARHNI-UHFFFAOYSA-N 1 1 347.459 3.746 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000301114169 1121950394 /nfs/dbraw/zinc/95/03/94/1121950394.db2.gz XRGAEURAAQEEDJ-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO Cc1cccc(N2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000488059940 1121980265 /nfs/dbraw/zinc/98/02/65/1121980265.db2.gz UPTUTSUZKZMZMT-MRXNPFEDSA-N 1 1 325.412 3.786 20 5 EHBDMO O=[N+]([O-])c1ccccc1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301180697 1122293595 /nfs/dbraw/zinc/29/35/95/1122293595.db2.gz HTEBAJOGVIRPLL-KRWDZBQOSA-N 1 1 325.412 3.571 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180423 1122545259 /nfs/dbraw/zinc/54/52/59/1122545259.db2.gz SOFIZULJYJDBPI-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180423 1122545261 /nfs/dbraw/zinc/54/52/61/1122545261.db2.gz SOFIZULJYJDBPI-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000154708956 1122792892 /nfs/dbraw/zinc/79/28/92/1122792892.db2.gz WBWWSNLPMRBCHM-AWEZNQCLSA-N 1 1 329.400 3.938 20 5 EHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315894 1123374067 /nfs/dbraw/zinc/37/40/67/1123374067.db2.gz IQSGGOIHQPGAQQ-OAHLLOKOSA-N 1 1 326.396 3.983 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000609625529 1123628040 /nfs/dbraw/zinc/62/80/40/1123628040.db2.gz UBTZVSKNZBRVCF-UHFFFAOYSA-N 1 1 330.359 3.529 20 5 EHBDMO C[N@H+](CCOc1ccc(F)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704712 1123648074 /nfs/dbraw/zinc/64/80/74/1123648074.db2.gz AAPNZZCUXNQUOB-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@@H+](CCOc1ccc(F)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704712 1123648077 /nfs/dbraw/zinc/64/80/77/1123648077.db2.gz AAPNZZCUXNQUOB-UHFFFAOYSA-N 1 1 338.766 3.898 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301838380 1129172352 /nfs/dbraw/zinc/17/23/52/1129172352.db2.gz WRIXLILWBLKQTR-SMDDNHRTSA-N 1 1 343.349 3.534 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000080652687 1124918976 /nfs/dbraw/zinc/91/89/76/1124918976.db2.gz IGQAUXPRTQPZLO-GFCCVEGCSA-N 1 1 345.365 3.782 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000080652685 1124920795 /nfs/dbraw/zinc/92/07/95/1124920795.db2.gz IGQAUXPRTQPZLO-LBPRGKRZSA-N 1 1 345.365 3.782 20 5 EHBDMO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccc(F)c(F)c1 ZINC000618680016 1125162127 /nfs/dbraw/zinc/16/21/27/1125162127.db2.gz CJZZBOHWFQFQBW-DOMZBBRYSA-N 1 1 339.367 3.792 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])s2)[C@@H]1c1ccc(F)c(F)c1 ZINC000618680016 1125162130 /nfs/dbraw/zinc/16/21/30/1125162130.db2.gz CJZZBOHWFQFQBW-DOMZBBRYSA-N 1 1 339.367 3.792 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569437 1125363735 /nfs/dbraw/zinc/36/37/35/1125363735.db2.gz CKBYRUPCGACMKL-FDPIWHGQSA-N 1 1 332.444 3.746 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)s1 ZINC000619698920 1125384141 /nfs/dbraw/zinc/38/41/41/1125384141.db2.gz RJYQYNDLXQJSOF-GFCCVEGCSA-N 1 1 332.429 3.573 20 5 EHBDMO C[C@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491941 1131353256 /nfs/dbraw/zinc/35/32/56/1131353256.db2.gz LZLIJMWUGCMYAB-LBPRGKRZSA-N 1 1 326.824 3.764 20 5 EHBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845871 1129184569 /nfs/dbraw/zinc/18/45/69/1129184569.db2.gz TXXGTEDYCCIEBF-HKUYNNGSSA-N 1 1 339.395 3.655 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255959010 1129237941 /nfs/dbraw/zinc/23/79/41/1129237941.db2.gz LWQLSZVXMZRBRX-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181740 1129316358 /nfs/dbraw/zinc/31/63/58/1129316358.db2.gz IYXZSELUSQFTLB-LSDHHAIUSA-N 1 1 331.416 3.518 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920388 1129362458 /nfs/dbraw/zinc/36/24/58/1129362458.db2.gz DUNUAIVXJGJKQZ-NWDGAFQWSA-N 1 1 343.374 3.729 20 5 EHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1cccc(O)c1 ZINC000080931875 1129388430 /nfs/dbraw/zinc/38/84/30/1129388430.db2.gz RCYXFLBORNWEAN-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1cccc(O)c1 ZINC000080931875 1129388434 /nfs/dbraw/zinc/38/84/34/1129388434.db2.gz RCYXFLBORNWEAN-ZDUSSCGKSA-N 1 1 330.384 3.892 20 5 EHBDMO Cc1nc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000716229534 1131371956 /nfs/dbraw/zinc/37/19/56/1131371956.db2.gz NMPVILUDZPTSDS-WMLDXEAASA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439704 1129490074 /nfs/dbraw/zinc/49/00/74/1129490074.db2.gz HHOAKQILQQZDBW-FQEVSTJZSA-N 1 1 340.423 3.553 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000070396415 1129512204 /nfs/dbraw/zinc/51/22/04/1129512204.db2.gz FISQBPBJUWTWHM-SNVBAGLBSA-N 1 1 336.189 3.603 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000070396414 1129512324 /nfs/dbraw/zinc/51/23/24/1129512324.db2.gz FISQBPBJUWTWHM-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO Cc1c(C[N@H+](Cc2ccccc2)[C@@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303985 1129583718 /nfs/dbraw/zinc/58/37/18/1129583718.db2.gz QOCXCOAJOWXQBT-HNNXBMFYSA-N 1 1 328.412 3.676 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cn1 ZINC000390854219 1129638467 /nfs/dbraw/zinc/63/84/67/1129638467.db2.gz JYEDTCOEDPAEOZ-KRWDZBQOSA-N 1 1 340.427 3.702 20 5 EHBDMO COc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000302157001 1129770672 /nfs/dbraw/zinc/77/06/72/1129770672.db2.gz FJQLFBDRRHYVJO-PBHICJAKSA-N 1 1 341.411 3.536 20 5 EHBDMO COc1c(C)cc(C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1C ZINC000303168891 1129822886 /nfs/dbraw/zinc/82/28/86/1129822886.db2.gz VISVZJWKJPWVAG-UHFFFAOYSA-N 1 1 344.411 3.731 20 5 EHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1ccccc1F ZINC000731671541 1130829408 /nfs/dbraw/zinc/82/94/08/1130829408.db2.gz GHENDIXXSACWSW-UHFFFAOYSA-N 1 1 332.375 3.677 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869884 1131551117 /nfs/dbraw/zinc/55/11/17/1131551117.db2.gz BQOLHSCBKGPEMM-OAHLLOKOSA-N 1 1 343.402 3.835 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000740881337 1131552925 /nfs/dbraw/zinc/55/29/25/1131552925.db2.gz AJXPUBJYJHEEDN-JSGCOSHPSA-N 1 1 325.840 3.553 20 5 EHBDMO C[C@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021843 1131570799 /nfs/dbraw/zinc/57/07/99/1131570799.db2.gz QGCGTCIVXUNFRA-GRYCIOLGSA-N 1 1 340.807 3.553 20 5 EHBDMO COC(C)(C)[C@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916384 1131904026 /nfs/dbraw/zinc/90/40/26/1131904026.db2.gz RLUIHQJUOXOBOH-FUHWJXTLSA-N 1 1 332.444 3.732 20 5 EHBDMO COC(C)(C)[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916381 1131904055 /nfs/dbraw/zinc/90/40/55/1131904055.db2.gz RLUIHQJUOXOBOH-AEFFLSMTSA-N 1 1 332.444 3.732 20 5 EHBDMO CC(C)N1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909651 1131917067 /nfs/dbraw/zinc/91/70/67/1131917067.db2.gz UTFRZSUOMSHIGI-BPAFIMBUSA-N 1 1 345.487 3.551 20 5 EHBDMO Cc1ccc(C[N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911617 1131918073 /nfs/dbraw/zinc/91/80/73/1131918073.db2.gz CZWUHGHGSLBFPT-SFHVURJKSA-N 1 1 325.412 3.678 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCCC[C@](C)(F)C2)c1F ZINC001173181902 1131993269 /nfs/dbraw/zinc/99/32/69/1131993269.db2.gz QGBRFVHCPJKKPB-SJCJKPOMSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@](C)(F)C2)c1F ZINC001173181902 1131993274 /nfs/dbraw/zinc/99/32/74/1131993274.db2.gz QGBRFVHCPJKKPB-SJCJKPOMSA-N 1 1 342.386 3.888 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2cccnc2C)c1F ZINC001173191218 1131995380 /nfs/dbraw/zinc/99/53/80/1131995380.db2.gz BBSXRBZUACGLJF-LBPRGKRZSA-N 1 1 347.390 3.509 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001173219314 1132003480 /nfs/dbraw/zinc/00/34/80/1132003480.db2.gz ATMIYKWVIVZBGE-NVXWUHKLSA-N 1 1 331.460 3.522 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 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344.411 3.547 20 5 EHBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000776580722 1136445511 /nfs/dbraw/zinc/44/55/11/1136445511.db2.gz ZGNAYPLDXVBUNY-SCLBCKFNSA-N 1 1 332.375 3.850 20 5 EHBDMO CCc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640972 1136487687 /nfs/dbraw/zinc/48/76/87/1136487687.db2.gz ZHQBTRJMNPRNFW-UYAOXDASSA-N 1 1 340.423 3.680 20 5 EHBDMO Cc1cc[nH+]c(N2CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])CC2)c1 ZINC000853447913 1136533498 /nfs/dbraw/zinc/53/34/98/1136533498.db2.gz DCXVTZUYPZBQNH-UHFFFAOYSA-N 1 1 348.353 3.562 20 5 EHBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)c2ccccc2C1 ZINC000816618384 1136742474 /nfs/dbraw/zinc/74/24/74/1136742474.db2.gz WKLBAXZKLCKJIM-UHFFFAOYSA-N 1 1 331.803 3.700 20 5 EHBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001170858996 1136792574 /nfs/dbraw/zinc/79/25/74/1136792574.db2.gz CRDOCZLZBWESRQ-IRXDYDNUSA-N 1 1 341.411 3.668 20 5 EHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001170858996 1136792576 /nfs/dbraw/zinc/79/25/76/1136792576.db2.gz CRDOCZLZBWESRQ-IRXDYDNUSA-N 1 1 341.411 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@H](CC(F)(F)F)C3)c2c1 ZINC000817365397 1136803340 /nfs/dbraw/zinc/80/33/40/1136803340.db2.gz OYWPHSYHEMERMB-LLVKDONJSA-N 1 1 342.321 3.566 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@H](CC(F)(F)F)C3)c2c1 ZINC000817365397 1136803343 /nfs/dbraw/zinc/80/33/43/1136803343.db2.gz OYWPHSYHEMERMB-LLVKDONJSA-N 1 1 342.321 3.566 20 5 EHBDMO CC(C)c1ccc([C@@H]([NH3+])CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951850 1136850894 /nfs/dbraw/zinc/85/08/94/1136850894.db2.gz BCKFXLQUZIRPPA-UGSOOPFHSA-N 1 1 342.443 3.651 20 5 EHBDMO CC(C)c1ccc([C@@H]([NH3+])CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951841 1136851077 /nfs/dbraw/zinc/85/10/77/1136851077.db2.gz BCKFXLQUZIRPPA-ACJLOTCBSA-N 1 1 342.443 3.651 20 5 EHBDMO NC(CCC(F)(F)F)=[NH+]OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000863489771 1137189084 /nfs/dbraw/zinc/18/90/84/1137189084.db2.gz RHJJOZXMPLHMHF-UHFFFAOYSA-N 1 1 325.674 3.589 20 5 EHBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2c(Cl)c(Cl)ccc2[N+](=O)[O-])C1 ZINC000865642747 1137301084 /nfs/dbraw/zinc/30/10/84/1137301084.db2.gz ZQAJWIWYGSVTOY-SECBINFHSA-N 1 1 341.198 3.629 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2ccc(OC(F)F)cc2F)cc1[N+](=O)[O-] ZINC000865788075 1137311839 /nfs/dbraw/zinc/31/18/39/1137311839.db2.gz YCSCGBSWSPXEPL-UHFFFAOYSA-N 1 1 340.301 3.934 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCCC1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000866542338 1137363469 /nfs/dbraw/zinc/36/34/69/1137363469.db2.gz YVABNPJUXFAANJ-KRWDZBQOSA-N 1 1 328.416 3.588 20 5 EHBDMO CC(C)c1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c1 ZINC000867945253 1137390788 /nfs/dbraw/zinc/39/07/88/1137390788.db2.gz BNHFDZVBOMXVBR-SFHVURJKSA-N 1 1 327.384 3.531 20 5 EHBDMO CCC(=O)c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000795094485 1137464761 /nfs/dbraw/zinc/46/47/61/1137464761.db2.gz ISXWUBWTUUYBNA-UHFFFAOYSA-N 1 1 345.443 3.642 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC000888575004 1137542610 /nfs/dbraw/zinc/54/26/10/1137542610.db2.gz YBVKRLSKAFRWCW-UHFFFAOYSA-N 1 1 340.383 3.541 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000873183967 1137592917 /nfs/dbraw/zinc/59/29/17/1137592917.db2.gz UFFAVESWPZDVDF-IAQYHMDHSA-N 1 1 333.413 3.754 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(C(F)(F)F)nc1 ZINC000873185128 1137593062 /nfs/dbraw/zinc/59/30/62/1137593062.db2.gz PSVLGEQYQRASJS-SECBINFHSA-N 1 1 343.280 3.999 20 5 EHBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3nc(C4CCC4)no3)CC2)c1 ZINC000877736389 1137687475 /nfs/dbraw/zinc/68/74/75/1137687475.db2.gz XRSCQQICNHPDRI-UHFFFAOYSA-N 1 1 342.399 3.625 20 5 EHBDMO CCC[C@H](C)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877953954 1137696840 /nfs/dbraw/zinc/69/68/40/1137696840.db2.gz TZNXUCODZPJGMD-JTQLQIEISA-N 1 1 338.795 3.919 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]2CCCC[C@@H]21 ZINC000878398809 1137714147 /nfs/dbraw/zinc/71/41/47/1137714147.db2.gz DMVRHLXQHOMSCM-UMVBOHGHSA-N 1 1 342.399 3.655 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cncc(C)c2)cc1[N+](=O)[O-] ZINC000879747984 1137757621 /nfs/dbraw/zinc/75/76/21/1137757621.db2.gz VTQUTISOACIUNN-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cncc(C)c2)cc1[N+](=O)[O-] ZINC000879747984 1137757622 /nfs/dbraw/zinc/75/76/22/1137757622.db2.gz VTQUTISOACIUNN-MRXNPFEDSA-N 1 1 327.384 3.644 20 5 EHBDMO Cc1csc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880012045 1137765495 /nfs/dbraw/zinc/76/54/95/1137765495.db2.gz XOKDAKRRSGSBFS-CQSZACIVSA-N 1 1 347.440 3.618 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)cc1F ZINC000880577798 1137781654 /nfs/dbraw/zinc/78/16/54/1137781654.db2.gz LCFZIHMQCDMEPN-MRXNPFEDSA-N 1 1 336.407 3.763 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2ccc(F)cc2F)C2CC2)cc1 ZINC000130557390 1137839346 /nfs/dbraw/zinc/83/93/46/1137839346.db2.gz HYSFHKBOVBXGQV-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CC2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000883254123 1137850628 /nfs/dbraw/zinc/85/06/28/1137850628.db2.gz KQAFECQLTRAFSU-KRWDZBQOSA-N 1 1 340.427 3.588 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901932 1137925154 /nfs/dbraw/zinc/92/51/54/1137925154.db2.gz JRXSICFUKJONQJ-WWECUESFSA-N 1 1 332.444 3.917 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000332200170 1137935420 /nfs/dbraw/zinc/93/54/20/1137935420.db2.gz BYDUUWRGQKTCHK-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1cccc(Cl)c1)C1CC1 ZINC000135223603 1137964746 /nfs/dbraw/zinc/96/47/46/1137964746.db2.gz RKVNVYNQSYAVRC-SFHVURJKSA-N 1 1 346.814 3.946 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(OCC2CC2)c(F)c1 ZINC000886111960 1138048082 /nfs/dbraw/zinc/04/80/82/1138048082.db2.gz LZZAYYYSBGGBPC-GFCCVEGCSA-N 1 1 345.374 3.769 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000886269481 1138062822 /nfs/dbraw/zinc/06/28/22/1138062822.db2.gz WETZRFYRQNVEFO-UHFFFAOYSA-N 1 1 337.301 3.788 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCOC1 ZINC000093839943 1138241511 /nfs/dbraw/zinc/24/15/11/1138241511.db2.gz WSMCEKHWCKXBSW-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCOC1 ZINC000093839721 1138241768 /nfs/dbraw/zinc/24/17/68/1138241768.db2.gz VXPGGHCOQSQFQD-CYBMUJFWSA-N 1 1 332.425 3.792 20 5 EHBDMO CC(=O)Nc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130393127 1138452359 /nfs/dbraw/zinc/45/23/59/1138452359.db2.gz BMUGDMIRHZXARO-UHFFFAOYSA-N 1 1 339.395 3.718 20 5 EHBDMO COCc1ccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000130898729 1138482957 /nfs/dbraw/zinc/48/29/57/1138482957.db2.gz AWNOACVAGCRKQM-KRWDZBQOSA-N 1 1 330.384 3.714 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cccc3c2OCO3)cc1[N+](=O)[O-] ZINC000153116730 1139123437 /nfs/dbraw/zinc/12/34/37/1139123437.db2.gz VEMFXJXBKCJESX-LBPRGKRZSA-N 1 1 344.367 3.573 20 5 EHBDMO C[N@@H+](Cc1c2ccccc2cc2ccccc21)CC1(O)CCOCC1 ZINC000188837472 1140310594 /nfs/dbraw/zinc/31/05/94/1140310594.db2.gz YAUMKKQJQHVETR-UHFFFAOYSA-N 1 1 335.447 3.966 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000266420081 1140684391 /nfs/dbraw/zinc/68/43/91/1140684391.db2.gz ACAYIICGNDUUIN-LLVKDONJSA-N 1 1 348.786 3.870 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cn3ccsc3n2)cc1[N+](=O)[O-] ZINC000271021017 1141295052 /nfs/dbraw/zinc/29/50/52/1141295052.db2.gz AOPTYVBQBCTUAB-LLVKDONJSA-N 1 1 346.412 3.554 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCC2 ZINC000271281796 1141339143 /nfs/dbraw/zinc/33/91/43/1141339143.db2.gz AEETUFWELXUNMV-ZDUSSCGKSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000348637252 1141559767 /nfs/dbraw/zinc/55/97/67/1141559767.db2.gz TYTDPHMLMCPTTQ-UHFFFAOYSA-N 1 1 340.383 3.561 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000051560029 214096145 /nfs/dbraw/zinc/09/61/45/214096145.db2.gz KDZBVNLQCZAXAV-QGZVFWFLSA-N 1 1 342.395 3.949 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)C1CCCCC1 ZINC000028473788 212620402 /nfs/dbraw/zinc/62/04/02/212620402.db2.gz GOUYIUGNPKGTCK-UHFFFAOYSA-N 1 1 342.443 3.935 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2c[nH]nc2-c2cccnc2)C2CC2)c1 ZINC000154293644 1015350100 /nfs/dbraw/zinc/35/01/00/1015350100.db2.gz AINBEDNSAKEUBA-UHFFFAOYSA-N 1 1 349.394 3.545 20 5 EHBDMO CC(C)c1ccc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000189475863 1016521476 /nfs/dbraw/zinc/52/14/76/1016521476.db2.gz WFCKXBZQHBOFTH-HNNXBMFYSA-N 1 1 347.459 3.568 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cc4n(n3)CCCC4)C2)cc1 ZINC000593031035 1032668813 /nfs/dbraw/zinc/66/88/13/1032668813.db2.gz YEIRVDYBEWDSPZ-INIZCTEOSA-N 1 1 340.427 3.507 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cc4n(n3)CCCC4)C2)cc1 ZINC000593031035 1032668818 /nfs/dbraw/zinc/66/88/18/1032668818.db2.gz YEIRVDYBEWDSPZ-INIZCTEOSA-N 1 1 340.427 3.507 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000190052629 1017266265 /nfs/dbraw/zinc/26/62/65/1017266265.db2.gz KEKKBGWERSCMSZ-LRDDRELGSA-N 1 1 332.425 3.526 20 5 EHBDMO CC1(C)C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2cc(N)ccc2O1 ZINC000415021473 1017406663 /nfs/dbraw/zinc/40/66/63/1017406663.db2.gz AXXGMUFNOMQBIV-ZDUSSCGKSA-N 1 1 333.413 3.631 20 5 EHBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000610282442 1017623314 /nfs/dbraw/zinc/62/33/14/1017623314.db2.gz VENBGDGEVKYKSG-ZDUSSCGKSA-N 1 1 328.397 3.786 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000610285190 1017660498 /nfs/dbraw/zinc/66/04/98/1017660498.db2.gz GCTQECZVPBZVIV-HNNXBMFYSA-N 1 1 331.441 3.615 20 5 EHBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)c1 ZINC000365625080 1018088385 /nfs/dbraw/zinc/08/83/85/1018088385.db2.gz UMNYUCVKRUSUPP-MRXNPFEDSA-N 1 1 328.416 3.670 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010023 1018197480 /nfs/dbraw/zinc/19/74/80/1018197480.db2.gz BSXIIFICMOXOGP-YOEHRIQHSA-N 1 1 340.427 3.678 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610341086 1018331176 /nfs/dbraw/zinc/33/11/76/1018331176.db2.gz XMZTUPMBXOFANF-NWDGAFQWSA-N 1 1 332.322 3.699 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000610341086 1018331189 /nfs/dbraw/zinc/33/11/89/1018331189.db2.gz XMZTUPMBXOFANF-NWDGAFQWSA-N 1 1 332.322 3.699 20 5 EHBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290409535 1018601924 /nfs/dbraw/zinc/60/19/24/1018601924.db2.gz JZAHVOFTHNCDGG-JZLODUJNSA-N 1 1 326.400 3.785 20 5 EHBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[NH+](C)C ZINC000449554551 1032786022 /nfs/dbraw/zinc/78/60/22/1032786022.db2.gz CHQFUIWLOAKYPU-NSHDSACASA-N 1 1 337.807 3.548 20 5 EHBDMO CCn1nc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000580218547 1018819792 /nfs/dbraw/zinc/81/97/92/1018819792.db2.gz MJUKRAATTOXXJU-UHFFFAOYSA-N 1 1 338.411 3.639 20 5 EHBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc2n[nH]cc2c1 ZINC000513188289 1019390421 /nfs/dbraw/zinc/39/04/21/1019390421.db2.gz NYRLWHSNYMICDW-SNVBAGLBSA-N 1 1 330.775 3.975 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000513502739 1019760128 /nfs/dbraw/zinc/76/01/28/1019760128.db2.gz DZLFICHXTSJNPB-YFHOEESVSA-N 1 1 326.396 3.791 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000360875587 1020846739 /nfs/dbraw/zinc/84/67/39/1020846739.db2.gz XDGKIXCRSZLXRC-RHSMWYFYSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516019 1021172652 /nfs/dbraw/zinc/17/26/52/1021172652.db2.gz VJHPYSSOWHHLOI-HIFRSBDPSA-N 1 1 331.441 3.979 20 5 EHBDMO COc1c(C)cc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507626091 1021408579 /nfs/dbraw/zinc/40/85/79/1021408579.db2.gz LGPJFUBOCNEFKJ-UHFFFAOYSA-N 1 1 344.411 3.731 20 5 EHBDMO COc1ccc(CCC[N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505923736 1021469243 /nfs/dbraw/zinc/46/92/43/1021469243.db2.gz XSMAWQZQMXYUSD-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505923736 1021469252 /nfs/dbraw/zinc/46/92/52/1021469252.db2.gz XSMAWQZQMXYUSD-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO COc1cc(C[NH2+][C@]2(C)CCOc3ccccc32)c([N+](=O)[O-])cc1F ZINC000933370530 1021499134 /nfs/dbraw/zinc/49/91/34/1021499134.db2.gz MGUVUIPDTQELTM-GOSISDBHSA-N 1 1 346.358 3.530 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000055911173 1021890361 /nfs/dbraw/zinc/89/03/61/1021890361.db2.gz PHLIVGZRRXECCT-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000055911173 1021890381 /nfs/dbraw/zinc/89/03/81/1021890381.db2.gz PHLIVGZRRXECCT-KRWDZBQOSA-N 1 1 339.395 3.679 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000178236931 1022249608 /nfs/dbraw/zinc/24/96/08/1022249608.db2.gz VPEOTBVGWDMZPF-CJNGLKHVSA-N 1 1 346.456 3.855 20 5 EHBDMO CC[N@@H+]1CCCC[C@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711763 1022602311 /nfs/dbraw/zinc/60/23/11/1022602311.db2.gz NNQIXZIKRILCDB-HNNXBMFYSA-N 1 1 343.427 3.819 20 5 EHBDMO CC[N@H+]1CCCC[C@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711763 1022602316 /nfs/dbraw/zinc/60/23/16/1022602316.db2.gz NNQIXZIKRILCDB-HNNXBMFYSA-N 1 1 343.427 3.819 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3c3ccc(O)cc3)nc2c1 ZINC000610580946 1022787935 /nfs/dbraw/zinc/78/79/35/1022787935.db2.gz KFAOUFASUOLGTA-INIZCTEOSA-N 1 1 339.351 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]3c3ccc(O)cc3)nc2c1 ZINC000610580946 1022787949 /nfs/dbraw/zinc/78/79/49/1022787949.db2.gz KFAOUFASUOLGTA-INIZCTEOSA-N 1 1 339.351 3.779 20 5 EHBDMO Cn1nccc1-c1ccccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507245357 1023211913 /nfs/dbraw/zinc/21/19/13/1023211913.db2.gz ZAXPYGHOTQIKTJ-UHFFFAOYSA-N 1 1 336.395 3.627 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](O)C[C@H]1c1ccccc1 ZINC000602730808 1033122508 /nfs/dbraw/zinc/12/25/08/1033122508.db2.gz IUIMUHWFAMLNII-TVZRVCQQSA-N 1 1 338.407 3.806 20 5 EHBDMO Cn1cc(CNc2ccc(C3CC3)c[nH+]2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000897711388 1033128446 /nfs/dbraw/zinc/12/84/46/1033128446.db2.gz DFFDSJKTQOULOL-UHFFFAOYSA-N 1 1 349.394 3.880 20 5 EHBDMO CCOc1cc(C[N@@H+](CC)CCc2nccs2)ccc1[N+](=O)[O-] ZINC000276931396 1023403557 /nfs/dbraw/zinc/40/35/57/1023403557.db2.gz QYYYZIQQPXWHJL-UHFFFAOYSA-N 1 1 335.429 3.515 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247529003 1023451255 /nfs/dbraw/zinc/45/12/55/1023451255.db2.gz OBWKOBGVEFIYNQ-IVMMDQJWSA-N 1 1 342.399 3.798 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000342051339 1023804755 /nfs/dbraw/zinc/80/47/55/1023804755.db2.gz SIZFQDAPMZQEKY-SJLPKXTDSA-N 1 1 334.416 3.525 20 5 EHBDMO O=[N+]([O-])c1sccc1NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000065202053 1023892321 /nfs/dbraw/zinc/89/23/21/1023892321.db2.gz QNFCLDLOPCHPIB-OAHLLOKOSA-N 1 1 331.441 3.980 20 5 EHBDMO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)c1 ZINC000248427137 1024094855 /nfs/dbraw/zinc/09/48/55/1024094855.db2.gz OOZQBERVYYPXTJ-KBXCAEBGSA-N 1 1 349.862 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCC[C@@H](C)CC1 ZINC000063308944 1033200664 /nfs/dbraw/zinc/20/06/64/1033200664.db2.gz JLVHGCJQAXYLAW-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@@H](C)CC1 ZINC000063308944 1033200675 /nfs/dbraw/zinc/20/06/75/1033200675.db2.gz JLVHGCJQAXYLAW-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000430112701 1024381895 /nfs/dbraw/zinc/38/18/95/1024381895.db2.gz DZMVXDRVKUWYJT-KZWKSZDHSA-N 1 1 343.471 3.660 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2cccc(F)c2)C2CC2)cc1 ZINC000065535519 1024622833 /nfs/dbraw/zinc/62/28/33/1024622833.db2.gz JLWWGPYLSFEZRF-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614188 1024659598 /nfs/dbraw/zinc/65/95/98/1024659598.db2.gz QORSMNVXIGWMGJ-UONOGXRCSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505614188 1024659605 /nfs/dbraw/zinc/65/96/05/1024659605.db2.gz QORSMNVXIGWMGJ-UONOGXRCSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505630726 1024698877 /nfs/dbraw/zinc/69/88/77/1024698877.db2.gz DWNSIQTXPLORTO-HIFRSBDPSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000505630726 1024698883 /nfs/dbraw/zinc/69/88/83/1024698883.db2.gz DWNSIQTXPLORTO-HIFRSBDPSA-N 1 1 330.384 3.854 20 5 EHBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507913348 1024762156 /nfs/dbraw/zinc/76/21/56/1024762156.db2.gz KJZRAOYTBLRWRJ-HNNXBMFYSA-N 1 1 343.402 3.613 20 5 EHBDMO CCc1ccc([C@H]([NH2+][C@@H]2C[C@@H](O)C2(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427871703 1024853797 /nfs/dbraw/zinc/85/37/97/1024853797.db2.gz WQRPYQCHQZEPGM-KZNAEPCWSA-N 1 1 344.411 3.589 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)o1 ZINC000895843994 1024890655 /nfs/dbraw/zinc/89/06/55/1024890655.db2.gz KXBZGBSLIKLNMI-KSSFIOAISA-N 1 1 342.395 3.856 20 5 EHBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000346664913 1025001908 /nfs/dbraw/zinc/00/19/08/1025001908.db2.gz IALFIVWFFQNPMC-KRWDZBQOSA-N 1 1 341.411 3.667 20 5 EHBDMO COc1ccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123761 1025035246 /nfs/dbraw/zinc/03/52/46/1025035246.db2.gz OLIVCRXKDJLMBK-LJQANCHMSA-N 1 1 342.395 3.819 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H](C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948062 1025135570 /nfs/dbraw/zinc/13/55/70/1025135570.db2.gz QHTVJEGMJLQFPD-JKSUJKDBSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(CNC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948062 1025135574 /nfs/dbraw/zinc/13/55/74/1025135574.db2.gz QHTVJEGMJLQFPD-JKSUJKDBSA-N 1 1 333.476 3.928 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000133 1025381473 /nfs/dbraw/zinc/38/14/73/1025381473.db2.gz WDUWNJURNCTRCJ-TTYHFUOFSA-N 1 1 346.471 3.789 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281771925 1025480707 /nfs/dbraw/zinc/48/07/07/1025480707.db2.gz DFGBLVAJCPIVAJ-AWEZNQCLSA-N 1 1 326.400 3.512 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[N@H+](C(C)(C)C)CC1 ZINC000530342006 1025680977 /nfs/dbraw/zinc/68/09/77/1025680977.db2.gz AHZCBQOJCFWJOV-SSZFMOIBSA-N 1 1 331.460 3.804 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451412189 1025945711 /nfs/dbraw/zinc/94/57/11/1025945711.db2.gz FWFSNZZCDLBFFL-RCCFBDPRSA-N 1 1 348.443 3.507 20 5 EHBDMO C[N@@H+]1CCCC[C@H]1CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099693 /nfs/dbraw/zinc/09/96/93/1026099693.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 1 1 331.460 3.649 20 5 EHBDMO C[N@H+]1CCCC[C@H]1CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099706 /nfs/dbraw/zinc/09/97/06/1026099706.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@H]1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099717 /nfs/dbraw/zinc/09/97/17/1026099717.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 1 1 331.460 3.649 20 5 EHBDMO CN1CCCC[C@H]1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099732 /nfs/dbraw/zinc/09/97/32/1026099732.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 1 1 331.460 3.649 20 5 EHBDMO COC(=O)c1oc([C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511122014 1026218073 /nfs/dbraw/zinc/21/80/73/1026218073.db2.gz LZDOZCGDIGEFGQ-CYBMUJFWSA-N 1 1 346.383 3.518 20 5 EHBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000338957093 1026301703 /nfs/dbraw/zinc/30/17/03/1026301703.db2.gz YBCHHLMQRYUCPE-UHFFFAOYSA-N 1 1 344.459 3.838 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@]3(CCOC3)C2)c1 ZINC000451907999 1026374031 /nfs/dbraw/zinc/37/40/31/1026374031.db2.gz IOSRDSZRULONMO-OAHLLOKOSA-N 1 1 344.333 3.616 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@]3(CCOC3)C2)c1 ZINC000451907999 1026374042 /nfs/dbraw/zinc/37/40/42/1026374042.db2.gz IOSRDSZRULONMO-OAHLLOKOSA-N 1 1 344.333 3.616 20 5 EHBDMO Cc1ccc(C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000452042386 1026454065 /nfs/dbraw/zinc/45/40/65/1026454065.db2.gz OAQHJFSMANPQLF-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000452042386 1026454071 /nfs/dbraw/zinc/45/40/71/1026454071.db2.gz OAQHJFSMANPQLF-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO COC[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452046659 1026456266 /nfs/dbraw/zinc/45/62/66/1026456266.db2.gz YOFWQGMDXUWGKY-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO COC[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452046659 1026456273 /nfs/dbraw/zinc/45/62/73/1026456273.db2.gz YOFWQGMDXUWGKY-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)n1 ZINC000611616502 1026524860 /nfs/dbraw/zinc/52/48/60/1026524860.db2.gz ULTPPOBCNVRUNB-SJORKVTESA-N 1 1 346.475 3.697 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)n1 ZINC000611616500 1026525274 /nfs/dbraw/zinc/52/52/74/1026525274.db2.gz ULTPPOBCNVRUNB-IAGOWNOFSA-N 1 1 346.475 3.697 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](COC)Cc1ccccc1 ZINC000531104373 1026574504 /nfs/dbraw/zinc/57/45/04/1026574504.db2.gz VMTAVDHFEGGELK-IBGZPJMESA-N 1 1 328.412 3.674 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cnn(CC2CCC2)c1 ZINC000934558210 1026783295 /nfs/dbraw/zinc/78/32/95/1026783295.db2.gz AUZGJGTVNCQSEN-GFCCVEGCSA-N 1 1 332.379 3.581 20 5 EHBDMO CO[C@@H](C)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000533432417 1027869691 /nfs/dbraw/zinc/86/96/91/1027869691.db2.gz XOCYSZSDMPEFNO-AWEZNQCLSA-N 1 1 347.415 3.538 20 5 EHBDMO CC(C)[C@@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444749765 1028234535 /nfs/dbraw/zinc/23/45/35/1028234535.db2.gz VAGVNQZBXZOLCB-GFCCVEGCSA-N 1 1 339.823 3.555 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444749765 1028234548 /nfs/dbraw/zinc/23/45/48/1028234548.db2.gz VAGVNQZBXZOLCB-GFCCVEGCSA-N 1 1 339.823 3.555 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CCO)CC3)o2)cc1 ZINC000421401228 1028348249 /nfs/dbraw/zinc/34/82/49/1028348249.db2.gz TYVYPLRRDKZHGC-HNNXBMFYSA-N 1 1 344.411 3.839 20 5 EHBDMO CCc1ccc([C@@H](N[C@@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438987 1028446806 /nfs/dbraw/zinc/44/68/06/1028446806.db2.gz RWWVTGUBHYVZOG-LIRRHRJNSA-N 1 1 345.443 3.947 20 5 EHBDMO CCc1ccccc1[C@H]([NH3+])CN[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505219 1028469816 /nfs/dbraw/zinc/46/98/16/1028469816.db2.gz OCHUTDGQJMZGDA-KBXCAEBGSA-N 1 1 327.428 3.816 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C[NH3+])C1CCCC1 ZINC000423504700 1028470136 /nfs/dbraw/zinc/47/01/36/1028470136.db2.gz NUHVEZGIOZDESX-CABCVRRESA-N 1 1 337.489 3.573 20 5 EHBDMO Cn1c2ccc(Nc3nc4ccccn4c3[N+](=O)[O-])cc2[nH+]c1C1CC1 ZINC000760270081 1028546046 /nfs/dbraw/zinc/54/60/46/1028546046.db2.gz AKKDUBUXYSMGGK-UHFFFAOYSA-N 1 1 348.366 3.750 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930042 1029076425 /nfs/dbraw/zinc/07/64/25/1029076425.db2.gz MYVRYQPXFWRVRA-GJZGRUSLSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930042 1029076445 /nfs/dbraw/zinc/07/64/45/1029076445.db2.gz MYVRYQPXFWRVRA-GJZGRUSLSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930045 1029076777 /nfs/dbraw/zinc/07/67/77/1029076777.db2.gz MYVRYQPXFWRVRA-LSDHHAIUSA-N 1 1 335.448 3.519 20 5 EHBDMO CCOc1ccc([C@@H](C)NCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930045 1029076794 /nfs/dbraw/zinc/07/67/94/1029076794.db2.gz MYVRYQPXFWRVRA-LSDHHAIUSA-N 1 1 335.448 3.519 20 5 EHBDMO CC1(C)CCCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000446063136 1029355532 /nfs/dbraw/zinc/35/55/32/1029355532.db2.gz WWPQMKOSICQCNP-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000533248716 1029526423 /nfs/dbraw/zinc/52/64/23/1029526423.db2.gz MLFHECFMTIZLJF-UKRRQHHQSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988784 1029575130 /nfs/dbraw/zinc/57/51/30/1029575130.db2.gz JSICUHZRMWEXML-ZANVPECISA-N 1 1 329.322 3.508 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000533298146 1029600546 /nfs/dbraw/zinc/60/05/46/1029600546.db2.gz IEDSIQOVQHSWRO-OAHLLOKOSA-N 1 1 333.432 3.744 20 5 EHBDMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])s2)[C@@H]1c1cccs1 ZINC000192464447 1029681074 /nfs/dbraw/zinc/68/10/74/1029681074.db2.gz DFJGXVDATKCAFT-GXFFZTMASA-N 1 1 338.458 3.608 20 5 EHBDMO CC[C@@]1(O)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428446995 1029688970 /nfs/dbraw/zinc/68/89/70/1029688970.db2.gz KXUKPVKLURFERH-QGZVFWFLSA-N 1 1 332.425 3.670 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192492646 1029708758 /nfs/dbraw/zinc/70/87/58/1029708758.db2.gz GGZIGXVNTFJLLM-ZDUSSCGKSA-N 1 1 338.477 3.532 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](CCCO)Cc2cccc(Cl)c2)cc1 ZINC000441064077 1029724577 /nfs/dbraw/zinc/72/45/77/1029724577.db2.gz PKFNPMDNAZXONQ-UHFFFAOYSA-N 1 1 348.830 3.675 20 5 EHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525409895 1029839624 /nfs/dbraw/zinc/83/96/24/1029839624.db2.gz WRJHQJGHRPQAEU-KURKYZTESA-N 1 1 332.444 3.663 20 5 EHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000428652090 1029853127 /nfs/dbraw/zinc/85/31/27/1029853127.db2.gz NDBQUSQDBCBPNB-UHFFFAOYSA-N 1 1 336.823 3.924 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3CCO)s2)cc1 ZINC000428462390 1029873834 /nfs/dbraw/zinc/87/38/34/1029873834.db2.gz SWQAFTIYYGJZEB-AWEZNQCLSA-N 1 1 332.425 3.670 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@@H](O)C2CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453396114 1030246838 /nfs/dbraw/zinc/24/68/38/1030246838.db2.gz YDMVQLWMDRCULL-MJGOQNOKSA-N 1 1 344.411 3.590 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160343711 1030685085 /nfs/dbraw/zinc/68/50/85/1030685085.db2.gz DTUAVBCGJPOJBR-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000160343711 1030685095 /nfs/dbraw/zinc/68/50/95/1030685095.db2.gz DTUAVBCGJPOJBR-KRWDZBQOSA-N 1 1 327.384 3.644 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC(C)(C)C1 ZINC000483097482 1030949834 /nfs/dbraw/zinc/94/98/34/1030949834.db2.gz MNSQXKFZQVDAMP-LBPRGKRZSA-N 1 1 339.823 3.697 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000483340554 1031127645 /nfs/dbraw/zinc/12/76/45/1031127645.db2.gz KVHQGZVPPYLDNM-KXBFYZLASA-N 1 1 348.443 3.624 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000484341804 1031545262 /nfs/dbraw/zinc/54/52/62/1031545262.db2.gz PCCCAHKIFXHBRN-CQSZACIVSA-N 1 1 346.349 3.884 20 5 EHBDMO CC(C)[N@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000052897560 1031987724 /nfs/dbraw/zinc/98/77/24/1031987724.db2.gz LXQIKTIINSOVKK-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CC(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000052897560 1031987736 /nfs/dbraw/zinc/98/77/36/1031987736.db2.gz LXQIKTIINSOVKK-UHFFFAOYSA-N 1 1 345.374 3.583 20 5 EHBDMO CCOc1cncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000598674996 1033390854 /nfs/dbraw/zinc/39/08/54/1033390854.db2.gz BRYXSGJKSNZOLS-QGZVFWFLSA-N 1 1 341.411 3.768 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](CCC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000063493221 1033400814 /nfs/dbraw/zinc/40/08/14/1033400814.db2.gz NMAUNKPHXHZXBQ-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000594502665 1033404473 /nfs/dbraw/zinc/40/44/73/1033404473.db2.gz ORYQPHJAVJTDIH-KRWDZBQOSA-N 1 1 326.400 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1OC(F)F ZINC000594597684 1033444121 /nfs/dbraw/zinc/44/41/21/1033444121.db2.gz DXMKCTXRFCIURB-QWHCGFSZSA-N 1 1 341.358 3.625 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761290388 1033487595 /nfs/dbraw/zinc/48/75/95/1033487595.db2.gz OTJAYRXUUVAXDJ-MRXNPFEDSA-N 1 1 336.395 3.700 20 5 EHBDMO COc1cc(CNc2[nH+]ccc(C)c2C2CC2)cc([N+](=O)[O-])c1O ZINC000594741696 1033518533 /nfs/dbraw/zinc/51/85/33/1033518533.db2.gz BZKCFDPDOPRVSL-UHFFFAOYSA-N 1 1 329.356 3.502 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1cccc(C[NH+](C)C)c1 ZINC000595003486 1033627538 /nfs/dbraw/zinc/62/75/38/1033627538.db2.gz HHZIVLCDHNWNRN-CQSZACIVSA-N 1 1 343.427 3.516 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054949 1033633131 /nfs/dbraw/zinc/63/31/31/1033633131.db2.gz XRZZHCUCIULDMU-DZGCQCFKSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054949 1033633138 /nfs/dbraw/zinc/63/31/38/1033633138.db2.gz XRZZHCUCIULDMU-DZGCQCFKSA-N 1 1 335.448 3.517 20 5 EHBDMO CC(C)(C)C(F)(F)C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000595108541 1033694455 /nfs/dbraw/zinc/69/44/55/1033694455.db2.gz SAZBNFFLLAVNBY-NEPJUHHUSA-N 1 1 330.379 3.546 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000599064268 1033702326 /nfs/dbraw/zinc/70/23/26/1033702326.db2.gz LXEGXCNRDGFZFE-MAUKXSAKSA-N 1 1 329.444 3.579 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599064268 1033702330 /nfs/dbraw/zinc/70/23/30/1033702330.db2.gz LXEGXCNRDGFZFE-MAUKXSAKSA-N 1 1 329.444 3.579 20 5 EHBDMO CCC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000595330863 1033728189 /nfs/dbraw/zinc/72/81/89/1033728189.db2.gz MZJZNLQYGHSMGD-USXIJHARSA-N 1 1 336.407 3.759 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000595502888 1033834913 /nfs/dbraw/zinc/83/49/13/1033834913.db2.gz XDMPCGDITXZYKJ-INIZCTEOSA-N 1 1 341.411 3.638 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566253 1033844537 /nfs/dbraw/zinc/84/45/37/1033844537.db2.gz NANYGQCVGMNVCQ-ZLDLUXBVSA-N 1 1 328.372 3.580 20 5 EHBDMO O=[N+]([O-])c1sccc1N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000608779443 1033884270 /nfs/dbraw/zinc/88/42/70/1033884270.db2.gz RDOHRWONKIFYDY-UHFFFAOYSA-N 1 1 345.468 3.801 20 5 EHBDMO Cc1noc(C[N@@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000599516074 1033976980 /nfs/dbraw/zinc/97/69/80/1033976980.db2.gz MEMAFYZYCXREQM-LBPRGKRZSA-N 1 1 337.326 3.549 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@H](c3ccc(F)c(F)c3)C2)c1[N+](=O)[O-] ZINC000599516074 1033976998 /nfs/dbraw/zinc/97/69/98/1033976998.db2.gz MEMAFYZYCXREQM-LBPRGKRZSA-N 1 1 337.326 3.549 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](C4CCC4)C3)n2)c1 ZINC000595832132 1034014836 /nfs/dbraw/zinc/01/48/36/1034014836.db2.gz IRDHUXBRTKASBD-HNNXBMFYSA-N 1 1 342.399 3.657 20 5 EHBDMO COc1cc(C[N@@H+]2CC3CC2(c2ccccc2)C3)c([N+](=O)[O-])cc1F ZINC000595906847 1034026594 /nfs/dbraw/zinc/02/65/94/1034026594.db2.gz AQXONSBPCSVUES-UHFFFAOYSA-N 1 1 342.370 3.864 20 5 EHBDMO COc1cc(C[N@H+]2CC3CC2(c2ccccc2)C3)c([N+](=O)[O-])cc1F ZINC000595906847 1034026606 /nfs/dbraw/zinc/02/66/06/1034026606.db2.gz AQXONSBPCSVUES-UHFFFAOYSA-N 1 1 342.370 3.864 20 5 EHBDMO CCOc1cccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596570814 1034293462 /nfs/dbraw/zinc/29/34/62/1034293462.db2.gz OHDDICJRCOIQQN-OAHLLOKOSA-N 1 1 333.432 3.527 20 5 EHBDMO COCc1csc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000596979070 1034477523 /nfs/dbraw/zinc/47/75/23/1034477523.db2.gz HLYHOGOWMMNLHA-UHFFFAOYSA-N 1 1 332.425 3.967 20 5 EHBDMO COCc1csc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000596979070 1034477525 /nfs/dbraw/zinc/47/75/25/1034477525.db2.gz HLYHOGOWMMNLHA-UHFFFAOYSA-N 1 1 332.425 3.967 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)o2)cc1 ZINC000597205083 1034607690 /nfs/dbraw/zinc/60/76/90/1034607690.db2.gz LHWKUHZPPGUWMQ-IBGZPJMESA-N 1 1 342.395 3.592 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](Oc3cccc(Cl)c3)C2)cs1 ZINC000534657340 1034775824 /nfs/dbraw/zinc/77/58/24/1034775824.db2.gz XSMOCWVXSHEFNG-AWEZNQCLSA-N 1 1 338.816 3.963 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Oc3cccc(Cl)c3)C2)cs1 ZINC000534657340 1034775840 /nfs/dbraw/zinc/77/58/40/1034775840.db2.gz XSMOCWVXSHEFNG-AWEZNQCLSA-N 1 1 338.816 3.963 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000612578519 1035074065 /nfs/dbraw/zinc/07/40/65/1035074065.db2.gz LTUATOKQWCTLDV-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000612578519 1035074072 /nfs/dbraw/zinc/07/40/72/1035074072.db2.gz LTUATOKQWCTLDV-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO C[C@@H](c1cccc(Nc2ccccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000511452446 1035459058 /nfs/dbraw/zinc/45/90/58/1035459058.db2.gz BMZLOYPVZRPMDX-AWEZNQCLSA-N 1 1 327.384 3.732 20 5 EHBDMO CC(=O)c1cc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000588012563 1035681145 /nfs/dbraw/zinc/68/11/45/1035681145.db2.gz BACYFZZUNVODCF-CQSZACIVSA-N 1 1 341.411 3.730 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](COC)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492776071 1036280493 /nfs/dbraw/zinc/28/04/93/1036280493.db2.gz TYZYJYFGYNSHMH-MRXNPFEDSA-N 1 1 348.374 3.610 20 5 EHBDMO CC(C)(CO)[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccs1 ZINC000589268763 1036335479 /nfs/dbraw/zinc/33/54/79/1036335479.db2.gz ZJLOEZVCEZLYNR-HNNXBMFYSA-N 1 1 338.404 3.645 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000589494668 1036436185 /nfs/dbraw/zinc/43/61/85/1036436185.db2.gz LCSBPGCLEIJBTL-KRWDZBQOSA-N 1 1 340.379 3.719 20 5 EHBDMO CCOC(=O)[C@]1(C(C)C)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825989 1036509610 /nfs/dbraw/zinc/50/96/10/1036509610.db2.gz IPDGKFFJYCSDMZ-RDTXWAMCSA-N 1 1 334.416 3.567 20 5 EHBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C2 ZINC000609133986 1036528376 /nfs/dbraw/zinc/52/83/76/1036528376.db2.gz UGMZKJVPTOAXJJ-UHFFFAOYSA-N 1 1 342.395 3.560 20 5 EHBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C2 ZINC000609133986 1036528382 /nfs/dbraw/zinc/52/83/82/1036528382.db2.gz UGMZKJVPTOAXJJ-UHFFFAOYSA-N 1 1 342.395 3.560 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748159 1036553818 /nfs/dbraw/zinc/55/38/18/1036553818.db2.gz QDVUYDDMEIMJJK-VDZJLULYSA-N 1 1 340.423 3.754 20 5 EHBDMO C[C@@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000783775821 1036812595 /nfs/dbraw/zinc/81/25/95/1036812595.db2.gz IULOMQVTLBHQSY-TUAOUCFPSA-N 1 1 340.807 3.553 20 5 EHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2CCCc2ccccc2)c1 ZINC000443650940 1036937149 /nfs/dbraw/zinc/93/71/49/1036937149.db2.gz QMOOHGSHKQNFOO-SFHVURJKSA-N 1 1 342.443 3.669 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462830211 1037433251 /nfs/dbraw/zinc/43/32/51/1037433251.db2.gz AWQWOQCUZOVTNW-TXEJJXNPSA-N 1 1 343.374 3.871 20 5 EHBDMO CCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462842539 1037472397 /nfs/dbraw/zinc/47/23/97/1037472397.db2.gz DTPWDJISWYXWHD-UHFFFAOYSA-N 1 1 330.226 3.501 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H](c2ccccc2Cl)[NH+](C)C)c1 ZINC000462916321 1037546149 /nfs/dbraw/zinc/54/61/49/1037546149.db2.gz CGCJAOWQJSPMGI-QGZVFWFLSA-N 1 1 349.818 3.972 20 5 EHBDMO CC[C@H]1CCCCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532583654 1037704285 /nfs/dbraw/zinc/70/42/85/1037704285.db2.gz ZGSGSWHBRRUDOF-LBPRGKRZSA-N 1 1 339.823 3.841 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532583654 1037704298 /nfs/dbraw/zinc/70/42/98/1037704298.db2.gz ZGSGSWHBRRUDOF-LBPRGKRZSA-N 1 1 339.823 3.841 20 5 EHBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000463067717 1037729100 /nfs/dbraw/zinc/72/91/00/1037729100.db2.gz FDPPWRCIDPICEK-INIZCTEOSA-N 1 1 343.402 3.692 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000596296318 1037758136 /nfs/dbraw/zinc/75/81/36/1037758136.db2.gz HAVCDQYUSYMCRZ-GXTWGEPZSA-N 1 1 325.359 3.961 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2cccc3[nH]ccc32)ccc1[N+](=O)[O-] ZINC000494005866 1037768050 /nfs/dbraw/zinc/76/80/50/1037768050.db2.gz DKYNNDDRAZRCDN-UHFFFAOYSA-N 1 1 325.368 3.717 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2nc(C)sc2c1 ZINC000494061197 1037803138 /nfs/dbraw/zinc/80/31/38/1037803138.db2.gz UVHGISYZNLQGSM-UHFFFAOYSA-N 1 1 343.408 3.811 20 5 EHBDMO COc1cccc(C2([NH2+]Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)c1 ZINC000274308633 1038457477 /nfs/dbraw/zinc/45/74/77/1038457477.db2.gz LQXVNCNITGHGSR-UHFFFAOYSA-N 1 1 346.358 3.530 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961579 1038698651 /nfs/dbraw/zinc/69/86/51/1038698651.db2.gz XUMUGMBNYAFZQO-WDEREUQCSA-N 1 1 331.338 3.817 20 5 EHBDMO C[C@H]1C[C@@H](CCNc2ncccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000511603747 1039430001 /nfs/dbraw/zinc/43/00/01/1039430001.db2.gz MDGPRTLCQXQBDV-DOTOQJQBSA-N 1 1 340.427 3.702 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3cncn3c1)CCCC2 ZINC000417369440 1039738563 /nfs/dbraw/zinc/73/85/63/1039738563.db2.gz PHFCUGKYGMBAOY-LJQANCHMSA-N 1 1 336.395 3.800 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000490037577 1040301217 /nfs/dbraw/zinc/30/12/17/1040301217.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 1 1 331.460 3.628 20 5 EHBDMO CC1(C)C[C@@H](N[C@H]2CC[N@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114678 1040766189 /nfs/dbraw/zinc/76/61/89/1040766189.db2.gz GTIKIRFAQFDIBV-IFXJQAMLSA-N 1 1 343.471 3.924 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@H]2CCN(C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114678 1040766207 /nfs/dbraw/zinc/76/62/07/1040766207.db2.gz GTIKIRFAQFDIBV-IFXJQAMLSA-N 1 1 343.471 3.924 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1nccc2c1cccc2[N+](=O)[O-] ZINC001167751004 1040795010 /nfs/dbraw/zinc/79/50/10/1040795010.db2.gz GRNGCSPCCQSQSD-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC000570894470 1040967108 /nfs/dbraw/zinc/96/71/08/1040967108.db2.gz XFFCQUIRPAOKGV-IFIJOSMWSA-N 1 1 328.416 3.872 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCC[C@@H]12 ZINC000570894470 1040967126 /nfs/dbraw/zinc/96/71/26/1040967126.db2.gz XFFCQUIRPAOKGV-IFIJOSMWSA-N 1 1 328.416 3.872 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178859 1041009448 /nfs/dbraw/zinc/00/94/48/1041009448.db2.gz CQORMHLEDGYOHQ-GFCCVEGCSA-N 1 1 346.383 3.518 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000150741042 1041217972 /nfs/dbraw/zinc/21/79/72/1041217972.db2.gz DBOBNVLMFCWITE-CQSZACIVSA-N 1 1 349.431 3.587 20 5 EHBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854651 1041247347 /nfs/dbraw/zinc/24/73/47/1041247347.db2.gz GJHRWOUHORNMFS-OAHLLOKOSA-N 1 1 341.411 3.659 20 5 EHBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000112699034 1042420124 /nfs/dbraw/zinc/42/01/24/1042420124.db2.gz MUTWLYNAGRUPBV-GOSISDBHSA-N 1 1 341.411 3.523 20 5 EHBDMO CSC[C@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000093760905 1042486163 /nfs/dbraw/zinc/48/61/63/1042486163.db2.gz YSXMIDOAWLVEOR-LLVKDONJSA-N 1 1 345.262 3.685 20 5 EHBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000093760905 1042486166 /nfs/dbraw/zinc/48/61/66/1042486166.db2.gz YSXMIDOAWLVEOR-LLVKDONJSA-N 1 1 345.262 3.685 20 5 EHBDMO COc1ccccc1CC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541995233 1043003225 /nfs/dbraw/zinc/00/32/25/1043003225.db2.gz KVFOTDSSJZNAAZ-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO COc1ccccc1CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541995233 1043003231 /nfs/dbraw/zinc/00/32/31/1043003231.db2.gz KVFOTDSSJZNAAZ-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178575966 1044776071 /nfs/dbraw/zinc/77/60/71/1044776071.db2.gz DWWMWJREWDUYDD-OALUTQOASA-N 1 1 326.396 3.774 20 5 EHBDMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283262 1127473601 /nfs/dbraw/zinc/47/36/01/1127473601.db2.gz PFKBJQOHBYXWMX-VXGBXAGGSA-N 1 1 341.839 3.943 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488448 1127758227 /nfs/dbraw/zinc/75/82/27/1127758227.db2.gz BUHOVWSTAQUONE-LLVKDONJSA-N 1 1 344.358 3.683 20 5 EHBDMO CC(C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(F)c1 ZINC000172342911 1127906553 /nfs/dbraw/zinc/90/65/53/1127906553.db2.gz OFWNOAPRISHABG-UHFFFAOYSA-N 1 1 346.358 3.625 20 5 EHBDMO CC(C)N(Cc1ncc(C[NH+](C)C)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000347609623 1128136719 /nfs/dbraw/zinc/13/67/19/1128136719.db2.gz KHXDLXFWPOZAQM-UHFFFAOYSA-N 1 1 348.472 3.524 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477797 1131242139 /nfs/dbraw/zinc/24/21/39/1131242139.db2.gz UMDLYFQDCXRZKI-YOEHRIQHSA-N 1 1 336.395 3.780 20 5 EHBDMO CC(C)([NH2+]Cc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000091062309 1128442529 /nfs/dbraw/zinc/44/25/29/1128442529.db2.gz CGEQAGWWLUEVEC-UHFFFAOYSA-N 1 1 336.395 3.805 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000027557529 1128483313 /nfs/dbraw/zinc/48/33/13/1128483313.db2.gz CMRKXCPSKBMOCN-ZDUSSCGKSA-N 1 1 345.374 3.674 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000027557529 1128483315 /nfs/dbraw/zinc/48/33/15/1128483315.db2.gz CMRKXCPSKBMOCN-ZDUSSCGKSA-N 1 1 345.374 3.674 20 5 EHBDMO COc1cc(N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609977 1128519265 /nfs/dbraw/zinc/51/92/65/1128519265.db2.gz BUCFYTUYAXOSQV-PBHICJAKSA-N 1 1 341.411 3.678 20 5 EHBDMO C[C@@H](C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO)c1ccccc1 ZINC000554279722 1128636810 /nfs/dbraw/zinc/63/68/10/1128636810.db2.gz PLTSFXBABGRSOZ-HOTGVXAUSA-N 1 1 328.412 3.581 20 5 EHBDMO Cc1nc(NCC(C)(C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000301613892 1128745825 /nfs/dbraw/zinc/74/58/25/1128745825.db2.gz AKMHIKSRPXCANT-UHFFFAOYSA-N 1 1 340.427 3.547 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000172766467 1128918655 /nfs/dbraw/zinc/91/86/55/1128918655.db2.gz MZODORQCQLOAGA-UHFFFAOYSA-N 1 1 340.330 3.593 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2cccc(OCC)c2[N+](=O)[O-])CC1 ZINC000542482453 1120551708 /nfs/dbraw/zinc/55/17/08/1120551708.db2.gz SJSKIMZDHONNRN-UHFFFAOYSA-N 1 1 349.475 3.942 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000494647236 1120712452 /nfs/dbraw/zinc/71/24/52/1120712452.db2.gz HQHAIDXAADZRPL-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000494647236 1120712455 /nfs/dbraw/zinc/71/24/55/1120712455.db2.gz HQHAIDXAADZRPL-SFHVURJKSA-N 1 1 344.798 3.880 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2ncccc2[N+](=O)[O-])cc1 ZINC000301069438 1121312233 /nfs/dbraw/zinc/31/22/33/1121312233.db2.gz COPYRWMGQPJMGW-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143306 1121784346 /nfs/dbraw/zinc/78/43/46/1121784346.db2.gz OXLCSTUULHJZSO-IUODEOHRSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032791931 1122102767 /nfs/dbraw/zinc/10/27/67/1122102767.db2.gz WWFFJNWMEIPLFF-WDEREUQCSA-N 1 1 349.337 3.551 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)C1 ZINC000195509023 1123494842 /nfs/dbraw/zinc/49/48/42/1123494842.db2.gz ZHBACGHSTZGZFD-ZDUSSCGKSA-N 1 1 346.456 3.895 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2C)C1 ZINC000609489226 1123590569 /nfs/dbraw/zinc/59/05/69/1123590569.db2.gz CDIYRPCRMZNMEM-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000609631770 1123634857 /nfs/dbraw/zinc/63/48/57/1123634857.db2.gz WFDQFRPVCDOBBW-BPUTZDHNSA-N 1 1 345.443 3.742 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000610133757 1123739173 /nfs/dbraw/zinc/73/91/73/1123739173.db2.gz SUFGRGRJXAHMFI-YPMHNXCESA-N 1 1 345.365 3.923 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)c1ccc(F)c(F)c1 ZINC000180855920 1124090475 /nfs/dbraw/zinc/09/04/75/1124090475.db2.gz UZUXZLFCBNFWLP-UHFFFAOYSA-N 1 1 336.338 3.907 20 5 EHBDMO CN(C)c1nc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000618984976 1125257163 /nfs/dbraw/zinc/25/71/63/1125257163.db2.gz URRDWXYMZCMPNF-OAHLLOKOSA-N 1 1 346.456 3.630 20 5 EHBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccc(F)cc1 ZINC000301880074 1129250877 /nfs/dbraw/zinc/25/08/77/1129250877.db2.gz ZPLFHHVYMVASKC-DLBZAZTESA-N 1 1 333.338 3.730 20 5 EHBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccc(F)cc1 ZINC000301880075 1129251649 /nfs/dbraw/zinc/25/16/49/1129251649.db2.gz ZPLFHHVYMVASKC-IAGOWNOFSA-N 1 1 333.338 3.730 20 5 EHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247734 1129371610 /nfs/dbraw/zinc/37/16/10/1129371610.db2.gz HYTRUVCPMJZSAN-KBPBESRZSA-N 1 1 333.432 3.598 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C(C)C)C1CCCC1 ZINC000068449280 1129371955 /nfs/dbraw/zinc/37/19/55/1129371955.db2.gz KAVPQIYYBPFCDB-UHFFFAOYSA-N 1 1 333.432 3.885 20 5 EHBDMO CCc1ccc([C@H](NCCCC[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403883 1129464008 /nfs/dbraw/zinc/46/40/08/1129464008.db2.gz FIBGCEGNJREGCX-LJQANCHMSA-N 1 1 345.443 3.771 20 5 EHBDMO CCOc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971347 1129465728 /nfs/dbraw/zinc/46/57/28/1129465728.db2.gz GFQJSYWUWVDUKL-APWZRJJASA-N 1 1 341.411 3.851 20 5 EHBDMO Cc1ccc(C[N@@H+](Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436539 1129545926 /nfs/dbraw/zinc/54/59/26/1129545926.db2.gz MSLKURBLPVUAMC-QGZVFWFLSA-N 1 1 330.384 3.677 20 5 EHBDMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436539 1129545928 /nfs/dbraw/zinc/54/59/28/1129545928.db2.gz MSLKURBLPVUAMC-QGZVFWFLSA-N 1 1 330.384 3.677 20 5 EHBDMO COc1cccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000389794507 1129590061 /nfs/dbraw/zinc/59/00/61/1129590061.db2.gz SGRBJJCNIXSKJF-PBHICJAKSA-N 1 1 341.411 3.536 20 5 EHBDMO Cc1ccc(C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638059 1129597814 /nfs/dbraw/zinc/59/78/14/1129597814.db2.gz AFONHTKGFSENQT-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO Cc1ccc(C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638059 1129597815 /nfs/dbraw/zinc/59/78/15/1129597815.db2.gz AFONHTKGFSENQT-HXUWFJFHSA-N 1 1 338.407 3.577 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](CCCCO)C3CC3)o2)c1 ZINC000125693701 1129711119 /nfs/dbraw/zinc/71/11/19/1129711119.db2.gz WUWZNDKQYZZPSN-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032644 1129764548 /nfs/dbraw/zinc/76/45/48/1129764548.db2.gz SPQUPQLHOYTZMS-UKRRQHHQSA-N 1 1 331.441 3.979 20 5 EHBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000302777196 1129791165 /nfs/dbraw/zinc/79/11/65/1129791165.db2.gz FYQJSVMMDNVBLF-CYBMUJFWSA-N 1 1 347.365 3.756 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000302829741 1129794249 /nfs/dbraw/zinc/79/42/49/1129794249.db2.gz JZJQZONPDRCAIM-AWEZNQCLSA-N 1 1 332.448 3.629 20 5 EHBDMO Cc1c(C[N@@H+](C)[C@H](C)c2ccc([S@@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000245472200 1130220123 /nfs/dbraw/zinc/22/01/23/1130220123.db2.gz OSCXTPLFXHBZBX-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1c(C[N@H+](C)[C@H](C)c2ccc([S@@](C)=O)cc2)cccc1[N+](=O)[O-] ZINC000245472200 1130220127 /nfs/dbraw/zinc/22/01/27/1130220127.db2.gz OSCXTPLFXHBZBX-JBEBIEQOSA-N 1 1 346.452 3.834 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000245923008 1130331881 /nfs/dbraw/zinc/33/18/81/1130331881.db2.gz OEWLRVLEYBEWHV-IJLUTSLNSA-N 1 1 339.823 3.553 20 5 EHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000245923008 1130331887 /nfs/dbraw/zinc/33/18/87/1130331887.db2.gz OEWLRVLEYBEWHV-IJLUTSLNSA-N 1 1 339.823 3.553 20 5 EHBDMO CC(C)C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C1CCCC1 ZINC000742146773 1131690495 /nfs/dbraw/zinc/69/04/95/1131690495.db2.gz LARGRIFMLCWFHS-UHFFFAOYSA-N 1 1 343.431 3.711 20 5 EHBDMO Cc1ncccc1C[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913893 1131902663 /nfs/dbraw/zinc/90/26/63/1131902663.db2.gz VMPGMBLUKUNKHB-SFHVURJKSA-N 1 1 325.412 3.678 20 5 EHBDMO CC[N@@H+](CC(=O)OC(C)(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921778 1131905702 /nfs/dbraw/zinc/90/57/02/1131905702.db2.gz SYTJZYDYWGZZPD-INIZCTEOSA-N 1 1 348.443 3.506 20 5 EHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381060 1131914480 /nfs/dbraw/zinc/91/44/80/1131914480.db2.gz TUJABFOPVRSLDP-GDBMZVCRSA-N 1 1 343.431 3.711 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2Cc3cccc(C)c3C2)c1F ZINC001173179701 1131992307 /nfs/dbraw/zinc/99/23/07/1131992307.db2.gz GFYYGKHGJJQQPG-CYBMUJFWSA-N 1 1 344.386 3.998 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2Cc3cccc(C)c3C2)c1F ZINC001173179701 1131992314 /nfs/dbraw/zinc/99/23/14/1131992314.db2.gz GFYYGKHGJJQQPG-CYBMUJFWSA-N 1 1 344.386 3.998 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCc3ccccc3C2)c1F ZINC001173184439 1131993396 /nfs/dbraw/zinc/99/33/96/1131993396.db2.gz NHODXDAGIXSQNL-CYBMUJFWSA-N 1 1 344.386 3.732 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H]3CCC[C@H]32)c1F ZINC001173196493 1131996311 /nfs/dbraw/zinc/99/63/11/1131996311.db2.gz NAAHBAXLNOBTRT-GZBFAFLISA-N 1 1 336.407 3.938 20 5 EHBDMO CCOC(=O)[C@]1(C)CCCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223257 1132005560 /nfs/dbraw/zinc/00/55/60/1132005560.db2.gz ZEFPSUGKFYKGCA-HNAYVOBHSA-N 1 1 348.443 3.581 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC/C=C/c1cccnc1 ZINC001173233421 1132010057 /nfs/dbraw/zinc/01/00/57/1132010057.db2.gz WNEIFMGALGZERO-WUTVXBCWSA-N 1 1 325.412 3.956 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C(=O)c2ccccc2)C1 ZINC001173233806 1132010655 /nfs/dbraw/zinc/01/06/55/1132010655.db2.gz YYWJXLCQEINBSN-CRAIPNDOSA-N 1 1 338.407 3.731 20 5 EHBDMO CCC[N@@H+](CCc1ccccn1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234034 1132010664 /nfs/dbraw/zinc/01/06/64/1132010664.db2.gz OTFFEOSIUWUERX-MRXNPFEDSA-N 1 1 327.428 3.876 20 5 EHBDMO CC[C@@]1(C)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419586 1132087417 /nfs/dbraw/zinc/08/74/17/1132087417.db2.gz KONSKMUVQJYCFE-INIZCTEOSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419586 1132087424 /nfs/dbraw/zinc/08/74/24/1132087424.db2.gz KONSKMUVQJYCFE-INIZCTEOSA-N 1 1 339.823 3.699 20 5 EHBDMO COC(=O)[C@H]1CCCC[C@@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860262 1132582600 /nfs/dbraw/zinc/58/26/00/1132582600.db2.gz VYKFJNJSGUQUPC-QAPCUYQASA-N 1 1 346.427 3.539 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057645 1132646628 /nfs/dbraw/zinc/64/66/28/1132646628.db2.gz WOSRAXVKTSOMDS-BRWVUGGUSA-N 1 1 338.398 3.632 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057645 1132646632 /nfs/dbraw/zinc/64/66/32/1132646632.db2.gz WOSRAXVKTSOMDS-BRWVUGGUSA-N 1 1 338.398 3.632 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H]1COc1ccc(F)cc1 ZINC001176532978 1132958308 /nfs/dbraw/zinc/95/83/08/1132958308.db2.gz OEZIDDRNOZMWKT-INIZCTEOSA-N 1 1 348.349 3.916 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]1COc1ccc(F)cc1 ZINC001176532978 1132958312 /nfs/dbraw/zinc/95/83/12/1132958312.db2.gz OEZIDDRNOZMWKT-INIZCTEOSA-N 1 1 348.349 3.916 20 5 EHBDMO C[C@@H](C[NH+]1CCCCC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001177222949 1133042653 /nfs/dbraw/zinc/04/26/53/1133042653.db2.gz WJTIRJYHCXVUTP-HNNXBMFYSA-N 1 1 343.427 3.819 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC001177483322 1133068418 /nfs/dbraw/zinc/06/84/18/1133068418.db2.gz MPGXRJRTTMWBIX-CQSZACIVSA-N 1 1 333.476 3.812 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC001177483322 1133068423 /nfs/dbraw/zinc/06/84/23/1133068423.db2.gz MPGXRJRTTMWBIX-CQSZACIVSA-N 1 1 333.476 3.812 20 5 EHBDMO C[C@H]1CCSCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001169980185 1133087482 /nfs/dbraw/zinc/08/74/82/1133087482.db2.gz VFWGJPWOSOGIDV-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO C[C@H]1CCSCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001169980185 1133087489 /nfs/dbraw/zinc/08/74/89/1133087489.db2.gz VFWGJPWOSOGIDV-JTQLQIEISA-N 1 1 345.262 3.685 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1Cl ZINC000773700947 1133090412 /nfs/dbraw/zinc/09/04/12/1133090412.db2.gz LGFDFAWLESGVEF-HIFRSBDPSA-N 1 1 338.835 3.887 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000769331654 1133263504 /nfs/dbraw/zinc/26/35/04/1133263504.db2.gz VVUZHVQKGNHOCT-CYBMUJFWSA-N 1 1 325.206 3.732 20 5 EHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC000769402687 1133276759 /nfs/dbraw/zinc/27/67/59/1133276759.db2.gz NKWUNUAKBOMEPI-UHFFFAOYSA-N 1 1 326.343 3.962 20 5 EHBDMO C[C@@H]1COCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000769457804 1133294702 /nfs/dbraw/zinc/29/47/02/1133294702.db2.gz UTNJBYLGSWQLSL-ZDUSSCGKSA-N 1 1 332.425 3.792 20 5 EHBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC[C@H](C2CC2)C1 ZINC000769514971 1133307545 /nfs/dbraw/zinc/30/75/45/1133307545.db2.gz MUZHXKUGVMVRJV-NSHDSACASA-N 1 1 325.206 3.589 20 5 EHBDMO Cc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1Cl ZINC001180253548 1133351559 /nfs/dbraw/zinc/35/15/59/1133351559.db2.gz PIQTVPNCPCDIJC-UHFFFAOYSA-N 1 1 345.830 3.879 20 5 EHBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954224 1133365565 /nfs/dbraw/zinc/36/55/65/1133365565.db2.gz QJRIHCWEQBEFPK-QHRIQVFBSA-N 1 1 344.386 3.775 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CCOc1ccccc1F ZINC001180445087 1133370421 /nfs/dbraw/zinc/37/04/21/1133370421.db2.gz JTXIXGFWFBLYKN-UHFFFAOYSA-N 1 1 332.375 3.862 20 5 EHBDMO CN(C)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC001181472354 1133491145 /nfs/dbraw/zinc/49/11/45/1133491145.db2.gz PXDMEZPSZPCMQG-UHFFFAOYSA-N 1 1 333.476 3.581 20 5 EHBDMO O=[N+]([O-])c1cc2cnn(C[N@@H+]3CC[C@H](c4ccco4)C3)c2c(Cl)c1 ZINC000774627680 1133808538 /nfs/dbraw/zinc/80/85/38/1133808538.db2.gz RABYJTIGUNVURX-NSHDSACASA-N 1 1 346.774 3.638 20 5 EHBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CC[C@H](c4ccco4)C3)c2c(Cl)c1 ZINC000774627680 1133808546 /nfs/dbraw/zinc/80/85/46/1133808546.db2.gz RABYJTIGUNVURX-NSHDSACASA-N 1 1 346.774 3.638 20 5 EHBDMO COC(=O)CC[C@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC001183631246 1133839373 /nfs/dbraw/zinc/83/93/73/1133839373.db2.gz QIQOAOGRRADIJI-RBFDBLARSA-N 1 1 346.427 3.663 20 5 EHBDMO Cc1cc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925741 1134006549 /nfs/dbraw/zinc/00/65/49/1134006549.db2.gz CVJODBUBEIIZLT-ZNMIVQPWSA-N 1 1 335.423 3.884 20 5 EHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886593 1134100145 /nfs/dbraw/zinc/10/01/45/1134100145.db2.gz WGAZCGAXJHFDSH-BBRMVZONSA-N 1 1 341.367 3.881 20 5 EHBDMO CCCC1CCC([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000790480174 1134423071 /nfs/dbraw/zinc/42/30/71/1134423071.db2.gz QUWBWECERCORGY-UHFFFAOYSA-N 1 1 345.447 3.896 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccnc(OC(F)F)c2)c1 ZINC000790634375 1134444279 /nfs/dbraw/zinc/44/42/79/1134444279.db2.gz GPGAOJIFLWFJPV-UHFFFAOYSA-N 1 1 343.717 3.534 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC23CCC3)ccc1Br ZINC000775184918 1134489002 /nfs/dbraw/zinc/48/90/02/1134489002.db2.gz UAKMSXKQXZKMHU-UHFFFAOYSA-N 1 1 325.206 3.876 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC23CCC3)ccc1Br ZINC000775184918 1134489006 /nfs/dbraw/zinc/48/90/06/1134489006.db2.gz UAKMSXKQXZKMHU-UHFFFAOYSA-N 1 1 325.206 3.876 20 5 EHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000747076089 1134689933 /nfs/dbraw/zinc/68/99/33/1134689933.db2.gz LAEZXSFUWVGXFM-MRXNPFEDSA-N 1 1 343.431 3.711 20 5 EHBDMO CSc1ccccc1C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001193974275 1135208468 /nfs/dbraw/zinc/20/84/68/1135208468.db2.gz APAJNQASCLCGNO-UHFFFAOYSA-N 1 1 332.425 3.828 20 5 EHBDMO Cc1ccccc1CC[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001194632761 1135294805 /nfs/dbraw/zinc/29/48/05/1135294805.db2.gz GRDPNQZJMPJOAN-UHFFFAOYSA-N 1 1 328.412 3.847 20 5 EHBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@@H](C)C1 ZINC001194714595 1135311713 /nfs/dbraw/zinc/31/17/13/1135311713.db2.gz IWFYJJRIKUUNMX-PBHICJAKSA-N 1 1 347.459 3.875 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001196898876 1135628366 /nfs/dbraw/zinc/62/83/66/1135628366.db2.gz IEHHQLWWTQOMQR-NXHRZFHOSA-N 1 1 326.371 3.969 20 5 EHBDMO COc1cc2c(cc1OC)[C@@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC001197498202 1135700671 /nfs/dbraw/zinc/70/06/71/1135700671.db2.gz YJUWJTITRRTNEX-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO COc1cc2c(cc1OC)[C@@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])CC2 ZINC001197498202 1135700677 /nfs/dbraw/zinc/70/06/77/1135700677.db2.gz YJUWJTITRRTNEX-CYBMUJFWSA-N 1 1 342.395 3.731 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000809965764 1135904417 /nfs/dbraw/zinc/90/44/17/1135904417.db2.gz OULNSURWTIIPRV-QWRGUYRKSA-N 1 1 345.226 3.760 20 5 EHBDMO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276594 1136130939 /nfs/dbraw/zinc/13/09/39/1136130939.db2.gz KUIQHEYPXLVLRI-APPDUMDISA-N 1 1 336.338 3.599 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851550 1136261324 /nfs/dbraw/zinc/26/13/24/1136261324.db2.gz SMMDYKIBYGWRCN-FZKQIMNGSA-N 1 1 332.375 3.678 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000851907518 1136418503 /nfs/dbraw/zinc/41/85/03/1136418503.db2.gz UTMUXDKQVPLFQL-LLVKDONJSA-N 1 1 333.319 3.801 20 5 EHBDMO Cc1[nH+]ccn1-c1ncccc1CNc1c(Cl)cccc1[N+](=O)[O-] ZINC000814365144 1136441903 /nfs/dbraw/zinc/44/19/03/1136441903.db2.gz AALWIKVBXIPALU-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(F)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580586 1136444942 /nfs/dbraw/zinc/44/49/42/1136444942.db2.gz WQHYSQOCZCSCFH-GOSISDBHSA-N 1 1 332.375 3.678 20 5 EHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589396 1136450660 /nfs/dbraw/zinc/45/06/60/1136450660.db2.gz RXSUDWBTYMYSEA-IEBWSBKVSA-N 1 1 328.412 3.581 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589395 1136452611 /nfs/dbraw/zinc/45/26/11/1136452611.db2.gz RXSUDWBTYMYSEA-HKUYNNGSSA-N 1 1 328.412 3.581 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000858038965 1136934592 /nfs/dbraw/zinc/93/45/92/1136934592.db2.gz QVAUXUNRUQCEMS-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)nc1 ZINC000858038965 1136934594 /nfs/dbraw/zinc/93/45/94/1136934594.db2.gz QVAUXUNRUQCEMS-HNNXBMFYSA-N 1 1 347.802 3.605 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3coc(C4CC4)n3)C2)cc1 ZINC000824820503 1137153706 /nfs/dbraw/zinc/15/37/06/1137153706.db2.gz GRJVABSXFUYNQO-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3coc(C4CC4)n3)C2)cc1 ZINC000824820503 1137153707 /nfs/dbraw/zinc/15/37/07/1137153707.db2.gz GRJVABSXFUYNQO-OAHLLOKOSA-N 1 1 327.384 3.840 20 5 EHBDMO Cc1nn(C)c(Cl)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821145 1137154008 /nfs/dbraw/zinc/15/40/08/1137154008.db2.gz VCRIQEPDUPMWOL-AWEZNQCLSA-N 1 1 348.834 3.670 20 5 EHBDMO O=c1[nH]c2c(cc1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CCCC2 ZINC000865879623 1137318368 /nfs/dbraw/zinc/31/83/68/1137318368.db2.gz PEVCZUCHLXYRCT-UHFFFAOYSA-N 1 1 347.802 3.517 20 5 EHBDMO CCn1cc(C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C(C)C)cn1 ZINC000846054496 1137330986 /nfs/dbraw/zinc/33/09/86/1137330986.db2.gz CNVXHCZZOZAUTE-UHFFFAOYSA-N 1 1 336.823 3.875 20 5 EHBDMO CCn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C(C)C)cn1 ZINC000846054496 1137330988 /nfs/dbraw/zinc/33/09/88/1137330988.db2.gz CNVXHCZZOZAUTE-UHFFFAOYSA-N 1 1 336.823 3.875 20 5 EHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCCC2)CC1 ZINC001171911648 1137518149 /nfs/dbraw/zinc/51/81/49/1137518149.db2.gz TWRAJFFSTYZJCP-HNNXBMFYSA-N 1 1 345.443 3.968 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(C2CC2)cnn1C ZINC000872086050 1137570471 /nfs/dbraw/zinc/57/04/71/1137570471.db2.gz RGPXKLDFDNOFEZ-NSHDSACASA-N 1 1 346.456 3.778 20 5 EHBDMO Cc1csc([C@@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813828 1137690977 /nfs/dbraw/zinc/69/09/77/1137690977.db2.gz PKNJCVQOEWWUBX-ZDTYVGOBSA-N 1 1 329.425 3.862 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC12CCC2 ZINC000878337485 1137711373 /nfs/dbraw/zinc/71/13/73/1137711373.db2.gz LGVSXYQMCGHMBB-ZDUSSCGKSA-N 1 1 342.399 3.657 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000130200377 1137834853 /nfs/dbraw/zinc/83/48/53/1137834853.db2.gz OTGXWERYXALWKM-GOSISDBHSA-N 1 1 348.349 3.571 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CC1(CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000883254126 1137850632 /nfs/dbraw/zinc/85/06/32/1137850632.db2.gz KTUMHROBZLGDPA-QGZVFWFLSA-N 1 1 340.427 3.588 20 5 EHBDMO Cc1ccc(C)n1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000332492252 1137945423 /nfs/dbraw/zinc/94/54/23/1137945423.db2.gz ZXOYGNFXKDRMDK-UHFFFAOYSA-N 1 1 331.391 3.989 20 5 EHBDMO COc1cccc([C@@H]2CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2(C)C)c1 ZINC000886316743 1138066702 /nfs/dbraw/zinc/06/67/02/1138066702.db2.gz LJMLYIXJHGKRCJ-KRWDZBQOSA-N 1 1 341.411 3.767 20 5 EHBDMO C[C@@H]1SCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000089902797 1138207241 /nfs/dbraw/zinc/20/72/41/1138207241.db2.gz LWRAYLOORGJUGR-RYUDHWBXSA-N 1 1 333.413 3.576 20 5 EHBDMO C[C@@H]1SCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000089902797 1138207243 /nfs/dbraw/zinc/20/72/43/1138207243.db2.gz LWRAYLOORGJUGR-RYUDHWBXSA-N 1 1 333.413 3.576 20 5 EHBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093838973 1138241640 /nfs/dbraw/zinc/24/16/40/1138241640.db2.gz MTYZMJDLRAKORV-AWEZNQCLSA-N 1 1 330.384 3.713 20 5 EHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337261168 1138512472 /nfs/dbraw/zinc/51/24/72/1138512472.db2.gz XSBIQZQGPMDLGV-CQSZACIVSA-N 1 1 339.395 3.543 20 5 EHBDMO COC(=O)c1oc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000180399951 1139831581 /nfs/dbraw/zinc/83/15/81/1139831581.db2.gz JFKKXJUJVGFOLR-VXGBXAGGSA-N 1 1 332.356 3.695 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000183390685 1140034478 /nfs/dbraw/zinc/03/44/78/1140034478.db2.gz CFDGOWWVLFTIAE-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000183390685 1140034484 /nfs/dbraw/zinc/03/44/84/1140034484.db2.gz CFDGOWWVLFTIAE-SHACYNPGSA-N 1 1 346.452 3.834 20 5 EHBDMO CCOc1ccccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000268847085 1141006529 /nfs/dbraw/zinc/00/65/29/1141006529.db2.gz GKZFNMPVFZHSCM-CYBMUJFWSA-N 1 1 330.384 3.853 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCc4c[nH]nc43)o2)cc1 ZINC000268883850 1141017872 /nfs/dbraw/zinc/01/78/72/1141017872.db2.gz YMBNAKKVYCNFFY-MRXNPFEDSA-N 1 1 338.367 3.745 20 5 EHBDMO CC(C)N(C(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271683318 1141417987 /nfs/dbraw/zinc/41/79/87/1141417987.db2.gz CZPOZJYHCVYNJD-OAHLLOKOSA-N 1 1 341.411 3.687 20 5 EHBDMO CCOC1CC([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339204347 1141527132 /nfs/dbraw/zinc/52/71/32/1141527132.db2.gz ZNCRRDAFWWRVGA-UHFFFAOYSA-N 1 1 332.322 3.613 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000430197057 1014831924 /nfs/dbraw/zinc/83/19/24/1014831924.db2.gz TZHMJCWARIIYSC-OAHLLOKOSA-N 1 1 342.395 3.504 20 5 EHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820335 1015017843 /nfs/dbraw/zinc/01/78/43/1015017843.db2.gz QEQGBOHBUQOJKT-XFFZJAGNSA-N 1 1 326.396 3.757 20 5 EHBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430216169 1015041501 /nfs/dbraw/zinc/04/15/01/1015041501.db2.gz IAXJCFOPSBMLJN-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000430216894 1015062752 /nfs/dbraw/zinc/06/27/52/1015062752.db2.gz GLMLCPXFXQTZLG-NSHDSACASA-N 1 1 335.429 3.870 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000430216894 1015062761 /nfs/dbraw/zinc/06/27/61/1015062761.db2.gz GLMLCPXFXQTZLG-NSHDSACASA-N 1 1 335.429 3.870 20 5 EHBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154709286 1015772358 /nfs/dbraw/zinc/77/23/58/1015772358.db2.gz WXYPIVGOOPQQJI-CQSZACIVSA-N 1 1 329.400 3.938 20 5 EHBDMO Cc1ccc(C[C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)cc1 ZINC001167263977 1016867478 /nfs/dbraw/zinc/86/74/78/1016867478.db2.gz HAZSLYQOCFOPDU-QGZVFWFLSA-N 1 1 325.412 3.753 20 5 EHBDMO CC[N@@H+](C[C@H]1COc2ccccc2O1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189005 1032368621 /nfs/dbraw/zinc/36/86/21/1032368621.db2.gz FKGWQLJOKCEKOP-GJZGRUSLSA-N 1 1 342.395 3.818 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c(Cl)c1 ZINC000459755160 1032447135 /nfs/dbraw/zinc/44/71/35/1032447135.db2.gz NRXPFOYZWLOTNT-DOTOQJQBSA-N 1 1 338.835 3.621 20 5 EHBDMO CCn1nc(C)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000449497177 1032670138 /nfs/dbraw/zinc/67/01/38/1032670138.db2.gz IGWXTWJOEDVMGK-KRWDZBQOSA-N 1 1 342.443 3.808 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc(O)c1 ZINC000181530094 1017124420 /nfs/dbraw/zinc/12/44/20/1017124420.db2.gz RCWCKGSYLNAKLN-ZDUSSCGKSA-N 1 1 330.384 3.938 20 5 EHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892730071 1017241211 /nfs/dbraw/zinc/24/12/11/1017241211.db2.gz DLCPEHQSPLDYCW-LBPRGKRZSA-N 1 1 348.834 3.574 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2cccs2)o1 ZINC000549170466 1017486379 /nfs/dbraw/zinc/48/63/79/1017486379.db2.gz INRLOGRMKALEQN-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2cccs2)o1 ZINC000549170466 1017486387 /nfs/dbraw/zinc/48/63/87/1017486387.db2.gz INRLOGRMKALEQN-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000118849882 1017990067 /nfs/dbraw/zinc/99/00/67/1017990067.db2.gz WALCDVDUTBFCFG-INWMFGNUSA-N 1 1 342.399 3.798 20 5 EHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410598 1018933255 /nfs/dbraw/zinc/93/32/55/1018933255.db2.gz VJCAACNBIZWXAK-PWSUYJOCSA-N 1 1 344.358 3.825 20 5 EHBDMO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1cccc([N+](=O)[O-])c1 ZINC000379623373 1019002213 /nfs/dbraw/zinc/00/22/13/1019002213.db2.gz IGQMNGHBWOTJHQ-UHFFFAOYSA-N 1 1 327.428 3.595 20 5 EHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1cccc([N+](=O)[O-])c1 ZINC000379623373 1019002229 /nfs/dbraw/zinc/00/22/29/1019002229.db2.gz IGQMNGHBWOTJHQ-UHFFFAOYSA-N 1 1 327.428 3.595 20 5 EHBDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449616047 1032886487 /nfs/dbraw/zinc/88/64/87/1032886487.db2.gz BMSTXRAFPXJPKU-MRXNPFEDSA-N 1 1 344.411 3.838 20 5 EHBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])s1 ZINC000337016026 1020542457 /nfs/dbraw/zinc/54/24/57/1020542457.db2.gz LRDMJSKOASGQSM-CQSZACIVSA-N 1 1 334.445 3.620 20 5 EHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000393853548 1021078831 /nfs/dbraw/zinc/07/88/31/1021078831.db2.gz XBVIWQYUTFVSBC-DOTOQJQBSA-N 1 1 325.412 3.917 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054174814 1021168224 /nfs/dbraw/zinc/16/82/24/1021168224.db2.gz OATSFIDWGYPRMQ-UHFFFAOYSA-N 1 1 345.468 3.673 20 5 EHBDMO CCCCOc1ncccc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516313781 1021290764 /nfs/dbraw/zinc/29/07/64/1021290764.db2.gz WDMWNHHGWBVQDV-KRWDZBQOSA-N 1 1 341.411 3.946 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000157895723 1021513643 /nfs/dbraw/zinc/51/36/43/1021513643.db2.gz HUKSTPBGYFEXHJ-OAHLLOKOSA-N 1 1 342.395 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccn(Cc2ccccc2)n1 ZINC000516877819 1021808977 /nfs/dbraw/zinc/80/89/77/1021808977.db2.gz NRBZJEYLATULSK-IBGZPJMESA-N 1 1 348.406 3.617 20 5 EHBDMO C[N@@H+](CCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000276683510 1022239939 /nfs/dbraw/zinc/23/99/39/1022239939.db2.gz QYTKWCDFBKEFEZ-UHFFFAOYSA-N 1 1 338.791 3.713 20 5 EHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187579990 1022356531 /nfs/dbraw/zinc/35/65/31/1022356531.db2.gz NTHYTJTUZOGIFI-DYVFJYSZSA-N 1 1 328.416 3.616 20 5 EHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184264169 1022679388 /nfs/dbraw/zinc/67/93/88/1022679388.db2.gz MTDPJXCVFOAZGU-NSHDSACASA-N 1 1 330.425 3.706 20 5 EHBDMO CCC1(CC)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000438493833 1022721708 /nfs/dbraw/zinc/72/17/08/1022721708.db2.gz MTGQFVCZXXDGIP-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000610582241 1022796587 /nfs/dbraw/zinc/79/65/87/1022796587.db2.gz PQYHFEPPXLQIFY-SFHVURJKSA-N 1 1 327.384 3.596 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn4ccnc4s3)C2)cc1 ZINC000894722121 1022818143 /nfs/dbraw/zinc/81/81/43/1022818143.db2.gz ILSODVDMWCWXSL-AWEZNQCLSA-N 1 1 342.424 3.684 20 5 EHBDMO COc1ccc([C@H](C)[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058932682 1033085612 /nfs/dbraw/zinc/08/56/12/1033085612.db2.gz VUVSZXOFIPRTNH-AWEZNQCLSA-N 1 1 330.384 3.675 20 5 EHBDMO Cc1ncc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684817 1033085780 /nfs/dbraw/zinc/08/57/80/1033085780.db2.gz IQIBPTJSJWHWRW-YOEHRIQHSA-N 1 1 340.427 3.942 20 5 EHBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1c2ccccc2cc2ccccc21 ZINC001270377288 1022924316 /nfs/dbraw/zinc/92/43/16/1022924316.db2.gz RQGUJBKKDIZAFB-HDICACEKSA-N 1 1 330.431 3.912 20 5 EHBDMO Cc1ccc(N2CCC(Nc3ccc(C)cc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000080657476 1023283504 /nfs/dbraw/zinc/28/35/04/1023283504.db2.gz FFQANGNXXBBTQB-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cc3nccs3)CC2)c(F)c1 ZINC000602735779 1033126409 /nfs/dbraw/zinc/12/64/09/1033126409.db2.gz XVFXLULWUMOSSH-UHFFFAOYSA-N 1 1 335.404 3.645 20 5 EHBDMO Cn1cc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])n1 ZINC000602788616 1033161982 /nfs/dbraw/zinc/16/19/82/1033161982.db2.gz QZXBOMXOISHNCH-UHFFFAOYSA-N 1 1 343.214 3.660 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288586 1024012599 /nfs/dbraw/zinc/01/25/99/1024012599.db2.gz YEGPFBVVNKFQJR-QWHCGFSZSA-N 1 1 336.823 3.569 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000749810682 1024549930 /nfs/dbraw/zinc/54/99/30/1024549930.db2.gz MRKBNWIYZKAXQS-KGLIPLIRSA-N 1 1 349.431 3.597 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000749810682 1024549939 /nfs/dbraw/zinc/54/99/39/1024549939.db2.gz MRKBNWIYZKAXQS-KGLIPLIRSA-N 1 1 349.431 3.597 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000749810683 1024551179 /nfs/dbraw/zinc/55/11/79/1024551179.db2.gz MRKBNWIYZKAXQS-UONOGXRCSA-N 1 1 349.431 3.597 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000749810683 1024551185 /nfs/dbraw/zinc/55/11/85/1024551185.db2.gz MRKBNWIYZKAXQS-UONOGXRCSA-N 1 1 349.431 3.597 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000065532615 1024658386 /nfs/dbraw/zinc/65/83/86/1024658386.db2.gz QCWVQGOVDWEYIO-LJQANCHMSA-N 1 1 342.395 3.819 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000052865833 1024736216 /nfs/dbraw/zinc/73/62/16/1024736216.db2.gz IBWCQCROYSQUHO-SFHVURJKSA-N 1 1 326.396 3.776 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000052865833 1024736231 /nfs/dbraw/zinc/73/62/31/1024736231.db2.gz IBWCQCROYSQUHO-SFHVURJKSA-N 1 1 326.396 3.776 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](CCCO)C3)s2)cc1 ZINC000449791155 1033234852 /nfs/dbraw/zinc/23/48/52/1033234852.db2.gz NVEOUPQJHBLZKD-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO C[C@H]1C[C@@H](C[NH3+])CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371217 1024856933 /nfs/dbraw/zinc/85/69/33/1024856933.db2.gz LYFSNRFNLKWPGL-RYUDHWBXSA-N 1 1 349.818 3.677 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)CO1 ZINC000508042011 1024867113 /nfs/dbraw/zinc/86/71/13/1024867113.db2.gz QUYKRFXKIVUNQK-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)CO1 ZINC000508042011 1024867131 /nfs/dbraw/zinc/86/71/31/1024867131.db2.gz QUYKRFXKIVUNQK-STQMWFEESA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123993 1025035341 /nfs/dbraw/zinc/03/53/41/1025035341.db2.gz SHVSOWIRZUZHPQ-LBPRGKRZSA-N 1 1 336.338 3.945 20 5 EHBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039192 1025073184 /nfs/dbraw/zinc/07/31/84/1025073184.db2.gz CNZJESPUWZGWOK-GDBMZVCRSA-N 1 1 347.459 3.693 20 5 EHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000435771461 1025130721 /nfs/dbraw/zinc/13/07/21/1025130721.db2.gz VOHYUQIXEQIWJC-KRWDZBQOSA-N 1 1 346.431 3.513 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1OC(F)F ZINC000511065717 1025174792 /nfs/dbraw/zinc/17/47/92/1025174792.db2.gz PDJNHLJZANFVSB-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO Cc1ccccc1[C@H]([C@@H](C)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000443008630 1025660207 /nfs/dbraw/zinc/66/02/07/1025660207.db2.gz GZNMZXXGYBGRAL-BEFAXECRSA-N 1 1 327.428 3.684 20 5 EHBDMO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1)N(C)C ZINC000443012250 1025662551 /nfs/dbraw/zinc/66/25/51/1025662551.db2.gz IQYHPLFWDOGUSL-DYVFJYSZSA-N 1 1 333.457 3.746 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000121234582 1025934726 /nfs/dbraw/zinc/93/47/26/1025934726.db2.gz SRWZPNABAVQJCL-HNNXBMFYSA-N 1 1 328.416 3.821 20 5 EHBDMO CC1CCN(CC[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548075 1026098059 /nfs/dbraw/zinc/09/80/59/1026098059.db2.gz MIKHBQYVUQROIW-SFHVURJKSA-N 1 1 331.460 3.506 20 5 EHBDMO CC1CCN(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548075 1026098075 /nfs/dbraw/zinc/09/80/75/1026098075.db2.gz MIKHBQYVUQROIW-SFHVURJKSA-N 1 1 331.460 3.506 20 5 EHBDMO CC(C)Cc1noc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451565714 1026117770 /nfs/dbraw/zinc/11/77/70/1026117770.db2.gz LTFHDJZEHPDSAI-OAHLLOKOSA-N 1 1 344.415 3.556 20 5 EHBDMO CC(C)Cc1noc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451565714 1026117780 /nfs/dbraw/zinc/11/77/80/1026117780.db2.gz LTFHDJZEHPDSAI-OAHLLOKOSA-N 1 1 344.415 3.556 20 5 EHBDMO CC(C)O[C@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000428344338 1026881399 /nfs/dbraw/zinc/88/13/99/1026881399.db2.gz BKCJWIYJWHYPIM-LJQANCHMSA-N 1 1 341.411 3.514 20 5 EHBDMO CC(C)O[C@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000428344338 1026881407 /nfs/dbraw/zinc/88/14/07/1026881407.db2.gz BKCJWIYJWHYPIM-LJQANCHMSA-N 1 1 341.411 3.514 20 5 EHBDMO CC(C)c1ccc(CN[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200571 1027077997 /nfs/dbraw/zinc/07/79/97/1027077997.db2.gz CPVROQRQISIXSF-HOTGVXAUSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(C[NH2+][C@@H](C)CN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200571 1027078001 /nfs/dbraw/zinc/07/80/01/1027078001.db2.gz CPVROQRQISIXSF-HOTGVXAUSA-N 1 1 333.476 3.928 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413172861 1027210426 /nfs/dbraw/zinc/21/04/26/1027210426.db2.gz GCZXUORFIXRFPA-ZFWWWQNUSA-N 1 1 344.390 3.594 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413188174 1027234015 /nfs/dbraw/zinc/23/40/15/1027234015.db2.gz TXPJIMTWDAPQGC-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000277845600 1027249856 /nfs/dbraw/zinc/24/98/56/1027249856.db2.gz SMMASRNHWLXDDK-SLEUVZQESA-N 1 1 346.349 3.599 20 5 EHBDMO C[N@@H+](CCc1cccc(Nc2ncc([N+](=O)[O-])cc2F)c1)C1CC1 ZINC000413220992 1027307236 /nfs/dbraw/zinc/30/72/36/1027307236.db2.gz IFHZEEVZGBMBIQ-UHFFFAOYSA-N 1 1 330.363 3.509 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000611941715 1027659436 /nfs/dbraw/zinc/65/94/36/1027659436.db2.gz YAGWWDYIMCLDAF-QIAWRQBBSA-N 1 1 346.456 3.848 20 5 EHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000611941715 1027659441 /nfs/dbraw/zinc/65/94/41/1027659441.db2.gz YAGWWDYIMCLDAF-QIAWRQBBSA-N 1 1 346.456 3.848 20 5 EHBDMO Cc1nc(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781589 1027788601 /nfs/dbraw/zinc/78/86/01/1027788601.db2.gz BQOJWUNUAQKKFM-YOEHRIQHSA-N 1 1 340.427 3.621 20 5 EHBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391410 1027796362 /nfs/dbraw/zinc/79/63/62/1027796362.db2.gz XQEKOAKWZBNORR-INIZCTEOSA-N 1 1 334.416 3.862 20 5 EHBDMO COc1ccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000420954101 1027916713 /nfs/dbraw/zinc/91/67/13/1027916713.db2.gz UGMQSGMJZKEDPF-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO COc1ccc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000420954101 1027916725 /nfs/dbraw/zinc/91/67/25/1027916725.db2.gz UGMQSGMJZKEDPF-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO Cc1cnc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656081 1028046222 /nfs/dbraw/zinc/04/62/22/1028046222.db2.gz ORPDITTUJGKMLN-AWEZNQCLSA-N 1 1 346.456 3.684 20 5 EHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444592101 1028053796 /nfs/dbraw/zinc/05/37/96/1028053796.db2.gz FBERMGZIDYPEDL-GFCCVEGCSA-N 1 1 340.383 3.673 20 5 EHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444592101 1028053814 /nfs/dbraw/zinc/05/38/14/1028053814.db2.gz FBERMGZIDYPEDL-GFCCVEGCSA-N 1 1 340.383 3.673 20 5 EHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1C ZINC000444677653 1028148612 /nfs/dbraw/zinc/14/86/12/1028148612.db2.gz QAQYSSVWMJBBAW-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681887 1028151950 /nfs/dbraw/zinc/15/19/50/1028151950.db2.gz RULKDUNXTZRSIV-WMLDXEAASA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cccc(Cl)c2OC)cc1[N+](=O)[O-] ZINC000897483093 1028268650 /nfs/dbraw/zinc/26/86/50/1028268650.db2.gz JAIPPAQPGRQHMQ-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO C[NH2+]C[C@H](C)CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285349 1028322276 /nfs/dbraw/zinc/32/22/76/1028322276.db2.gz ZJWABFRPJBNPGT-STQMWFEESA-N 1 1 333.457 3.829 20 5 EHBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369117 1028328823 /nfs/dbraw/zinc/32/88/23/1028328823.db2.gz XVUCUWGEVRCRJP-ZIAGYGMSSA-N 1 1 346.452 3.774 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419802 1028435654 /nfs/dbraw/zinc/43/56/54/1028435654.db2.gz JKZDDISUZZNVNM-AWEZNQCLSA-N 1 1 330.384 3.675 20 5 EHBDMO CC[N@H+](C)[C@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000504222479 1028512642 /nfs/dbraw/zinc/51/26/42/1028512642.db2.gz FCKKEEWAKDDMEG-INIZCTEOSA-N 1 1 338.367 3.686 20 5 EHBDMO CC[N@@H+](C)[C@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000504222479 1028512647 /nfs/dbraw/zinc/51/26/47/1028512647.db2.gz FCKKEEWAKDDMEG-INIZCTEOSA-N 1 1 338.367 3.686 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H](CC(C)C)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899742 1029042240 /nfs/dbraw/zinc/04/22/40/1029042240.db2.gz LISZDSVWIXGMLD-ZBFHGGJFSA-N 1 1 337.464 3.620 20 5 EHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)CN(C)C ZINC000504911815 1029052035 /nfs/dbraw/zinc/05/20/35/1029052035.db2.gz LWDXRVYVJYQILU-AWEZNQCLSA-N 1 1 339.505 3.643 20 5 EHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000052183668 1029234525 /nfs/dbraw/zinc/23/45/25/1029234525.db2.gz MSGUIRSYDQBKTE-HNNXBMFYSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000052183667 1029235812 /nfs/dbraw/zinc/23/58/12/1029235812.db2.gz MSGUIRSYDQBKTE-OAHLLOKOSA-N 1 1 340.427 3.976 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc2c(c1)OCO2 ZINC000237465815 1029483118 /nfs/dbraw/zinc/48/31/18/1029483118.db2.gz XIPAXVFSHBMJLY-SNVBAGLBSA-N 1 1 334.759 3.828 20 5 EHBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988781 1029575299 /nfs/dbraw/zinc/57/52/99/1029575299.db2.gz JSICUHZRMWEXML-TVQRCGJNSA-N 1 1 329.322 3.508 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000533293613 1029587563 /nfs/dbraw/zinc/58/75/63/1029587563.db2.gz WASKHZUVYVWYTL-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO CCC1(CC)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000446721487 1029773239 /nfs/dbraw/zinc/77/32/39/1029773239.db2.gz UTYHSJBEWFWPIX-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000245515288 1030109495 /nfs/dbraw/zinc/10/94/95/1030109495.db2.gz DJQBSAGIKSFGQZ-RVKKMQEKSA-N 1 1 328.416 3.744 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000159448554 1030202545 /nfs/dbraw/zinc/20/25/45/1030202545.db2.gz FAZQYTPBLRUVKC-MNOVXSKESA-N 1 1 349.337 3.551 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1COc3ccc(F)cc31)CCC2 ZINC000447595745 1030331602 /nfs/dbraw/zinc/33/16/02/1030331602.db2.gz AOTLUSMQTYFAKJ-DLBZAZTESA-N 1 1 328.343 3.835 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccc1)C[C@H](C)O ZINC000527304335 1030767573 /nfs/dbraw/zinc/76/75/73/1030767573.db2.gz AQYOAMXUWBKYFF-NIFLVVHWSA-N 1 1 340.423 3.881 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc4ccccc4c3)C2)nc1 ZINC000237998931 1030810300 /nfs/dbraw/zinc/81/03/00/1030810300.db2.gz DYSAPZMXKCHHBR-SFHVURJKSA-N 1 1 348.406 3.829 20 5 EHBDMO COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1cncs1 ZINC000448367481 1031019051 /nfs/dbraw/zinc/01/90/51/1031019051.db2.gz QIKIGODMRUCMTO-ZSOIEALJSA-N 1 1 347.440 3.603 20 5 EHBDMO COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1cncs1 ZINC000448367481 1031019065 /nfs/dbraw/zinc/01/90/65/1031019065.db2.gz QIKIGODMRUCMTO-ZSOIEALJSA-N 1 1 347.440 3.603 20 5 EHBDMO C[C@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C ZINC000161118754 1031337366 /nfs/dbraw/zinc/33/73/66/1031337366.db2.gz OYIGLBRRJYIXCG-CMPLNLGQSA-N 1 1 331.338 3.533 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161145753 1031357923 /nfs/dbraw/zinc/35/79/23/1031357923.db2.gz PDQXHOAEAXOKNL-VQIMIIECSA-N 1 1 348.443 3.509 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000343566051 1031424714 /nfs/dbraw/zinc/42/47/14/1031424714.db2.gz KVZVFMNUOAMSEY-UHFFFAOYSA-N 1 1 347.440 3.550 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CCC(C)CC1 ZINC000063482942 1033388292 /nfs/dbraw/zinc/38/82/92/1033388292.db2.gz PBYHVENMWUTLCW-UHFFFAOYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)Oc1ncccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594493867 1033394630 /nfs/dbraw/zinc/39/46/30/1033394630.db2.gz NQSQNWPLRYRRTI-MRXNPFEDSA-N 1 1 327.384 3.554 20 5 EHBDMO CC[NH+](CC)[C@H](CNCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000061015193 1033432411 /nfs/dbraw/zinc/43/24/11/1033432411.db2.gz MLOKIEYPTBOQRI-LJQANCHMSA-N 1 1 327.428 3.768 20 5 EHBDMO COc1cccc([N+](=O)[O-])c1NCc1ccc(C)[nH+]c1N1CCCC1 ZINC000594575058 1033458759 /nfs/dbraw/zinc/45/87/59/1033458759.db2.gz NSPBNMLANRFKBG-UHFFFAOYSA-N 1 1 342.399 3.519 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000063618735 1033521309 /nfs/dbraw/zinc/52/13/09/1033521309.db2.gz DXPFMKTYUFRFKS-GFCCVEGCSA-N 1 1 344.358 3.825 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583492 1033573908 /nfs/dbraw/zinc/57/39/08/1033573908.db2.gz KKHBVVLBNFZYOE-WBVHZDCISA-N 1 1 325.412 3.775 20 5 EHBDMO COc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)ccc1Cl ZINC000598961944 1033596130 /nfs/dbraw/zinc/59/61/30/1033596130.db2.gz DCOMGURAQYMNLE-UHFFFAOYSA-N 1 1 336.775 3.555 20 5 EHBDMO CCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057256 1033635869 /nfs/dbraw/zinc/63/58/69/1033635869.db2.gz VYNJIYOEZZSXNR-DZGCQCFKSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057256 1033635878 /nfs/dbraw/zinc/63/58/78/1033635878.db2.gz VYNJIYOEZZSXNR-DZGCQCFKSA-N 1 1 335.448 3.517 20 5 EHBDMO COc1cccc(C2([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000595029661 1033650231 /nfs/dbraw/zinc/65/02/31/1033650231.db2.gz JXJXMWRPMFQGHN-ZDUSSCGKSA-N 1 1 342.395 3.952 20 5 EHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(OC(C)C)ccn2)cc1[N+](=O)[O-] ZINC000593021332 1033832940 /nfs/dbraw/zinc/83/29/40/1033832940.db2.gz VRKGXKPATGQYPL-CQSZACIVSA-N 1 1 329.400 3.936 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000595553797 1033858567 /nfs/dbraw/zinc/85/85/67/1033858567.db2.gz NRASDKAVIPHIBQ-KRWDZBQOSA-N 1 1 334.391 3.515 20 5 EHBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670815 1033942734 /nfs/dbraw/zinc/94/27/34/1033942734.db2.gz DNPVLWXDCHTWLD-IAQYHMDHSA-N 1 1 346.349 3.597 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000603836687 1033961719 /nfs/dbraw/zinc/96/17/19/1033961719.db2.gz ALICYFQZFVOBPC-UHFFFAOYSA-N 1 1 330.359 3.777 20 5 EHBDMO COCCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000599506615 1033966010 /nfs/dbraw/zinc/96/60/10/1033966010.db2.gz OONPFGUFNGMHOI-UHFFFAOYSA-N 1 1 346.349 3.862 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](C4CCC4)C3)n2)cc1 ZINC000595837053 1034001511 /nfs/dbraw/zinc/00/15/11/1034001511.db2.gz OHFZYDNSGHXYIQ-OAHLLOKOSA-N 1 1 342.399 3.657 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2(C)C)c1[N+](=O)[O-] ZINC000599621169 1034039174 /nfs/dbraw/zinc/03/91/74/1034039174.db2.gz DCBNGYMZRJHIJK-AWEZNQCLSA-N 1 1 333.363 3.798 20 5 EHBDMO Cc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093692 1034079284 /nfs/dbraw/zinc/07/92/84/1034079284.db2.gz DPIRGJCUGCTNFT-DOTOQJQBSA-N 1 1 331.460 3.676 20 5 EHBDMO COc1cc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596096601 1034081224 /nfs/dbraw/zinc/08/12/24/1034081224.db2.gz VGJMZCBBMKZPOT-LBPRGKRZSA-N 1 1 341.839 3.789 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000604435389 1034377748 /nfs/dbraw/zinc/37/77/48/1034377748.db2.gz UQABKOFDHMNJKZ-GOSISDBHSA-N 1 1 345.443 3.886 20 5 EHBDMO COCc1csc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000596980263 1034478703 /nfs/dbraw/zinc/47/87/03/1034478703.db2.gz YILAGUATNDXVNT-UHFFFAOYSA-N 1 1 332.425 3.967 20 5 EHBDMO COCc1csc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000596980263 1034478711 /nfs/dbraw/zinc/47/87/11/1034478711.db2.gz YILAGUATNDXVNT-UHFFFAOYSA-N 1 1 332.425 3.967 20 5 EHBDMO COc1cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000463486593 1035555047 /nfs/dbraw/zinc/55/50/47/1035555047.db2.gz IRGWMGMMSJPPQU-MRXNPFEDSA-N 1 1 330.359 3.862 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000463486593 1035555062 /nfs/dbraw/zinc/55/50/62/1035555062.db2.gz IRGWMGMMSJPPQU-MRXNPFEDSA-N 1 1 330.359 3.862 20 5 EHBDMO O=[N+]([O-])c1cccnc1NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000386471256 1035661071 /nfs/dbraw/zinc/66/10/71/1035661071.db2.gz UUMXEUUIOZNXEC-QGZVFWFLSA-N 1 1 340.427 3.704 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc(N2CCCC2)nc1 ZINC000892542796 1035780599 /nfs/dbraw/zinc/78/05/99/1035780599.db2.gz UFBHWFLWFWIQJO-UHFFFAOYSA-N 1 1 346.818 3.533 20 5 EHBDMO Cc1nnc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 ZINC000540942550 1035827950 /nfs/dbraw/zinc/82/79/50/1035827950.db2.gz DPDPMYJPXVAKJF-UHFFFAOYSA-N 1 1 346.437 3.773 20 5 EHBDMO C[N@H+](CCCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541073475 1035953592 /nfs/dbraw/zinc/95/35/92/1035953592.db2.gz ZNDUVFIKCPUWBD-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO C[N@@H+](CCCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541073475 1035953602 /nfs/dbraw/zinc/95/36/02/1035953602.db2.gz ZNDUVFIKCPUWBD-UHFFFAOYSA-N 1 1 342.823 3.802 20 5 EHBDMO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)Cc1ccc(OC)cc1OC ZINC000508645138 1036079313 /nfs/dbraw/zinc/07/93/13/1036079313.db2.gz KPTVDLHWWCRCHS-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)Cc1ccc(OC)cc1OC ZINC000508645138 1036079329 /nfs/dbraw/zinc/07/93/29/1036079329.db2.gz KPTVDLHWWCRCHS-UHFFFAOYSA-N 1 1 344.411 3.943 20 5 EHBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000589180875 1036294545 /nfs/dbraw/zinc/29/45/45/1036294545.db2.gz LEQUIGCXBBAOKR-OAHLLOKOSA-N 1 1 335.451 3.848 20 5 EHBDMO CC(C)Cc1ncc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000589183767 1036295373 /nfs/dbraw/zinc/29/53/73/1036295373.db2.gz MOLFOKHTBWOWTA-UHFFFAOYSA-N 1 1 333.457 3.924 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541555018 1036447829 /nfs/dbraw/zinc/44/78/29/1036447829.db2.gz GULNGSZPEZWURU-MRXNPFEDSA-N 1 1 342.443 3.863 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687383 1036728483 /nfs/dbraw/zinc/72/84/83/1036728483.db2.gz TVZMAYBXGOUAOA-ROUUACIJSA-N 1 1 330.359 3.604 20 5 EHBDMO CCO[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590161132 1036780359 /nfs/dbraw/zinc/78/03/59/1036780359.db2.gz AXDDMSCPXFIHRL-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO CCO[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590161132 1036780380 /nfs/dbraw/zinc/78/03/80/1036780380.db2.gz AXDDMSCPXFIHRL-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OC(F)F)c(F)c2)c(F)c1 ZINC000590195985 1036794810 /nfs/dbraw/zinc/79/48/10/1036794810.db2.gz LWRDIZYIEPRWGT-UHFFFAOYSA-N 1 1 344.264 3.764 20 5 EHBDMO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000271701908 1036935616 /nfs/dbraw/zinc/93/56/16/1036935616.db2.gz HPUOOINGZKJASM-JTQLQIEISA-N 1 1 334.397 3.602 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)N1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519673 1037099032 /nfs/dbraw/zinc/09/90/32/1037099032.db2.gz DCCJNQQFGNSJIF-CHWSQXEVSA-N 1 1 325.840 3.601 20 5 EHBDMO C[C@H]1CCC[C@H](C)N1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519674 1037099056 /nfs/dbraw/zinc/09/90/56/1037099056.db2.gz DCCJNQQFGNSJIF-STQMWFEESA-N 1 1 325.840 3.601 20 5 EHBDMO CO[C@H](C)C[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000573018214 1037158689 /nfs/dbraw/zinc/15/86/89/1037158689.db2.gz DTOBMFDDQWCNMZ-CYBMUJFWSA-N 1 1 348.374 3.993 20 5 EHBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ncc([N+](=O)[O-])s2)CCC1 ZINC000386726872 1037228781 /nfs/dbraw/zinc/22/87/81/1037228781.db2.gz AJEXWPNJZQNPOM-UHFFFAOYSA-N 1 1 332.429 3.518 20 5 EHBDMO C[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@H+]1C1CC1 ZINC000177185147 1037408995 /nfs/dbraw/zinc/40/89/95/1037408995.db2.gz CRTWYUFDTRZXTO-GDBMZVCRSA-N 1 1 345.446 3.743 20 5 EHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000171128680 1037464991 /nfs/dbraw/zinc/46/49/91/1037464991.db2.gz RIJRXNAVAAMFRZ-AWEZNQCLSA-N 1 1 339.395 3.572 20 5 EHBDMO CCOc1cc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000540023646 1037483203 /nfs/dbraw/zinc/48/32/03/1037483203.db2.gz BWCZIYFCTNBUJJ-HNNXBMFYSA-N 1 1 335.448 3.773 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nccn1CC(F)(F)F ZINC000532497840 1037541724 /nfs/dbraw/zinc/54/17/24/1037541724.db2.gz SWZIZPPYSCZTIS-LLVKDONJSA-N 1 1 342.321 3.513 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CC1CC1)C1CCCCC1 ZINC000532546349 1037577213 /nfs/dbraw/zinc/57/72/13/1037577213.db2.gz HVTLLDKVNGUWRY-UHFFFAOYSA-N 1 1 345.443 3.886 20 5 EHBDMO C[C@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741021670 1037690044 /nfs/dbraw/zinc/69/00/44/1037690044.db2.gz FOXUNYQISOMGJG-GRYCIOLGSA-N 1 1 340.807 3.553 20 5 EHBDMO CCOc1cc(C[NH2+][C@H](CC)c2c(C)noc2C)ccc1[N+](=O)[O-] ZINC000491812933 1037702152 /nfs/dbraw/zinc/70/21/52/1037702152.db2.gz LJRLCRUWZMCEJV-CQSZACIVSA-N 1 1 333.388 3.839 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1=CCCC1)[C@H]1CC[C@H](O)CC1 ZINC000592132495 1037842440 /nfs/dbraw/zinc/84/24/40/1037842440.db2.gz HJXMKKLGNDAFIE-IYARVYRRSA-N 1 1 330.428 3.811 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000463200468 1037887234 /nfs/dbraw/zinc/88/72/34/1037887234.db2.gz UEYNQBMGLSOFOT-KURKYZTESA-N 1 1 348.443 3.509 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000103465603 1037899555 /nfs/dbraw/zinc/89/95/55/1037899555.db2.gz ODHUHRVCDZDDET-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](O)[C@H]2CCc2ccccc2)cs1 ZINC000592165653 1037910846 /nfs/dbraw/zinc/91/08/46/1037910846.db2.gz DIOPGRXXXQOAPK-SJORKVTESA-N 1 1 346.452 3.614 20 5 EHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCCC1 ZINC000104679485 1038451467 /nfs/dbraw/zinc/45/14/67/1038451467.db2.gz OWAAUOSJGPRIRQ-UHFFFAOYSA-N 1 1 329.400 3.914 20 5 EHBDMO CCN1CC[C@H]([N@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582640 /nfs/dbraw/zinc/58/26/40/1038582640.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 1 1 331.460 3.660 20 5 EHBDMO CCN1CC[C@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582641 /nfs/dbraw/zinc/58/26/41/1038582641.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 1 1 331.460 3.660 20 5 EHBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000511562607 1038731703 /nfs/dbraw/zinc/73/17/03/1038731703.db2.gz WUQAULMKRJOFIL-IAGOWNOFSA-N 1 1 336.432 3.507 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488108436 1038865304 /nfs/dbraw/zinc/86/53/04/1038865304.db2.gz NZTLIEKCQQTJKX-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO CCCC[N@@H+](C)CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000488255385 1039010194 /nfs/dbraw/zinc/01/01/94/1039010194.db2.gz MYROCAAKOIHBOZ-UHFFFAOYSA-N 1 1 330.226 3.501 20 5 EHBDMO Cc1cccc([C@@H]2CCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1C ZINC000478013178 1039117786 /nfs/dbraw/zinc/11/77/86/1039117786.db2.gz CQQMWCSMMFDLDZ-KRWDZBQOSA-N 1 1 328.416 3.635 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488364286 1039124613 /nfs/dbraw/zinc/12/46/13/1039124613.db2.gz VTLBTCZBSOIJMJ-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO Cc1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1Br ZINC000190319249 1039308695 /nfs/dbraw/zinc/30/86/95/1039308695.db2.gz REDVOVCFBGEUQE-UHFFFAOYSA-N 1 1 335.201 3.956 20 5 EHBDMO Cc1cc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)cc([N+](=O)[O-])c1 ZINC000500746564 1039336994 /nfs/dbraw/zinc/33/69/94/1039336994.db2.gz JYHZEHRKRQKIFX-UHFFFAOYSA-N 1 1 347.802 3.871 20 5 EHBDMO COc1cccc2c1CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000489603313 1040100513 /nfs/dbraw/zinc/10/05/13/1040100513.db2.gz HQFRXIFJCQQZDA-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371483 1040791144 /nfs/dbraw/zinc/79/11/44/1040791144.db2.gz MXYURLXIVJSOIU-ZYHUDNBSSA-N 1 1 344.358 3.825 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc2cccnc2c([N+](=O)[O-])c1 ZINC001167752318 1040832078 /nfs/dbraw/zinc/83/20/78/1040832078.db2.gz DYDKKCOKJGHGPT-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO COC(=O)[C@H](C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509797030 1040836125 /nfs/dbraw/zinc/83/61/25/1040836125.db2.gz AWQSZADUVQETRQ-GFCCVEGCSA-N 1 1 348.424 3.564 20 5 EHBDMO CCC[N@@H+]1CC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173347 1040992305 /nfs/dbraw/zinc/99/23/05/1040992305.db2.gz GHBAZFJDXQENIC-KBXCAEBGSA-N 1 1 331.460 3.639 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173347 1040992325 /nfs/dbraw/zinc/99/23/25/1040992325.db2.gz GHBAZFJDXQENIC-KBXCAEBGSA-N 1 1 331.460 3.639 20 5 EHBDMO c1ccc2c(c1)nc(N[C@@H]1CCC[N@@H+](C3COC3)C1)c1ccccc21 ZINC001168373961 1041214312 /nfs/dbraw/zinc/21/43/12/1041214312.db2.gz HKDIIURWEDEFDP-OAHLLOKOSA-N 1 1 333.435 3.663 20 5 EHBDMO c1ccc2c(c1)nc(N[C@@H]1CCC[N@H+](C3COC3)C1)c1ccccc21 ZINC001168373961 1041214335 /nfs/dbraw/zinc/21/43/35/1041214335.db2.gz HKDIIURWEDEFDP-OAHLLOKOSA-N 1 1 333.435 3.663 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481699341 1041265108 /nfs/dbraw/zinc/26/51/08/1041265108.db2.gz VHYOQSVHSWWMPK-FQEVSTJZSA-N 1 1 338.407 3.925 20 5 EHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000247201364 1041582548 /nfs/dbraw/zinc/58/25/48/1041582548.db2.gz CBFNYVDKCTXXDZ-IIYDPXPESA-N 1 1 332.400 3.614 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCNC(=O)OC(C)(C)C ZINC000125250715 1041926573 /nfs/dbraw/zinc/92/65/73/1041926573.db2.gz SDXROIZQEORKOM-ZDUSSCGKSA-N 1 1 337.420 3.502 20 5 EHBDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283788 1042134545 /nfs/dbraw/zinc/13/45/45/1042134545.db2.gz IQTARADSKNIRTJ-ZFWWWQNUSA-N 1 1 334.416 3.567 20 5 EHBDMO COc1cc(C)c(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000024800319 1042822890 /nfs/dbraw/zinc/82/28/90/1042822890.db2.gz WJEHHDWMDGJLHP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000024800319 1042822893 /nfs/dbraw/zinc/82/28/93/1042822893.db2.gz WJEHHDWMDGJLHP-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO C[N@@H+](CCCc1ccc2c(c1)CCO2)Cc1ccccc1[N+](=O)[O-] ZINC000482074468 1042913232 /nfs/dbraw/zinc/91/32/32/1042913232.db2.gz AOCUQQUFJLHNNZ-UHFFFAOYSA-N 1 1 326.396 3.594 20 5 EHBDMO CCC[C@H](NCCC[N@@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421087 1043157972 /nfs/dbraw/zinc/15/79/72/1043157972.db2.gz FSRYGANXJJIWEW-LPHOPBHVSA-N 1 1 349.475 3.527 20 5 EHBDMO CCC[C@H](NCCC[N@H+]1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421087 1043157978 /nfs/dbraw/zinc/15/79/78/1043157978.db2.gz FSRYGANXJJIWEW-LPHOPBHVSA-N 1 1 349.475 3.527 20 5 EHBDMO CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3c[nH]nc32)c2cc([N+](=O)[O-])ccc21 ZINC000279118023 1043380740 /nfs/dbraw/zinc/38/07/40/1043380740.db2.gz PVMVCVNBTGCICP-HZPDHXFCSA-N 1 1 326.400 3.708 20 5 EHBDMO Cn1cnc2cc(C[N@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000342682023 1043716496 /nfs/dbraw/zinc/71/64/96/1043716496.db2.gz NCBMZRMMMQEKPT-UHFFFAOYSA-N 1 1 336.395 3.646 20 5 EHBDMO Cn1cnc2cc(C[N@@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc21 ZINC000342682023 1043716512 /nfs/dbraw/zinc/71/65/12/1043716512.db2.gz NCBMZRMMMQEKPT-UHFFFAOYSA-N 1 1 336.395 3.646 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cc1F ZINC000931913351 1043736199 /nfs/dbraw/zinc/73/61/99/1043736199.db2.gz MEPDQSSSXSBSSC-GFCCVEGCSA-N 1 1 336.260 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)cc1F ZINC000931913351 1043736213 /nfs/dbraw/zinc/73/62/13/1043736213.db2.gz MEPDQSSSXSBSSC-GFCCVEGCSA-N 1 1 336.260 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)c(Cl)c1 ZINC000542045086 1043863708 /nfs/dbraw/zinc/86/37/08/1043863708.db2.gz OFTRLRSNKMSPRQ-UHFFFAOYSA-N 1 1 346.770 3.756 20 5 EHBDMO Cc1cccc(N2CCC(Nc3ccc([N+](=O)[O-])c(C)c3)CC2)[nH+]1 ZINC000301318664 1127736610 /nfs/dbraw/zinc/73/66/10/1127736610.db2.gz QAXKJJROHVEDLX-UHFFFAOYSA-N 1 1 326.400 3.688 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(NCCC[N@@H+](C)Cc2ccccc2)c1 ZINC000301321445 1127737243 /nfs/dbraw/zinc/73/72/43/1127737243.db2.gz DEFFAYARKYQYED-UHFFFAOYSA-N 1 1 329.400 3.537 20 5 EHBDMO CCC[N@H+]1CCC[C@H]1CN[C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336579 1127750120 /nfs/dbraw/zinc/75/01/20/1127750120.db2.gz FYIQYYADWXGVFM-ZBFHGGJFSA-N 1 1 335.448 3.519 20 5 EHBDMO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336579 1127750125 /nfs/dbraw/zinc/75/01/25/1127750125.db2.gz FYIQYYADWXGVFM-ZBFHGGJFSA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564050 1128497977 /nfs/dbraw/zinc/49/79/77/1128497977.db2.gz VRNPDEUWRPYHDB-RDJZCZTQSA-N 1 1 340.427 3.763 20 5 EHBDMO Cc1nc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000301647358 1128822749 /nfs/dbraw/zinc/82/27/49/1128822749.db2.gz IHUVHKJOSYHKSK-WMLDXEAASA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC001648832760 1120050602 /nfs/dbraw/zinc/05/06/02/1120050602.db2.gz LDLRYGLFWQZQHJ-NHYWBVRUSA-N 1 1 333.413 3.754 20 5 EHBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000487962410 1121361721 /nfs/dbraw/zinc/36/17/21/1121361721.db2.gz IZXLJTKMSGREQN-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000487962410 1121361730 /nfs/dbraw/zinc/36/17/30/1121361730.db2.gz IZXLJTKMSGREQN-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC000780400261 1121575140 /nfs/dbraw/zinc/57/51/40/1121575140.db2.gz UQZPVQNKRTVKJO-FFQNAWCLSA-N 1 1 338.407 3.806 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000916151482 1122081442 /nfs/dbraw/zinc/08/14/42/1122081442.db2.gz ITIDPIGPPFCNMW-CYBMUJFWSA-N 1 1 340.379 3.581 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000916151482 1122081447 /nfs/dbraw/zinc/08/14/47/1122081447.db2.gz ITIDPIGPPFCNMW-CYBMUJFWSA-N 1 1 340.379 3.581 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(F)cc(Br)c1 ZINC000112017387 1122277608 /nfs/dbraw/zinc/27/76/08/1122277608.db2.gz WAYURUDBYOELLA-UHFFFAOYSA-N 1 1 339.164 3.786 20 5 EHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000497118333 1122340609 /nfs/dbraw/zinc/34/06/09/1122340609.db2.gz YRTKDHWHWCLLKU-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000497118333 1122340614 /nfs/dbraw/zinc/34/06/14/1122340614.db2.gz YRTKDHWHWCLLKU-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127881764 1122513219 /nfs/dbraw/zinc/51/32/19/1122513219.db2.gz IFYAMQOEUQGVSF-HNNXBMFYSA-N 1 1 348.447 3.598 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]2C2CCCCC2)c1 ZINC000917477206 1122612787 /nfs/dbraw/zinc/61/27/87/1122612787.db2.gz FAPQXFLXJZBTPU-QGZVFWFLSA-N 1 1 328.416 3.947 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c(C)cccc2[N+](=O)[O-])C1 ZINC000194676692 1122837870 /nfs/dbraw/zinc/83/78/70/1122837870.db2.gz RNEZYQLAUCUERC-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO CC[N@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194702614 1122872852 /nfs/dbraw/zinc/87/28/52/1122872852.db2.gz NHURXSODOOLLLV-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000194702614 1122872856 /nfs/dbraw/zinc/87/28/56/1122872856.db2.gz NHURXSODOOLLLV-GFCCVEGCSA-N 1 1 333.413 3.505 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301813940 1129117984 /nfs/dbraw/zinc/11/79/84/1129117984.db2.gz FYRQELMIOCZRCF-NSHDSACASA-N 1 1 331.338 3.757 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610133756 1123739142 /nfs/dbraw/zinc/73/91/42/1123739142.db2.gz SUFGRGRJXAHMFI-WCQYABFASA-N 1 1 345.365 3.923 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000301820948 1129147941 /nfs/dbraw/zinc/14/79/41/1129147941.db2.gz JRTZWJMBDCHHID-GXSJLCMTSA-N 1 1 329.322 3.651 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000615837609 1123884781 /nfs/dbraw/zinc/88/47/81/1123884781.db2.gz LAPDJOXDGHTNGX-LDCOFTPGSA-N 1 1 326.343 3.702 20 5 EHBDMO NC(CCc1ccccc1)=[NH+]OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734834065 1131283757 /nfs/dbraw/zinc/28/37/57/1131283757.db2.gz ATVPFICMVLGETH-UHFFFAOYSA-N 1 1 333.775 3.879 20 5 EHBDMO CC(C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301861150 1129229329 /nfs/dbraw/zinc/22/93/29/1129229329.db2.gz KVYVAYVJWSTQGX-HNNXBMFYSA-N 1 1 326.400 3.551 20 5 EHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247690 1129371503 /nfs/dbraw/zinc/37/15/03/1129371503.db2.gz VPOOKZFNUWFWFB-CYBMUJFWSA-N 1 1 330.388 3.513 20 5 EHBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000081584597 1129429952 /nfs/dbraw/zinc/42/99/52/1129429952.db2.gz QDKHKBRRLPWTCN-INIZCTEOSA-N 1 1 349.475 3.546 20 5 EHBDMO C[NH+](C)CC1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCC1 ZINC000466424687 1129441340 /nfs/dbraw/zinc/44/13/40/1129441340.db2.gz WXFJYGMOWKYMPY-UHFFFAOYSA-N 1 1 345.468 3.897 20 5 EHBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383678 1129504314 /nfs/dbraw/zinc/50/43/14/1129504314.db2.gz CLSQHRJCGPYMRK-OLZOCXBDSA-N 1 1 326.824 3.764 20 5 EHBDMO COc1cc(C[NH+]2CCCCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000092107127 1129533269 /nfs/dbraw/zinc/53/32/69/1129533269.db2.gz QNWHWDMAKUTDTP-UHFFFAOYSA-N 1 1 348.321 3.530 20 5 EHBDMO C[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955482 1129593431 /nfs/dbraw/zinc/59/34/31/1129593431.db2.gz YJLYJYGKEMUJSL-MEBBXXQBSA-N 1 1 338.766 3.772 20 5 EHBDMO CSCC[C@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093558563 1129594287 /nfs/dbraw/zinc/59/42/87/1129594287.db2.gz NYOJIZGKLVMDLU-ZDUSSCGKSA-N 1 1 348.472 3.569 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](C3CC3)C2)c(C(F)(F)F)c1 ZINC000390049145 1129601961 /nfs/dbraw/zinc/60/19/61/1129601961.db2.gz FOUFXAYQYJZNRJ-SNVBAGLBSA-N 1 1 329.322 3.510 20 5 EHBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])cc2C)c(N2CCCC2)[nH+]1 ZINC000302043053 1129764726 /nfs/dbraw/zinc/76/47/26/1129764726.db2.gz JBJAWCDMBARSNX-UHFFFAOYSA-N 1 1 326.400 3.819 20 5 EHBDMO CC[C@@H](C(=O)Oc1cc([N+](=O)[O-])c(Cl)cc1C)[NH+](CC)CC ZINC000736021951 1131404580 /nfs/dbraw/zinc/40/45/80/1131404580.db2.gz KOJNDWLLIJMNND-LBPRGKRZSA-N 1 1 328.796 3.582 20 5 EHBDMO CCOc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1Cl ZINC000556411744 1129884744 /nfs/dbraw/zinc/88/47/44/1129884744.db2.gz HBZWQHMCGRIZJI-UHFFFAOYSA-N 1 1 326.805 3.998 20 5 EHBDMO CCCCc1noc([C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000282460111 1129894357 /nfs/dbraw/zinc/89/43/57/1129894357.db2.gz MSSBXKHCDCUELY-CYBMUJFWSA-N 1 1 332.404 3.556 20 5 EHBDMO CCCCc1noc([C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000282460111 1129894363 /nfs/dbraw/zinc/89/43/63/1129894363.db2.gz MSSBXKHCDCUELY-CYBMUJFWSA-N 1 1 332.404 3.556 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCCO)Cc2cccc(Cl)c2)c1 ZINC000134292258 1129990018 /nfs/dbraw/zinc/99/00/18/1129990018.db2.gz GNUCQSDQOSGSDN-UHFFFAOYSA-N 1 1 334.803 3.633 20 5 EHBDMO C[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000245739232 1130314792 /nfs/dbraw/zinc/31/47/92/1130314792.db2.gz XAIZTKFCACXELK-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000245739232 1130314796 /nfs/dbraw/zinc/31/47/96/1130314796.db2.gz XAIZTKFCACXELK-BLLLJJGKSA-N 1 1 334.807 3.528 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000246055903 1130339220 /nfs/dbraw/zinc/33/92/20/1130339220.db2.gz XWJJRVJVCAPJGK-UPJWGTAASA-N 1 1 330.388 3.684 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094949 1130342565 /nfs/dbraw/zinc/34/25/65/1130342565.db2.gz AJICGUOODCFLOK-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094949 1130342571 /nfs/dbraw/zinc/34/25/71/1130342571.db2.gz AJICGUOODCFLOK-WCQYABFASA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094935 1130342650 /nfs/dbraw/zinc/34/26/50/1130342650.db2.gz AJICGUOODCFLOK-DGCLKSJQSA-N 1 1 348.353 3.515 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246094935 1130342655 /nfs/dbraw/zinc/34/26/55/1130342655.db2.gz AJICGUOODCFLOK-DGCLKSJQSA-N 1 1 348.353 3.515 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246462448 1130384986 /nfs/dbraw/zinc/38/49/86/1130384986.db2.gz FNOSIDDXGZQZIQ-GUYCJALGSA-N 1 1 349.862 3.697 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869883 1131550761 /nfs/dbraw/zinc/55/07/61/1131550761.db2.gz BQOLHSCBKGPEMM-HNNXBMFYSA-N 1 1 343.402 3.835 20 5 EHBDMO C[C@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000741029547 1131571462 /nfs/dbraw/zinc/57/14/62/1131571462.db2.gz PPWVKMUTFQEQCA-GFCCVEGCSA-N 1 1 340.807 3.556 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742152849 1131694016 /nfs/dbraw/zinc/69/40/16/1131694016.db2.gz KGKYNIYGTJBVMI-OAHLLOKOSA-N 1 1 343.431 3.569 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](c3ccncc3)C1)CC2 ZINC001172911307 1131917668 /nfs/dbraw/zinc/91/76/68/1131917668.db2.gz SECGJTKBRZQOTF-RBUKOAKNSA-N 1 1 337.423 3.727 20 5 EHBDMO CCCCC[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010746 1131935531 /nfs/dbraw/zinc/93/55/31/1131935531.db2.gz AGXFDAIBHASXPY-UHFFFAOYSA-N 1 1 341.402 3.964 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CCCCC2(F)F)c1F ZINC001173193744 1131995218 /nfs/dbraw/zinc/99/52/18/1131995218.db2.gz WPWCOTQDTDNDKJ-YGRLFVJLSA-N 1 1 346.349 3.841 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCn3cccc3[C@@H]2C)c1F ZINC001173195376 1131997105 /nfs/dbraw/zinc/99/71/05/1131997105.db2.gz FDYMJOBBRMAAPL-STQMWFEESA-N 1 1 347.390 3.552 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCn3cccc3[C@@H]2C)c1F ZINC001173195376 1131997111 /nfs/dbraw/zinc/99/71/11/1131997111.db2.gz FDYMJOBBRMAAPL-STQMWFEESA-N 1 1 347.390 3.552 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(CC(C)(C)C)CC1 ZINC001173220909 1132003943 /nfs/dbraw/zinc/00/39/43/1132003943.db2.gz IAKBWNHUTQFSTE-HNNXBMFYSA-N 1 1 333.476 3.626 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H](C(F)F)C1CCCCC1 ZINC001174716374 1132450136 /nfs/dbraw/zinc/45/01/36/1132450136.db2.gz QNKGZWADVHLKGY-HNNXBMFYSA-N 1 1 328.359 3.777 20 5 EHBDMO COc1ccc(OCC[N@H+]2CC(C)(C)CCC2(C)C)c([N+](=O)[O-])c1 ZINC001174723549 1132452127 /nfs/dbraw/zinc/45/21/27/1132452127.db2.gz CSJLECWEXKWBLQ-UHFFFAOYSA-N 1 1 336.432 3.883 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052533 1132550765 /nfs/dbraw/zinc/55/07/65/1132550765.db2.gz HAWVDZIQYFGLBP-PYLYLYNFSA-N 1 1 349.406 3.741 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030293 1132635638 /nfs/dbraw/zinc/63/56/38/1132635638.db2.gz YCUIASDNTPVIHF-MJGOQNOKSA-N 1 1 325.412 3.529 20 5 EHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041697 1132638220 /nfs/dbraw/zinc/63/82/20/1132638220.db2.gz CBNJSOPBCHCETQ-FUHWJXTLSA-N 1 1 334.485 3.830 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040153 1132638282 /nfs/dbraw/zinc/63/82/82/1132638282.db2.gz YHTQTDVZJKYHRM-UNEWFSDZSA-N 1 1 338.835 3.629 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057649 1132646004 /nfs/dbraw/zinc/64/60/04/1132646004.db2.gz WOSRAXVKTSOMDS-IXDOHACOSA-N 1 1 338.398 3.632 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](Cc3ccccc3)C(F)(F)C2)C1 ZINC001169057649 1132646009 /nfs/dbraw/zinc/64/60/09/1132646009.db2.gz WOSRAXVKTSOMDS-IXDOHACOSA-N 1 1 338.398 3.632 20 5 EHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc2cc[nH]c2c1 ZINC001175611316 1132725504 /nfs/dbraw/zinc/72/55/04/1132725504.db2.gz KYPXILGYFDVXDN-UHFFFAOYSA-N 1 1 325.368 3.587 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H](C2CCOCC2)C1 ZINC001175697580 1132729771 /nfs/dbraw/zinc/72/97/71/1132729771.db2.gz DYGUSEVLEQARDW-INIZCTEOSA-N 1 1 348.443 3.632 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714359 1132742148 /nfs/dbraw/zinc/74/21/48/1132742148.db2.gz HAEDTJJUXFPHAU-HNNXBMFYSA-N 1 1 329.400 3.968 20 5 EHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766240 1133049781 /nfs/dbraw/zinc/04/97/81/1133049781.db2.gz RLKANKYCLLOLJY-CQSZACIVSA-N 1 1 331.420 3.506 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155579 /nfs/dbraw/zinc/15/55/79/1133155579.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 1 1 325.840 3.553 20 5 EHBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000770145698 1133393383 /nfs/dbraw/zinc/39/33/83/1133393383.db2.gz ODGUUAUEUGVFBE-LBPRGKRZSA-N 1 1 334.807 3.674 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1Nc1cccc(C[NH+]2CCOCC2)c1 ZINC001185127411 1134040389 /nfs/dbraw/zinc/04/03/89/1134040389.db2.gz MNLUAAXYGCDUOS-UHFFFAOYSA-N 1 1 347.802 3.824 20 5 EHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873510 1134089748 /nfs/dbraw/zinc/08/97/48/1134089748.db2.gz JGAUFQWRAYTOEC-AWEZNQCLSA-N 1 1 341.367 3.801 20 5 EHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774905543 1134114067 /nfs/dbraw/zinc/11/40/67/1134114067.db2.gz QMMPREZVCNWCGA-AWEZNQCLSA-N 1 1 343.383 3.874 20 5 EHBDMO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c2ccccc21 ZINC001186873534 1134264889 /nfs/dbraw/zinc/26/48/89/1134264889.db2.gz YFNDBCKTUNACBK-CVEARBPZSA-N 1 1 326.400 3.572 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326628 1134748561 /nfs/dbraw/zinc/74/85/61/1134748561.db2.gz AVXJPVCKUHXAPD-AWEZNQCLSA-N 1 1 326.396 3.593 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170352654 1134754004 /nfs/dbraw/zinc/75/40/04/1134754004.db2.gz PLYQPANNDFNPRP-ZDUSSCGKSA-N 1 1 344.386 3.732 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347883 1134759522 /nfs/dbraw/zinc/75/95/22/1134759522.db2.gz SUJBEQDEYXABRP-CYBMUJFWSA-N 1 1 332.375 3.806 20 5 EHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001191477517 1134870250 /nfs/dbraw/zinc/87/02/50/1134870250.db2.gz YKELYKGMQXSLFG-AWEZNQCLSA-N 1 1 339.395 3.543 20 5 EHBDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001191464695 1134876380 /nfs/dbraw/zinc/87/63/80/1134876380.db2.gz MVBUOYHJEBPXEB-LLVKDONJSA-N 1 1 330.413 3.596 20 5 EHBDMO Cc1nn(C[N@H+](C)CCc2cccc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000101537865 1135349280 /nfs/dbraw/zinc/34/92/80/1135349280.db2.gz GCGKACZWXUQKTM-UHFFFAOYSA-N 1 1 338.411 3.693 20 5 EHBDMO Cc1nn(C[N@@H+](C)CCc2cccc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000101537865 1135349287 /nfs/dbraw/zinc/34/92/87/1135349287.db2.gz GCGKACZWXUQKTM-UHFFFAOYSA-N 1 1 338.411 3.693 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCc2ccc(F)cc21 ZINC001195694378 1135456589 /nfs/dbraw/zinc/45/65/89/1135456589.db2.gz KRQQEUZHYKVUDO-CQSZACIVSA-N 1 1 328.387 3.938 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095625 1135591451 /nfs/dbraw/zinc/59/14/51/1135591451.db2.gz KYRMPSASJUIVAA-INIZCTEOSA-N 1 1 347.462 3.991 20 5 EHBDMO COc1ccc(C[N@@H+]2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)cc1[N+](=O)[O-] ZINC001196889493 1135622202 /nfs/dbraw/zinc/62/22/02/1135622202.db2.gz SPYNELTZZSQIMN-KURKYZTESA-N 1 1 338.407 3.839 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001197203119 1135659283 /nfs/dbraw/zinc/65/92/83/1135659283.db2.gz RNMMTTNYWJOCTP-AWEZNQCLSA-N 1 1 333.388 3.905 20 5 EHBDMO CN(C)c1ccccc1C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000808785602 1135737488 /nfs/dbraw/zinc/73/74/88/1135737488.db2.gz MGLQIQUBSJQODU-UHFFFAOYSA-N 1 1 333.819 3.946 20 5 EHBDMO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCC[N@@H+](C)C1 ZINC000809948631 1135905505 /nfs/dbraw/zinc/90/55/05/1135905505.db2.gz IHNYHNAISLFTOO-LLVKDONJSA-N 1 1 346.258 3.675 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000809954145 1135906015 /nfs/dbraw/zinc/90/60/15/1135906015.db2.gz QHUDKABSEGTORW-HZMBPMFUSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000809954145 1135906018 /nfs/dbraw/zinc/90/60/18/1135906018.db2.gz QHUDKABSEGTORW-HZMBPMFUSA-N 1 1 345.226 3.903 20 5 EHBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000769192735 1135997288 /nfs/dbraw/zinc/99/72/88/1135997288.db2.gz YRPSQCYNLHXANE-UHFFFAOYSA-N 1 1 339.233 3.978 20 5 EHBDMO COc1ccc(C[NH2+]Cc2ccnc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000811476855 1136096397 /nfs/dbraw/zinc/09/63/97/1136096397.db2.gz ULRBDDZXYGDUPT-UHFFFAOYSA-N 1 1 342.182 3.595 20 5 EHBDMO C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254066 1136104781 /nfs/dbraw/zinc/10/47/81/1136104781.db2.gz QYEVCQLEMUGIGX-ROUUACIJSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254066 1136104782 /nfs/dbraw/zinc/10/47/82/1136104782.db2.gz QYEVCQLEMUGIGX-ROUUACIJSA-N 1 1 345.830 3.783 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776271686 1136124385 /nfs/dbraw/zinc/12/43/85/1136124385.db2.gz NDIURPJBPVTVRF-LJQANCHMSA-N 1 1 328.412 3.884 20 5 EHBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278193 1136133089 /nfs/dbraw/zinc/13/30/89/1136133089.db2.gz SNIKGPBPMFXYHI-OALUTQOASA-N 1 1 326.396 3.774 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812847474 1136259483 /nfs/dbraw/zinc/25/94/83/1136259483.db2.gz DDMSFPDZTCEGED-KUHUBIRLSA-N 1 1 344.411 3.547 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850770 1136261030 /nfs/dbraw/zinc/26/10/30/1136261030.db2.gz XTGQUSPTOIHAER-LIRRHRJNSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cccc(F)n2)o1 ZINC000747936162 1136443471 /nfs/dbraw/zinc/44/34/71/1136443471.db2.gz QFCXQDOZYLSCIE-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581325 1136444947 /nfs/dbraw/zinc/44/49/47/1136444947.db2.gz CLIOXAAXPCXIEO-RTBURBONSA-N 1 1 328.412 3.957 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000814641825 1136488509 /nfs/dbraw/zinc/48/85/09/1136488509.db2.gz LLGDTLVAUICKSI-IEBWSBKVSA-N 1 1 326.396 3.508 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666335 1136491777 /nfs/dbraw/zinc/49/17/77/1136491777.db2.gz GMGJIIKVNURMBM-CRAIPNDOSA-N 1 1 346.814 3.771 20 5 EHBDMO C[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000853644267 1136552301 /nfs/dbraw/zinc/55/23/01/1136552301.db2.gz IEOTXLLPMLHBEH-LBPRGKRZSA-N 1 1 339.386 3.843 20 5 EHBDMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2C1 ZINC000816617978 1136742649 /nfs/dbraw/zinc/74/26/49/1136742649.db2.gz MPMMCVNVZGIUHC-UHFFFAOYSA-N 1 1 331.803 3.700 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nc1 ZINC000858011265 1136930004 /nfs/dbraw/zinc/93/00/04/1136930004.db2.gz LURKUFABBOMSEX-AWEZNQCLSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)nc1 ZINC000858011265 1136930007 /nfs/dbraw/zinc/93/00/07/1136930007.db2.gz LURKUFABBOMSEX-AWEZNQCLSA-N 1 1 347.802 3.605 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000823659961 1137108547 /nfs/dbraw/zinc/10/85/47/1137108547.db2.gz AQTZZBJJYXINDZ-QGZVFWFLSA-N 1 1 334.391 3.515 20 5 EHBDMO CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000844402912 1137217525 /nfs/dbraw/zinc/21/75/25/1137217525.db2.gz WPXMHUAJPUAMJR-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000844402912 1137217526 /nfs/dbraw/zinc/21/75/26/1137217526.db2.gz WPXMHUAJPUAMJR-GFCCVEGCSA-N 1 1 333.215 3.903 20 5 EHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(Br)cn1 ZINC000866570644 1137365879 /nfs/dbraw/zinc/36/58/79/1137365879.db2.gz IEPXYEHNSSURSV-CQSZACIVSA-N 1 1 348.200 3.529 20 5 EHBDMO C[C@@H](c1cnn(C)c1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339076413 1137382540 /nfs/dbraw/zinc/38/25/40/1137382540.db2.gz SBNAFHYPPMLWMR-JTQLQIEISA-N 1 1 342.321 3.540 20 5 EHBDMO C[C@@H](c1cnn(C)c1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339076413 1137382542 /nfs/dbraw/zinc/38/25/42/1137382542.db2.gz SBNAFHYPPMLWMR-JTQLQIEISA-N 1 1 342.321 3.540 20 5 EHBDMO C[C@@H](NC[C@@H](c1ccsc1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017902 1137564793 /nfs/dbraw/zinc/56/47/93/1137564793.db2.gz GUWQZFMHHLPXOD-ABAIWWIYSA-N 1 1 337.420 3.749 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]CCC[C@@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000872108083 1137571401 /nfs/dbraw/zinc/57/14/01/1137571401.db2.gz WEDFCUAVOLSBKP-CRAIPNDOSA-N 1 1 340.427 3.754 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872281401 1137577738 /nfs/dbraw/zinc/57/77/38/1137577738.db2.gz UXTLGYORBZBFKF-KRWDZBQOSA-N 1 1 334.416 3.527 20 5 EHBDMO C[C@@H]([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000873183966 1137592906 /nfs/dbraw/zinc/59/29/06/1137592906.db2.gz UFFAVESWPZDVDF-ABAIWWIYSA-N 1 1 333.413 3.754 20 5 EHBDMO Cc1nc2c(s1)[C@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000877182570 1137672402 /nfs/dbraw/zinc/67/24/02/1137672402.db2.gz OEQPBXZHTSWNIN-LLVKDONJSA-N 1 1 344.396 3.668 20 5 EHBDMO CC[C@H](C)C[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878092963 1137702111 /nfs/dbraw/zinc/70/21/11/1137702111.db2.gz CQTNLAYEUMHKDG-JTQLQIEISA-N 1 1 338.795 3.776 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880028403 1137765926 /nfs/dbraw/zinc/76/59/26/1137765926.db2.gz CVQIFPIKGKONEZ-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO CC(=O)Nc1ccc2c(c1)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880028403 1137765927 /nfs/dbraw/zinc/76/59/27/1137765927.db2.gz CVQIFPIKGKONEZ-CYBMUJFWSA-N 1 1 339.395 3.673 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000880053266 1137766830 /nfs/dbraw/zinc/76/68/30/1137766830.db2.gz LAANDGBXACQOOK-RISCZKNCSA-N 1 1 332.322 3.617 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@H](C(F)(F)F)CC1 ZINC000880053266 1137766831 /nfs/dbraw/zinc/76/68/31/1137766831.db2.gz LAANDGBXACQOOK-RISCZKNCSA-N 1 1 332.322 3.617 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000883254125 1137850634 /nfs/dbraw/zinc/85/06/34/1137850634.db2.gz KTUMHROBZLGDPA-KRWDZBQOSA-N 1 1 340.427 3.588 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000104662179 1137878870 /nfs/dbraw/zinc/87/88/70/1137878870.db2.gz UILZWYMUQLDCAQ-UHFFFAOYSA-N 1 1 341.367 3.826 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ncccc1C)C(C)C ZINC000120833800 1137952644 /nfs/dbraw/zinc/95/26/44/1137952644.db2.gz SQLLADCHYPOGDD-QGZVFWFLSA-N 1 1 329.400 3.794 20 5 EHBDMO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1OC ZINC000886057663 1138036394 /nfs/dbraw/zinc/03/63/94/1138036394.db2.gz UHVXROKIHOHEJT-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000137067564 1138045254 /nfs/dbraw/zinc/04/52/54/1138045254.db2.gz AGDYQNQAWZRYHU-XPGWFJOJSA-N 1 1 340.423 3.754 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCc3cccnc32)cc(C(F)(F)F)c1 ZINC000886601525 1138100665 /nfs/dbraw/zinc/10/06/65/1138100665.db2.gz VQNSCPZRWHQBCO-AWEZNQCLSA-N 1 1 337.301 3.786 20 5 EHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCCO1 ZINC000092427359 1138227709 /nfs/dbraw/zinc/22/77/09/1138227709.db2.gz XDOGJAGISOLXRM-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCCO1 ZINC000092427359 1138227710 /nfs/dbraw/zinc/22/77/10/1138227710.db2.gz XDOGJAGISOLXRM-MRXNPFEDSA-N 1 1 347.440 3.719 20 5 EHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C1CC1)C1CC1 ZINC000153374524 1139133297 /nfs/dbraw/zinc/13/32/97/1139133297.db2.gz VZIURWCJNFLHCH-UHFFFAOYSA-N 1 1 327.384 3.870 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)ccc1O ZINC000178003798 1139661768 /nfs/dbraw/zinc/66/17/68/1139661768.db2.gz OLCRZPLWTARKEP-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)ccc1O ZINC000178003798 1139661772 /nfs/dbraw/zinc/66/17/72/1139661772.db2.gz OLCRZPLWTARKEP-UHFFFAOYSA-N 1 1 336.775 3.594 20 5 EHBDMO CCc1oc(C(=O)OC)cc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181828134 1139935034 /nfs/dbraw/zinc/93/50/34/1139935034.db2.gz FEHGUHPPCRLDQO-LBPRGKRZSA-N 1 1 346.383 3.696 20 5 EHBDMO COc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])cc1F ZINC000184304714 1140094635 /nfs/dbraw/zinc/09/46/35/1140094635.db2.gz TZPPUOUKTOAHIT-JTQLQIEISA-N 1 1 349.318 3.502 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C(=O)C(F)(F)F)CC1 ZINC000186072057 1140185774 /nfs/dbraw/zinc/18/57/74/1140185774.db2.gz WOZILTKWKDBUIL-LLVKDONJSA-N 1 1 344.333 3.808 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000187769651 1140270311 /nfs/dbraw/zinc/27/03/11/1140270311.db2.gz STHCQQPZNJQXQX-PBHICJAKSA-N 1 1 347.459 3.521 20 5 EHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2c[nH]nc21 ZINC000271558786 1141397477 /nfs/dbraw/zinc/39/74/77/1141397477.db2.gz WIBDAPHEKCVWEI-ZIAGYGMSSA-N 1 1 346.456 3.856 20 5 EHBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283143443 1141561594 /nfs/dbraw/zinc/56/15/94/1141561594.db2.gz ODEZXFGDSVIJJB-AWEZNQCLSA-N 1 1 332.375 3.507 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C2CCCC2)c2c(c1)COCO2 ZINC000055927962 214348985 /nfs/dbraw/zinc/34/89/85/214348985.db2.gz UBOVJDFPKCQGGJ-KRWDZBQOSA-N 1 1 332.400 3.616 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)c(OC)c1 ZINC000183232185 1125477200 /nfs/dbraw/zinc/47/72/00/1125477200.db2.gz ZCVYYQOJNHBVMA-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)c(OC)c1 ZINC000183232185 1125477203 /nfs/dbraw/zinc/47/72/03/1125477203.db2.gz ZCVYYQOJNHBVMA-UHFFFAOYSA-N 1 1 330.384 3.552 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCc2ccccc2C1 ZINC000430196372 1014813590 /nfs/dbraw/zinc/81/35/90/1014813590.db2.gz QYRIGMRLVCSBNC-KRWDZBQOSA-N 1 1 326.396 3.593 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](C3CC3)C3CCCC3)n2)c1 ZINC000064809283 1015006182 /nfs/dbraw/zinc/00/61/82/1015006182.db2.gz XGIGFJMPUBZANM-UHFFFAOYSA-N 1 1 328.372 3.552 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1nccs1)C(C)C ZINC000430211739 1015015707 /nfs/dbraw/zinc/01/57/07/1015015707.db2.gz YLGYCBXLWARXQZ-UHFFFAOYSA-N 1 1 335.429 3.513 20 5 EHBDMO CCC[N@H+]1CC[C@H](CNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC000692958648 1015034516 /nfs/dbraw/zinc/03/45/16/1015034516.db2.gz YTZSCBZDGPRNJN-LLVKDONJSA-N 1 1 342.237 3.501 20 5 EHBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430227362 1015121984 /nfs/dbraw/zinc/12/19/84/1015121984.db2.gz RATJITNYMCZEIB-UHFFFAOYSA-N 1 1 344.411 3.677 20 5 EHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837072 1016353351 /nfs/dbraw/zinc/35/33/51/1016353351.db2.gz DXSXNWJGDRJLCH-HOTGVXAUSA-N 1 1 345.399 3.516 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccn(C)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536830543 1032310211 /nfs/dbraw/zinc/31/02/11/1032310211.db2.gz CJEMGHPRRJXLPV-GFCCVEGCSA-N 1 1 342.424 3.908 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593526 1032315024 /nfs/dbraw/zinc/31/50/24/1032315024.db2.gz VOYBOPWMXNVOAE-UGSOOPFHSA-N 1 1 334.416 3.710 20 5 EHBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(CN(C)C)c(F)c1 ZINC000449200837 1032324522 /nfs/dbraw/zinc/32/45/22/1032324522.db2.gz FXAZKCHFOUXECI-AWEZNQCLSA-N 1 1 345.418 3.516 20 5 EHBDMO Cn1cc([C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000537176078 1032549005 /nfs/dbraw/zinc/54/90/05/1032549005.db2.gz PKXHJWOFMBOCMK-HNNXBMFYSA-N 1 1 336.823 3.859 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000449455722 1032572996 /nfs/dbraw/zinc/57/29/96/1032572996.db2.gz AYGAGOZIRAVEET-SCTDSRPQSA-N 1 1 332.444 3.844 20 5 EHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1[N+](=O)[O-] ZINC000449455724 1032573106 /nfs/dbraw/zinc/57/31/06/1032573106.db2.gz AYGAGOZIRAVEET-ZHALLVOQSA-N 1 1 332.444 3.844 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000610274785 1017271810 /nfs/dbraw/zinc/27/18/10/1017271810.db2.gz ATAJIFIBPZZSAG-UHFFFAOYSA-N 1 1 343.374 3.507 20 5 EHBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2cc(N)ccc2O1 ZINC000415036435 1017428097 /nfs/dbraw/zinc/42/80/97/1017428097.db2.gz NQWKWVYBOBOYAB-MRXNPFEDSA-N 1 1 345.374 3.708 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNCCC[NH2+]C2CC2)s1 ZINC000415069232 1017501732 /nfs/dbraw/zinc/50/17/32/1017501732.db2.gz OMNPDSQYONTYKE-UHFFFAOYSA-N 1 1 331.441 3.555 20 5 EHBDMO Cc1[nH+]ccn1CCCCNc1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593465684 1032709224 /nfs/dbraw/zinc/70/92/24/1032709224.db2.gz QUSJNQYXLDRGQU-UHFFFAOYSA-N 1 1 325.372 3.540 20 5 EHBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000610285191 1017660525 /nfs/dbraw/zinc/66/05/25/1017660525.db2.gz GCTQECZVPBZVIV-OAHLLOKOSA-N 1 1 331.441 3.615 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610004257 1017984596 /nfs/dbraw/zinc/98/45/96/1017984596.db2.gz IAPOYJQLJXUVSZ-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610004257 1017984608 /nfs/dbraw/zinc/98/46/08/1017984608.db2.gz IAPOYJQLJXUVSZ-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000610367962 1018536166 /nfs/dbraw/zinc/53/61/66/1018536166.db2.gz SAAWRGAYDFTKDR-ZACQAIPSSA-N 1 1 337.423 3.724 20 5 EHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371726 1018548443 /nfs/dbraw/zinc/54/84/43/1018548443.db2.gz KNYDTKVMPGRTCO-NVXWUHKLSA-N 1 1 338.473 3.970 20 5 EHBDMO CCCC[N@@H+](C)CC1CCN(c2c(OC)cccc2[N+](=O)[O-])CC1 ZINC000580481949 1019453913 /nfs/dbraw/zinc/45/39/13/1019453913.db2.gz ZBBQAOOPCSJBTO-UHFFFAOYSA-N 1 1 335.448 3.552 20 5 EHBDMO CN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000574065296 1019502367 /nfs/dbraw/zinc/50/23/67/1019502367.db2.gz LOQVUVJOLKPZSN-FUNVUKJBSA-N 1 1 343.349 3.675 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000513380834 1019585738 /nfs/dbraw/zinc/58/57/38/1019585738.db2.gz MODKPCPFXTYVOC-INIZCTEOSA-N 1 1 340.379 3.969 20 5 EHBDMO C[C@]1(C[NH3+])CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918146 1019716760 /nfs/dbraw/zinc/71/67/60/1019716760.db2.gz YIXNMTQWACCGRF-QGZVFWFLSA-N 1 1 349.818 3.679 20 5 EHBDMO CCCCNC(=O)[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718412 1019738668 /nfs/dbraw/zinc/73/86/68/1019738668.db2.gz LAWUPBSGLNPYMT-JKSUJKDBSA-N 1 1 347.459 3.593 20 5 EHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732586 1020295939 /nfs/dbraw/zinc/29/59/39/1020295939.db2.gz MLFOGKKNULEIAK-INIZCTEOSA-N 1 1 334.416 3.862 20 5 EHBDMO COc1cc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000361029390 1020892052 /nfs/dbraw/zinc/89/20/52/1020892052.db2.gz HBDLOIFIXAANJD-CQSZACIVSA-N 1 1 329.400 3.536 20 5 EHBDMO CC(C)Oc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602509276 1032943207 /nfs/dbraw/zinc/94/32/07/1032943207.db2.gz QRNIIWLPRFRPER-UHFFFAOYSA-N 1 1 341.367 3.813 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000084137481 1021006020 /nfs/dbraw/zinc/00/60/20/1021006020.db2.gz QIEHXZZIWALVDS-UHFFFAOYSA-N 1 1 332.322 3.638 20 5 EHBDMO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439258341 1021281118 /nfs/dbraw/zinc/28/11/18/1021281118.db2.gz LAEUCPNFGAGODJ-LJQANCHMSA-N 1 1 346.402 3.897 20 5 EHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000439258341 1021281122 /nfs/dbraw/zinc/28/11/22/1021281122.db2.gz LAEUCPNFGAGODJ-LJQANCHMSA-N 1 1 346.402 3.897 20 5 EHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613102 1033029283 /nfs/dbraw/zinc/02/92/83/1033029283.db2.gz OVUPSKDMDRLDTL-LRDDRELGSA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613102 1033029297 /nfs/dbraw/zinc/02/92/97/1033029297.db2.gz OVUPSKDMDRLDTL-LRDDRELGSA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613104 1033030027 /nfs/dbraw/zinc/03/00/27/1033030027.db2.gz OVUPSKDMDRLDTL-WBMJQRKESA-N 1 1 338.367 3.714 20 5 EHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602613104 1033030036 /nfs/dbraw/zinc/03/00/36/1033030036.db2.gz OVUPSKDMDRLDTL-WBMJQRKESA-N 1 1 338.367 3.714 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441295805 1022138914 /nfs/dbraw/zinc/13/89/14/1022138914.db2.gz UATQVSYPTUBEPB-HOTGVXAUSA-N 1 1 348.443 3.631 20 5 EHBDMO Cc1nc(C2([NH2+]CCc3ccc([N+](=O)[O-])cc3)CCCCCC2)no1 ZINC000101546117 1022510573 /nfs/dbraw/zinc/51/05/73/1022510573.db2.gz QVGFBMHHUVZBQX-UHFFFAOYSA-N 1 1 344.415 3.668 20 5 EHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1cccnc1 ZINC000602668898 1033066477 /nfs/dbraw/zinc/06/64/77/1033066477.db2.gz VHLGIAWDNMKPOQ-LBPRGKRZSA-N 1 1 326.356 3.714 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1cccnc1 ZINC000602668898 1033066496 /nfs/dbraw/zinc/06/64/96/1033066496.db2.gz VHLGIAWDNMKPOQ-LBPRGKRZSA-N 1 1 326.356 3.714 20 5 EHBDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266489133 1022656924 /nfs/dbraw/zinc/65/69/24/1022656924.db2.gz RUIDUSKUUNXZBS-QWHCGFSZSA-N 1 1 327.384 3.965 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1OCCO2 ZINC000058922359 1033070792 /nfs/dbraw/zinc/07/07/92/1033070792.db2.gz DCPNZFGMLMDGAY-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@@H]43)o2)cc1 ZINC000510665885 1022850808 /nfs/dbraw/zinc/85/08/08/1022850808.db2.gz SQWLWQWDAZEUHB-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@@H]43)o2)cc1 ZINC000510665885 1022850822 /nfs/dbraw/zinc/85/08/22/1022850822.db2.gz SQWLWQWDAZEUHB-WMZOPIPTSA-N 1 1 328.368 3.608 20 5 EHBDMO Cc1ccncc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602684058 1033085439 /nfs/dbraw/zinc/08/54/39/1033085439.db2.gz FGAMUKODHXUIFL-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CC2)OCc2ccccc23)cs1 ZINC000610738908 1023401799 /nfs/dbraw/zinc/40/17/99/1023401799.db2.gz ZNAVAXOWEMCKCL-UHFFFAOYSA-N 1 1 330.409 3.678 20 5 EHBDMO COCC[C@@H](c1ccccc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000535822704 1023787661 /nfs/dbraw/zinc/78/76/61/1023787661.db2.gz PSQAVTCVVWMLOY-IBGZPJMESA-N 1 1 326.396 3.731 20 5 EHBDMO CC(C)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000610844401 1023788209 /nfs/dbraw/zinc/78/82/09/1023788209.db2.gz OFENIRIDKPQCBN-UHFFFAOYSA-N 1 1 347.802 3.755 20 5 EHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000522298920 1024185007 /nfs/dbraw/zinc/18/50/07/1024185007.db2.gz LQZGSNVIGAHHSR-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H](CC4CC4)C3)o2)c1 ZINC000550422500 1024195715 /nfs/dbraw/zinc/19/57/15/1024195715.db2.gz LYFWELVGRCCSSF-HNNXBMFYSA-N 1 1 341.411 3.914 20 5 EHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000141537300 1024230783 /nfs/dbraw/zinc/23/07/83/1024230783.db2.gz PMYXDJUCNFOHLA-KRWDZBQOSA-N 1 1 345.446 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c(C(F)F)c1 ZINC000895567678 1024624378 /nfs/dbraw/zinc/62/43/78/1024624378.db2.gz GQVFMDOQZNHBDC-KGLIPLIRSA-N 1 1 343.399 3.524 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000065532897 1024661758 /nfs/dbraw/zinc/66/17/58/1024661758.db2.gz YWPAAMDCLTYHFG-SFHVURJKSA-N 1 1 326.396 3.681 20 5 EHBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1cncs1 ZINC000897930073 1033243813 /nfs/dbraw/zinc/24/38/13/1033243813.db2.gz IGKXPYHVBPULJD-LURJTMIESA-N 1 1 348.247 3.726 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000053221413 1024988760 /nfs/dbraw/zinc/98/87/60/1024988760.db2.gz HKXQARNNDUIZHN-IBGZPJMESA-N 1 1 326.396 3.776 20 5 EHBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1cc(C2CC2)cc[nH+]1 ZINC000515149876 1025046164 /nfs/dbraw/zinc/04/61/64/1025046164.db2.gz OARXCOZNPJXFPF-GFCCVEGCSA-N 1 1 340.383 3.696 20 5 EHBDMO CC(C)c1ccc(CNC[C@H](C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948059 1025134771 /nfs/dbraw/zinc/13/47/71/1025134771.db2.gz QHTVJEGMJLQFPD-CVEARBPZSA-N 1 1 333.476 3.928 20 5 EHBDMO CC(C)c1ccc(CNC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948059 1025134777 /nfs/dbraw/zinc/13/47/77/1025134777.db2.gz QHTVJEGMJLQFPD-CVEARBPZSA-N 1 1 333.476 3.928 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000438996709 1025384629 /nfs/dbraw/zinc/38/46/29/1025384629.db2.gz PPOLSGIVJKGAMM-QBIMZIAESA-N 1 1 336.407 3.640 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@@H](O)c2ccccc2)CC1 ZINC000051531702 1025638018 /nfs/dbraw/zinc/63/80/18/1025638018.db2.gz XIQJTHBBBIZIGS-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO CCOc1cc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213769 1025683382 /nfs/dbraw/zinc/68/33/82/1025683382.db2.gz WFIMYFNFGPIAOV-RDTXWAMCSA-N 1 1 341.411 3.972 20 5 EHBDMO Cc1ccc(N2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)[C@H](C)C2)cc1C ZINC001167559217 1025711663 /nfs/dbraw/zinc/71/16/63/1025711663.db2.gz ZLQIZKIDUSFIJO-QGZVFWFLSA-N 1 1 339.439 3.922 20 5 EHBDMO Cc1ccc(N2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)[C@H](C)C2)cc1C ZINC001167559217 1025711679 /nfs/dbraw/zinc/71/16/79/1025711679.db2.gz ZLQIZKIDUSFIJO-QGZVFWFLSA-N 1 1 339.439 3.922 20 5 EHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2C)C1 ZINC000521982339 1025854800 /nfs/dbraw/zinc/85/48/00/1025854800.db2.gz JSXQTTGSOWCTNT-OAHLLOKOSA-N 1 1 347.459 3.534 20 5 EHBDMO Cc1[nH+]ccn1CCCN(C)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000338289234 1026011286 /nfs/dbraw/zinc/01/12/86/1026011286.db2.gz ONLCGLBOBBCFSK-UHFFFAOYSA-N 1 1 342.321 3.645 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](c4ccccc4F)C3)nc2c1 ZINC000339378377 1026545341 /nfs/dbraw/zinc/54/53/41/1026545341.db2.gz KPSCWZIWTNVZOS-GFCCVEGCSA-N 1 1 340.358 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4ccccc4F)C3)nc2c1 ZINC000339378377 1026545348 /nfs/dbraw/zinc/54/53/48/1026545348.db2.gz KPSCWZIWTNVZOS-GFCCVEGCSA-N 1 1 340.358 3.600 20 5 EHBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293730633 1027702961 /nfs/dbraw/zinc/70/29/61/1027702961.db2.gz GQOASDHPUHAUGJ-OAHLLOKOSA-N 1 1 346.349 3.741 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC2(C1)CCCCC2 ZINC000533426698 1027855016 /nfs/dbraw/zinc/85/50/16/1027855016.db2.gz GJQCLZLIMIRAFS-AWEZNQCLSA-N 1 1 331.416 3.578 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000533428500 1027861647 /nfs/dbraw/zinc/86/16/47/1027861647.db2.gz VQKGHSRLEZVXDS-MRXNPFEDSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000612174605 1027913346 /nfs/dbraw/zinc/91/33/46/1027913346.db2.gz PAXKWOZKTIINHY-KRWDZBQOSA-N 1 1 330.359 3.696 20 5 EHBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533529466 1028022078 /nfs/dbraw/zinc/02/20/78/1028022078.db2.gz IQUPKARJKUZEFK-CYBMUJFWSA-N 1 1 326.462 3.955 20 5 EHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648634 1028111582 /nfs/dbraw/zinc/11/15/82/1028111582.db2.gz HKHOHHZCBJCWGN-HIFRSBDPSA-N 1 1 336.395 3.849 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](C(C)C)C1 ZINC000444774973 1028262659 /nfs/dbraw/zinc/26/26/59/1028262659.db2.gz YXPJXOJFDNRTFF-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000421378347 1028339961 /nfs/dbraw/zinc/33/99/61/1028339961.db2.gz SSIVQKICXJSSMZ-IUODEOHRSA-N 1 1 332.425 3.669 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2cc(C)ccc21 ZINC000178728700 1028376030 /nfs/dbraw/zinc/37/60/30/1028376030.db2.gz FQFWLMZOEJLYAQ-KRWDZBQOSA-N 1 1 342.395 3.915 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])oc1C ZINC000292452228 1028427412 /nfs/dbraw/zinc/42/74/12/1028427412.db2.gz OATIIUDZRBMLHJ-GHMZBOCLSA-N 1 1 332.356 3.695 20 5 EHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419803 1028436603 /nfs/dbraw/zinc/43/66/03/1028436603.db2.gz JKZDDISUZZNVNM-CQSZACIVSA-N 1 1 330.384 3.675 20 5 EHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615676 1028488063 /nfs/dbraw/zinc/48/80/63/1028488063.db2.gz ZTVQYZUBZNPVGL-ZNMIVQPWSA-N 1 1 335.423 3.571 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)c(Cl)c1 ZINC000183803200 1029535252 /nfs/dbraw/zinc/53/52/52/1029535252.db2.gz OOSWQBGMTUJYRM-UHFFFAOYSA-N 1 1 342.786 3.928 20 5 EHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288259 1029578747 /nfs/dbraw/zinc/57/87/47/1029578747.db2.gz WUFPQVPSYZPABD-GXTWGEPZSA-N 1 1 333.432 3.741 20 5 EHBDMO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525123973 1029696678 /nfs/dbraw/zinc/69/66/78/1029696678.db2.gz VHEMFJXDMGARTG-LIRRHRJNSA-N 1 1 344.386 3.738 20 5 EHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000525123973 1029696684 /nfs/dbraw/zinc/69/66/84/1029696684.db2.gz VHEMFJXDMGARTG-LIRRHRJNSA-N 1 1 344.386 3.738 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cc(F)cc(Cl)c3)nc2c1 ZINC000446843610 1029824572 /nfs/dbraw/zinc/82/45/72/1029824572.db2.gz AWQFEIKVDFMKQS-UHFFFAOYSA-N 1 1 334.738 3.553 20 5 EHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407736 1029839198 /nfs/dbraw/zinc/83/91/98/1029839198.db2.gz HLAMISMXLMIVHU-LSDHHAIUSA-N 1 1 326.824 3.884 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1ccccn1 ZINC000035009611 1029840209 /nfs/dbraw/zinc/84/02/09/1029840209.db2.gz KIZLUHDSQRLVIN-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO COc1ccc(OCC[N@@H+](Cc2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000441183873 1029880972 /nfs/dbraw/zinc/88/09/72/1029880972.db2.gz SYHCEAOPKSNSCW-UHFFFAOYSA-N 1 1 344.411 3.893 20 5 EHBDMO CCOc1ccc([C@H](C)[N@H+]2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365340 1030180083 /nfs/dbraw/zinc/18/00/83/1030180083.db2.gz LVARIAAIFKWXAN-KBXCAEBGSA-N 1 1 334.416 3.557 20 5 EHBDMO CC[C@]1(C(C)C)C[C@@H]1[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453439724 1030257312 /nfs/dbraw/zinc/25/73/12/1030257312.db2.gz MILYNYARJRFALQ-JENIJYKNSA-N 1 1 342.443 3.832 20 5 EHBDMO CC(C)C[N@@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587024 1030321332 /nfs/dbraw/zinc/32/13/32/1030321332.db2.gz PWWBJURSHFAEKY-OXQOHEQNSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)C[N@H+]1CCC[C@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587024 1030321346 /nfs/dbraw/zinc/32/13/46/1030321346.db2.gz PWWBJURSHFAEKY-OXQOHEQNSA-N 1 1 345.487 3.930 20 5 EHBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532125091 1030418603 /nfs/dbraw/zinc/41/86/03/1030418603.db2.gz ZRAMYYWACYFZBX-OAHLLOKOSA-N 1 1 334.416 3.539 20 5 EHBDMO Cc1cnc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)c1 ZINC000583691012 1030462760 /nfs/dbraw/zinc/46/27/60/1030462760.db2.gz SFEJNNVQJMJCNH-UHFFFAOYSA-N 1 1 325.412 3.814 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOCC23CCCC3)o1 ZINC000537660845 1030916533 /nfs/dbraw/zinc/91/65/33/1030916533.db2.gz KCFPXNLVEGTBDN-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOCC23CCCC3)o1 ZINC000537660845 1030916547 /nfs/dbraw/zinc/91/65/47/1030916547.db2.gz KCFPXNLVEGTBDN-UHFFFAOYSA-N 1 1 342.395 4.000 20 5 EHBDMO COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1cncs1 ZINC000448367480 1031018376 /nfs/dbraw/zinc/01/83/76/1031018376.db2.gz QIKIGODMRUCMTO-RIYZIHGNSA-N 1 1 347.440 3.603 20 5 EHBDMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1cncs1 ZINC000448367480 1031018392 /nfs/dbraw/zinc/01/83/92/1031018392.db2.gz QIKIGODMRUCMTO-RIYZIHGNSA-N 1 1 347.440 3.603 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000551113176 1031042593 /nfs/dbraw/zinc/04/25/93/1031042593.db2.gz WXCYMLIRMLRESH-OAHLLOKOSA-N 1 1 341.411 3.834 20 5 EHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251363 1031065273 /nfs/dbraw/zinc/06/52/73/1031065273.db2.gz CZBJTNZDQRDWAD-CQSZACIVSA-N 1 1 344.415 3.903 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000122053324 1031292156 /nfs/dbraw/zinc/29/21/56/1031292156.db2.gz AQQUEVISZCZLKT-CYBMUJFWSA-N 1 1 349.456 3.994 20 5 EHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487880 1033369420 /nfs/dbraw/zinc/36/94/20/1033369420.db2.gz NYBDKGJUYQAWRW-HIFRSBDPSA-N 1 1 334.445 3.508 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC000063493759 1033401804 /nfs/dbraw/zinc/40/18/04/1033401804.db2.gz QGYOEOWCYUWWCT-UHFFFAOYSA-N 1 1 333.432 3.886 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1N(C)C ZINC000595020466 1033611511 /nfs/dbraw/zinc/61/15/11/1033611511.db2.gz YXIKFVSCDFOGCO-ZDUSSCGKSA-N 1 1 329.400 3.520 20 5 EHBDMO COc1cccc(C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC(C)C)c1 ZINC000595296702 1033721134 /nfs/dbraw/zinc/72/11/34/1033721134.db2.gz HEFBJSPAUNBLTJ-UHFFFAOYSA-N 1 1 333.388 3.558 20 5 EHBDMO COc1cccc(C[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC(C)C)c1 ZINC000595296702 1033721145 /nfs/dbraw/zinc/72/11/45/1033721145.db2.gz HEFBJSPAUNBLTJ-UHFFFAOYSA-N 1 1 333.388 3.558 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CCC[N@@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599110646 1033741712 /nfs/dbraw/zinc/74/17/12/1033741712.db2.gz DZPFSVRVCMKMMY-OAHLLOKOSA-N 1 1 340.427 3.677 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c2ncccc12 ZINC000599164092 1033779667 /nfs/dbraw/zinc/77/96/67/1033779667.db2.gz JLABLQRTNPNSKM-CQSZACIVSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(F)(c2ccccn2)CC1 ZINC000595474158 1033825068 /nfs/dbraw/zinc/82/50/68/1033825068.db2.gz COSRXODIAXJIOB-UHFFFAOYSA-N 1 1 333.338 3.590 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115990 1033944957 /nfs/dbraw/zinc/94/49/57/1033944957.db2.gz KFOVTISVBVLTRF-OAHLLOKOSA-N 1 1 326.343 3.613 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593115990 1033944977 /nfs/dbraw/zinc/94/49/77/1033944977.db2.gz KFOVTISVBVLTRF-OAHLLOKOSA-N 1 1 326.343 3.613 20 5 EHBDMO C[C@@H](c1ccccc1F)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000603840024 1033985349 /nfs/dbraw/zinc/98/53/49/1033985349.db2.gz OUNDRRSKRLELCO-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CCC3CC3)CC3CC3)n2)cc1 ZINC000595872359 1034031590 /nfs/dbraw/zinc/03/15/90/1034031590.db2.gz WLWYWDJWRCLTOI-UHFFFAOYSA-N 1 1 342.399 3.657 20 5 EHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000595867048 1034032590 /nfs/dbraw/zinc/03/25/90/1034032590.db2.gz JVZOPZAPGKEHTE-UONOGXRCSA-N 1 1 349.431 3.585 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059437 1034086631 /nfs/dbraw/zinc/08/66/31/1034086631.db2.gz OEXFUMALCSBQDM-HOCLYGCPSA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1cnc(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059437 1034086642 /nfs/dbraw/zinc/08/66/42/1034086642.db2.gz OEXFUMALCSBQDM-HOCLYGCPSA-N 1 1 346.818 3.809 20 5 EHBDMO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000450320756 1034127321 /nfs/dbraw/zinc/12/73/21/1034127321.db2.gz XJYPBXCJGOMGCA-ZDUSSCGKSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000596296319 1034147553 /nfs/dbraw/zinc/14/75/53/1034147553.db2.gz HAVCDQYUSYMCRZ-JSGCOSHPSA-N 1 1 325.359 3.961 20 5 EHBDMO CCC[C@@H](NCc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593321507 1034645649 /nfs/dbraw/zinc/64/56/49/1034645649.db2.gz YEYIMXJKOHVLSZ-GOSISDBHSA-N 1 1 331.391 3.824 20 5 EHBDMO CCOc1ccc([C@@H](C)NCc2ccccc2C[NH2+]C)cc1[N+](=O)[O-] ZINC000593324763 1034650966 /nfs/dbraw/zinc/65/09/66/1034650966.db2.gz ZNBGOZZDCYVZLV-CQSZACIVSA-N 1 1 343.427 3.564 20 5 EHBDMO CCOc1ccc([C@H](C)NCc2ccccc2C[NH2+]C)cc1[N+](=O)[O-] ZINC000593324762 1034651028 /nfs/dbraw/zinc/65/10/28/1034651028.db2.gz ZNBGOZZDCYVZLV-AWEZNQCLSA-N 1 1 343.427 3.564 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(CC(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000450689012 1034691990 /nfs/dbraw/zinc/69/19/90/1034691990.db2.gz XKSIPNYNSVUVRD-NSHDSACASA-N 1 1 342.321 3.513 20 5 EHBDMO CC[C@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411282932 1034850279 /nfs/dbraw/zinc/85/02/79/1034850279.db2.gz JYDPLLREBZSANA-AWEZNQCLSA-N 1 1 349.431 3.587 20 5 EHBDMO COc1ccccc1CCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935652 1035002294 /nfs/dbraw/zinc/00/22/94/1035002294.db2.gz QSAZXMRVXLWGKT-UHFFFAOYSA-N 1 1 328.412 3.711 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000612540179 1035044074 /nfs/dbraw/zinc/04/40/74/1035044074.db2.gz CBNNNOBZJPTFAT-HNNXBMFYSA-N 1 1 348.443 3.773 20 5 EHBDMO COc1cc(C[N@@H+](C)CCCc2ccccc2)c([N+](=O)[O-])cc1F ZINC000463475049 1035529022 /nfs/dbraw/zinc/52/90/22/1035529022.db2.gz VMXAJJJIJJVPRS-UHFFFAOYSA-N 1 1 332.375 3.807 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](COCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000075865944 1035569645 /nfs/dbraw/zinc/56/96/45/1035569645.db2.gz GPVRWZGFGIYJPG-SFHVURJKSA-N 1 1 340.423 3.942 20 5 EHBDMO CC[N@@H+](CCC(=O)OC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000511496523 1035699921 /nfs/dbraw/zinc/69/99/21/1035699921.db2.gz RCRVQWMDYZGSOK-UHFFFAOYSA-N 1 1 348.424 3.708 20 5 EHBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000457106745 1035743906 /nfs/dbraw/zinc/74/39/06/1035743906.db2.gz DOPNOKPWUPVVMU-QGZVFWFLSA-N 1 1 347.462 3.943 20 5 EHBDMO C[C@H](C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000588214985 1035826693 /nfs/dbraw/zinc/82/66/93/1035826693.db2.gz WDWKSDOGXADMAB-CABCVRRESA-N 1 1 346.402 3.720 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000464102573 1036126154 /nfs/dbraw/zinc/12/61/54/1036126154.db2.gz BCRNGCWYOVSRTN-CYBMUJFWSA-N 1 1 348.349 3.871 20 5 EHBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000541391378 1036277283 /nfs/dbraw/zinc/27/72/83/1036277283.db2.gz VPTGDVXIINPCQN-NSHDSACASA-N 1 1 339.823 3.555 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000031006289 1036389829 /nfs/dbraw/zinc/38/98/29/1036389829.db2.gz HBAFCLLBWGKTTN-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO CC(C)c1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381397 1036423621 /nfs/dbraw/zinc/42/36/21/1036423621.db2.gz IHTRECUFMZVADI-SFHVURJKSA-N 1 1 328.416 3.752 20 5 EHBDMO CCC[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000541662200 1036546459 /nfs/dbraw/zinc/54/64/59/1036546459.db2.gz BSTLVVJZNYHZPZ-HNNXBMFYSA-N 1 1 333.432 3.886 20 5 EHBDMO CCC1(CC)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCS1 ZINC000464574895 1036561985 /nfs/dbraw/zinc/56/19/85/1036561985.db2.gz AJNDPIBZTPWGCM-UHFFFAOYSA-N 1 1 335.429 3.844 20 5 EHBDMO CCC1(CC)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCS1 ZINC000464574895 1036561999 /nfs/dbraw/zinc/56/19/99/1036561999.db2.gz AJNDPIBZTPWGCM-UHFFFAOYSA-N 1 1 335.429 3.844 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000464675721 1036648958 /nfs/dbraw/zinc/64/89/58/1036648958.db2.gz BWJIBTJHTVLICZ-OAHLLOKOSA-N 1 1 344.386 3.807 20 5 EHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736836 1036695162 /nfs/dbraw/zinc/69/51/62/1036695162.db2.gz LTXPSCIYHXSGDB-DZGCQCFKSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000249777553 1036920330 /nfs/dbraw/zinc/92/03/30/1036920330.db2.gz CJIMKUAUUMBZER-BLLLJJGKSA-N 1 1 332.425 3.526 20 5 EHBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3ccsc3[N+](=O)[O-])CC2)c1 ZINC000609143799 1036955637 /nfs/dbraw/zinc/95/56/37/1036955637.db2.gz UBQFZIAQMHWAQU-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](CC)N2CCCC2)cc1[N+](=O)[O-] ZINC000152852064 1036996791 /nfs/dbraw/zinc/99/67/91/1036996791.db2.gz BNFYZLXCVRCXAT-GDBMZVCRSA-N 1 1 335.448 3.519 20 5 EHBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000590967249 1037144209 /nfs/dbraw/zinc/14/42/09/1037144209.db2.gz UYFGGOLZHFIGLF-GASCZTMLSA-N 1 1 326.352 3.551 20 5 EHBDMO COc1cc(C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000191509633 1037174628 /nfs/dbraw/zinc/17/46/28/1037174628.db2.gz BRTONDTVVSPTES-UHFFFAOYSA-N 1 1 342.395 3.782 20 5 EHBDMO COc1ccc(C[N@H+]2CC[C@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318603 1037285948 /nfs/dbraw/zinc/28/59/48/1037285948.db2.gz VGVLMWBJMVZROP-KRWDZBQOSA-N 1 1 326.396 3.901 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000542322048 1037298674 /nfs/dbraw/zinc/29/86/74/1037298674.db2.gz GWIVBKXPPZLICK-QGZVFWFLSA-N 1 1 326.396 3.901 20 5 EHBDMO Cc1cnc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311041766 1037311314 /nfs/dbraw/zinc/31/13/14/1037311314.db2.gz SCHXWTPJEFZMGQ-QGZVFWFLSA-N 1 1 340.427 3.622 20 5 EHBDMO Cn1cc(C[N@H+]2CC[C@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591267706 1037313375 /nfs/dbraw/zinc/31/33/75/1037313375.db2.gz DEKCYEXBJJWOMD-INIZCTEOSA-N 1 1 340.427 3.617 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000311199281 1037570091 /nfs/dbraw/zinc/57/00/91/1037570091.db2.gz JQLUJGYFYYDNDL-LJQANCHMSA-N 1 1 340.427 3.622 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494117166 1037839452 /nfs/dbraw/zinc/83/94/52/1037839452.db2.gz REASRLJACXQGNP-UHFFFAOYSA-N 1 1 325.368 3.717 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000592146401 1037868523 /nfs/dbraw/zinc/86/85/23/1037868523.db2.gz OGRGOPFXBHIEOY-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000592146401 1037868530 /nfs/dbraw/zinc/86/85/30/1037868530.db2.gz OGRGOPFXBHIEOY-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO C[N@@H+](CCOCC1CC1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000538764081 1038529406 /nfs/dbraw/zinc/52/94/06/1038529406.db2.gz LFENRZROWUJNSM-UHFFFAOYSA-N 1 1 330.384 3.713 20 5 EHBDMO Cc1cccc([C@H]2CCCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)c1C ZINC000478013179 1039117055 /nfs/dbraw/zinc/11/70/55/1039117055.db2.gz CQQMWCSMMFDLDZ-QGZVFWFLSA-N 1 1 328.416 3.635 20 5 EHBDMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668097 1039384809 /nfs/dbraw/zinc/38/48/09/1039384809.db2.gz ICUGJSLWRZBFEK-WFASDCNBSA-N 1 1 346.818 3.891 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340922 1039706549 /nfs/dbraw/zinc/70/65/49/1039706549.db2.gz AXNCEQHAGFIKLE-DYVFJYSZSA-N 1 1 342.395 3.916 20 5 EHBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000894081731 1040039753 /nfs/dbraw/zinc/03/97/53/1040039753.db2.gz AWBGKFIKJORMDN-UHFFFAOYSA-N 1 1 330.262 3.505 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000192951738 1040158049 /nfs/dbraw/zinc/15/80/49/1040158049.db2.gz IUOCRVLSPZVWJW-CQSZACIVSA-N 1 1 346.818 3.577 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2cccs2)CC1 ZINC000490084793 1040351748 /nfs/dbraw/zinc/35/17/48/1040351748.db2.gz CSUQMGRZWBCHFL-AWEZNQCLSA-N 1 1 331.441 3.848 20 5 EHBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCCCC1 ZINC000029455055 1040626225 /nfs/dbraw/zinc/62/62/25/1040626225.db2.gz MQAKZHDELWQICE-UHFFFAOYSA-N 1 1 339.823 3.699 20 5 EHBDMO CCc1ccc([C@@H]2CCCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871417 1041203748 /nfs/dbraw/zinc/20/37/48/1041203748.db2.gz BEAXNIJYHRQLGZ-INIZCTEOSA-N 1 1 332.404 3.564 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)O1 ZINC000511958984 1042488745 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C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCCC1)C1CCN(C)CC1 ZINC001173238088 1132026697 /nfs/dbraw/zinc/02/66/97/1132026697.db2.gz MXBKHSMOVKBUDF-INIZCTEOSA-N 1 1 345.487 3.865 20 5 EHBDMO COC(=O)[C@@H]1CCCC[C@@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860257 1132583193 /nfs/dbraw/zinc/58/31/93/1132583193.db2.gz VYKFJNJSGUQUPC-CRAIPNDOSA-N 1 1 346.427 3.539 20 5 EHBDMO CC1(C)[C@H](c2ccccc2F)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175454430 1132686967 /nfs/dbraw/zinc/68/69/67/1132686967.db2.gz STUNELFNLJBWEK-HNNXBMFYSA-N 1 1 329.375 3.897 20 5 EHBDMO CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CCC1 ZINC001169696525 1132823556 /nfs/dbraw/zinc/82/35/56/1132823556.db2.gz HFXLUPCQTQKTRJ-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])CC1CCC1 ZINC001169696525 1132823561 /nfs/dbraw/zinc/82/35/61/1132823561.db2.gz HFXLUPCQTQKTRJ-UHFFFAOYSA-N 1 1 327.222 3.979 20 5 EHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155317 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QCYXKPKVKRNJLG-IQJOONFLSA-N 1 1 330.215 3.654 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000792355351 1134680473 /nfs/dbraw/zinc/68/04/73/1134680473.db2.gz RIZRZAOKKHZSNG-ZIAGYGMSSA-N 1 1 346.349 3.539 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc([Si](C)(C)C)cc1 ZINC001170196187 1134712006 /nfs/dbraw/zinc/71/20/06/1134712006.db2.gz YHMGEMBETYYNPP-UHFFFAOYSA-N 1 1 342.515 3.815 20 5 EHBDMO CC[C@@H]1CC[C@H](C)[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001170281243 1134741541 /nfs/dbraw/zinc/74/15/41/1134741541.db2.gz ZFFAIOJKNSFFGC-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001170281243 1134741548 /nfs/dbraw/zinc/74/15/48/1134741548.db2.gz ZFFAIOJKNSFFGC-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353612 1134753940 /nfs/dbraw/zinc/75/39/40/1134753940.db2.gz ZYEKHHYYLHORFU-IUODEOHRSA-N 1 1 347.440 3.828 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2nccs2)c([N+](=O)[O-])c1 ZINC001170353612 1134753942 /nfs/dbraw/zinc/75/39/42/1134753942.db2.gz ZYEKHHYYLHORFU-IUODEOHRSA-N 1 1 347.440 3.828 20 5 EHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC001191368238 1134858637 /nfs/dbraw/zinc/85/86/37/1134858637.db2.gz YYKXFLVXSSLJKS-DLBZAZTESA-N 1 1 336.457 3.724 20 5 EHBDMO C[C@H]1C[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502611 1135025121 /nfs/dbraw/zinc/02/51/21/1135025121.db2.gz WQKNSKMJCKAYTC-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@H]1C[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502611 1135025128 /nfs/dbraw/zinc/02/51/28/1135025128.db2.gz WQKNSKMJCKAYTC-LLVKDONJSA-N 1 1 339.823 3.555 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000804564496 1135121784 /nfs/dbraw/zinc/12/17/84/1135121784.db2.gz WWXZAOGNVYCPLP-SWLSCSKDSA-N 1 1 335.835 3.701 20 5 EHBDMO CC1(C)c2ccccc2CC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001195384733 1135421710 /nfs/dbraw/zinc/42/17/10/1135421710.db2.gz CYACJYBMNPJHPE-UHFFFAOYSA-N 1 1 326.396 3.767 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@](C)(c2cccc(F)c2)C1 ZINC001195851589 1135475518 /nfs/dbraw/zinc/47/55/18/1135475518.db2.gz LQBBESJWKNJXLI-IBGZPJMESA-N 1 1 344.386 3.906 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613094 1135589714 /nfs/dbraw/zinc/58/97/14/1135589714.db2.gz HTUWVHRXYYYZRL-XGACYXMMSA-N 1 1 332.400 3.560 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095626 1135591680 /nfs/dbraw/zinc/59/16/80/1135591680.db2.gz KYRMPSASJUIVAA-MRXNPFEDSA-N 1 1 347.462 3.991 20 5 EHBDMO COC(=O)C(C)(C)C[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC001197325551 1135680004 /nfs/dbraw/zinc/68/00/04/1135680004.db2.gz JGEAORBMBMPGCP-UHFFFAOYSA-N 1 1 336.432 3.560 20 5 EHBDMO C[C@@]1(Cc2cccs2)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301960 1135796644 /nfs/dbraw/zinc/79/66/44/1135796644.db2.gz ZCKWGIQDQIPLQM-ROUUACIJSA-N 1 1 346.452 3.787 20 5 EHBDMO C[C@@]12CSC[C@@H]1C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC001198468478 1135818645 /nfs/dbraw/zinc/81/86/45/1135818645.db2.gz WWBGTXDGHUBVEX-SMDDNHRTSA-N 1 1 346.374 3.799 20 5 EHBDMO CC[N@H+]1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843916 1135931865 /nfs/dbraw/zinc/93/18/65/1135931865.db2.gz SJBVADALIZUJQA-HNNXBMFYSA-N 1 1 343.427 3.676 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776271685 1136124353 /nfs/dbraw/zinc/12/43/53/1136124353.db2.gz NDIURPJBPVTVRF-IBGZPJMESA-N 1 1 328.412 3.884 20 5 EHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274959 1136128912 /nfs/dbraw/zinc/12/89/12/1136128912.db2.gz DYSRNZCYUMMEPZ-SJKOYZFVSA-N 1 1 334.803 3.975 20 5 EHBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000776278075 1136131209 /nfs/dbraw/zinc/13/12/09/1136131209.db2.gz RPDXKWXPEPXDDR-UIAACRFSSA-N 1 1 340.423 3.754 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000776583345 1136441983 /nfs/dbraw/zinc/44/19/83/1136441983.db2.gz DNXJTSNBXZBCOU-IRXDYDNUSA-N 1 1 330.384 3.839 20 5 EHBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584568 1136442580 /nfs/dbraw/zinc/44/25/80/1136442580.db2.gz MYFGNYYSFWLFEQ-WOJBJXKFSA-N 1 1 340.423 3.682 20 5 EHBDMO CC(C)C[N@@H+](CCc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579924 1136444653 /nfs/dbraw/zinc/44/46/53/1136444653.db2.gz PQVCIFLWYALVNW-FQEVSTJZSA-N 1 1 342.439 3.829 20 5 EHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588190 1136446009 /nfs/dbraw/zinc/44/60/09/1136446009.db2.gz MDZFVILGWLIJNP-ZNOIYHFQSA-N 1 1 344.386 3.850 20 5 EHBDMO CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000776591392 1136450529 /nfs/dbraw/zinc/45/05/29/1136450529.db2.gz MECOHKIAHSLRCG-MSOLQXFVSA-N 1 1 326.396 3.711 20 5 EHBDMO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000858099530 1136940106 /nfs/dbraw/zinc/94/01/06/1136940106.db2.gz ZCGBDGMERUTZAO-UHFFFAOYSA-N 1 1 348.424 3.901 20 5 EHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]3COCC[C@H]32)c1 ZINC000339015684 1136995400 /nfs/dbraw/zinc/99/54/00/1136995400.db2.gz WPCFZVODFYIFHG-XHDPSFHLSA-N 1 1 344.333 3.615 20 5 EHBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738644 1137075891 /nfs/dbraw/zinc/07/58/91/1137075891.db2.gz CGGKGMVJLWTJDV-ZBFHGGJFSA-N 1 1 340.379 3.532 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823606945 1137106581 /nfs/dbraw/zinc/10/65/81/1137106581.db2.gz XTVZZIRTUBBQCD-DNVCBOLYSA-N 1 1 328.412 3.804 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@]3(CCSC3)C2)ccc1Cl ZINC000825215643 1137169040 /nfs/dbraw/zinc/16/90/40/1137169040.db2.gz UQRYHWTVAUTRPE-OAHLLOKOSA-N 1 1 326.849 3.967 20 5 EHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706720 1137239704 /nfs/dbraw/zinc/23/97/04/1137239704.db2.gz WABVWJFZHJLYHW-HNNXBMFYSA-N 1 1 343.431 3.569 20 5 EHBDMO O=[N+]([O-])c1ccc(NCCc2cn3c([nH+]2)CCCC3)c(C(F)F)c1 ZINC000865433814 1137283463 /nfs/dbraw/zinc/28/34/63/1137283463.db2.gz KHEGTRBZMPPWPA-UHFFFAOYSA-N 1 1 336.342 3.720 20 5 EHBDMO CC(=O)Oc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000122902062 1137475637 /nfs/dbraw/zinc/47/56/37/1137475637.db2.gz OLGSEVATIVLFCI-UHFFFAOYSA-N 1 1 342.395 3.931 20 5 EHBDMO C[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccns1 ZINC000715995277 1137479343 /nfs/dbraw/zinc/47/93/43/1137479343.db2.gz RORAQIXKGNRIME-MRVPVSSYSA-N 1 1 342.218 3.665 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1 ZINC000888572691 1137541805 /nfs/dbraw/zinc/54/18/05/1137541805.db2.gz TZEFGIBIXQRZKQ-UHFFFAOYSA-N 1 1 340.383 3.541 20 5 EHBDMO C[C@@H](NC[C@@H](c1cccs1)[NH+](C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017573 1137564705 /nfs/dbraw/zinc/56/47/05/1137564705.db2.gz CJEZCOYSCCEICF-RISCZKNCSA-N 1 1 337.420 3.749 20 5 EHBDMO COc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)cc1O ZINC000872031501 1137566435 /nfs/dbraw/zinc/56/64/35/1137566435.db2.gz PQWBRLYGNHCAIU-NSHDSACASA-N 1 1 348.424 3.882 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1c(F)cccc1[N+](=O)[O-] ZINC000872032404 1137566506 /nfs/dbraw/zinc/56/65/06/1137566506.db2.gz SODJCLLEWJXDEI-LBPRGKRZSA-N 1 1 346.358 3.746 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CO)c1ccccc1 ZINC000872044199 1137567331 /nfs/dbraw/zinc/56/73/31/1137567331.db2.gz RTEHIFNLJKUHJX-LRDDRELGSA-N 1 1 332.425 3.701 20 5 EHBDMO CCn1nc(C)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1C ZINC000877664641 1137684818 /nfs/dbraw/zinc/68/48/18/1137684818.db2.gz VGHMHDLKHKADOQ-UHFFFAOYSA-N 1 1 336.823 3.713 20 5 EHBDMO CCn1nc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1C ZINC000877664641 1137684819 /nfs/dbraw/zinc/68/48/19/1137684819.db2.gz VGHMHDLKHKADOQ-UHFFFAOYSA-N 1 1 336.823 3.713 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000877672558 1137685235 /nfs/dbraw/zinc/68/52/35/1137685235.db2.gz HGFVZQWDTFWLSU-QAPCUYQASA-N 1 1 346.814 3.946 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1Cl ZINC000877672558 1137685236 /nfs/dbraw/zinc/68/52/36/1137685236.db2.gz HGFVZQWDTFWLSU-QAPCUYQASA-N 1 1 346.814 3.946 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674374 1137685459 /nfs/dbraw/zinc/68/54/59/1137685459.db2.gz UZEFZZFBFXQWCS-HKUYNNGSSA-N 1 1 326.396 3.601 20 5 EHBDMO CC(C)(O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000877835866 1137692880 /nfs/dbraw/zinc/69/28/80/1137692880.db2.gz YLCJAFORLBXBSI-ZDUSSCGKSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000878416057 1137715037 /nfs/dbraw/zinc/71/50/37/1137715037.db2.gz AIIJSZNQRXCEGF-NSHDSACASA-N 1 1 344.396 3.866 20 5 EHBDMO CCC[C@H](C)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000883257406 1137850966 /nfs/dbraw/zinc/85/09/66/1137850966.db2.gz AMGAIDKIWUEMKW-WMLDXEAASA-N 1 1 330.432 3.834 20 5 EHBDMO COC[C@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000112990616 1137911195 /nfs/dbraw/zinc/91/11/95/1137911195.db2.gz IHTYXISFERVODF-HNNXBMFYSA-N 1 1 337.419 3.805 20 5 EHBDMO COc1cc(C[N@H+](C)Cc2ccccc2SC)ccc1[N+](=O)[O-] ZINC000348328726 1137964332 /nfs/dbraw/zinc/96/43/32/1137964332.db2.gz VTMAMTHUNQHFQU-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2SC)ccc1[N+](=O)[O-] ZINC000348328726 1137964333 /nfs/dbraw/zinc/96/43/33/1137964333.db2.gz VTMAMTHUNQHFQU-UHFFFAOYSA-N 1 1 332.425 3.957 20 5 EHBDMO COc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1OC ZINC000886057846 1138036490 /nfs/dbraw/zinc/03/64/90/1138036490.db2.gz YZQOOGQBTSQTAE-LLVKDONJSA-N 1 1 334.347 3.602 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000136958667 1138044647 /nfs/dbraw/zinc/04/46/47/1138044647.db2.gz SRWMGWYNOWAJGR-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccc(F)cc2F)C2CC2)c1 ZINC000136958667 1138044649 /nfs/dbraw/zinc/04/46/49/1138044649.db2.gz SRWMGWYNOWAJGR-SFHVURJKSA-N 1 1 348.349 3.571 20 5 EHBDMO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000886107104 1138047502 /nfs/dbraw/zinc/04/75/02/1138047502.db2.gz KMGKRZUDJLEECT-CYBMUJFWSA-N 1 1 337.326 3.832 20 5 EHBDMO COC[C@@H](C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886302815 1138065991 /nfs/dbraw/zinc/06/59/91/1138065991.db2.gz WYEPYRYQHWDJIV-RDTXWAMCSA-N 1 1 341.411 3.514 20 5 EHBDMO COC[C@@H](C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886302815 1138065993 /nfs/dbraw/zinc/06/59/93/1138065993.db2.gz WYEPYRYQHWDJIV-RDTXWAMCSA-N 1 1 341.411 3.514 20 5 EHBDMO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCCO2 ZINC000089512630 1138200705 /nfs/dbraw/zinc/20/07/05/1138200705.db2.gz UPJXEMQJPXRESY-MRXNPFEDSA-N 1 1 328.368 3.607 20 5 EHBDMO C[C@H]1C[C@@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130656387 1138467347 /nfs/dbraw/zinc/46/73/47/1138467347.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130656387 1138467350 /nfs/dbraw/zinc/46/73/50/1138467350.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 1 1 343.427 3.769 20 5 EHBDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000130656387 1138467352 /nfs/dbraw/zinc/46/73/52/1138467352.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 1 1 343.427 3.769 20 5 EHBDMO CCc1nc(C)c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000178728268 1139715704 /nfs/dbraw/zinc/71/57/04/1139715704.db2.gz GXWSRMLKYITDBT-JTQLQIEISA-N 1 1 335.429 3.782 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)c(F)c1 ZINC000266982952 1140746814 /nfs/dbraw/zinc/74/68/14/1140746814.db2.gz BCJUKHDWWWVIAM-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO COc1ccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1[N+](=O)[O-] ZINC000269853629 1141151585 /nfs/dbraw/zinc/15/15/85/1141151585.db2.gz PROQFVPTLNUWEO-CQSZACIVSA-N 1 1 334.322 3.659 20 5 EHBDMO CC(C)[N@@H+](Cc1cnc(N(C)C)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000271077720 1141305781 /nfs/dbraw/zinc/30/57/81/1141305781.db2.gz PJGOCBNGTDAWOC-UHFFFAOYSA-N 1 1 334.445 3.528 20 5 EHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000271225743 1141328678 /nfs/dbraw/zinc/32/86/78/1141328678.db2.gz AMLZDCNJGAVITK-DOTOQJQBSA-N 1 1 330.384 3.584 20 5 EHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275497 1141492141 /nfs/dbraw/zinc/49/21/41/1141492141.db2.gz BYVYDFNBGKKQDA-CABCVRRESA-N 1 1 334.416 3.710 20 5 EHBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339116650 1141501445 /nfs/dbraw/zinc/50/14/45/1141501445.db2.gz UZYHIOCVNHUJJL-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123760 1141503092 /nfs/dbraw/zinc/50/30/92/1141503092.db2.gz JOZUNRCOLRYLMO-YPMHNXCESA-N 1 1 346.349 3.597 20 5 EHBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(-n2cccn2)c(F)c1 ZINC000339426737 1014406303 /nfs/dbraw/zinc/40/63/03/1014406303.db2.gz WEMPSPLTXCUFRZ-LLVKDONJSA-N 1 1 346.387 3.832 20 5 EHBDMO O=C(CC[N@H+]1CCC2(C1)CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000610216210 1015031968 /nfs/dbraw/zinc/03/19/68/1015031968.db2.gz ABQZTJIBUONKMD-UHFFFAOYSA-N 1 1 331.416 3.580 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228995 1015128212 /nfs/dbraw/zinc/12/82/12/1015128212.db2.gz SOCLOLZJZBCBLB-HNNXBMFYSA-N 1 1 342.395 3.602 20 5 EHBDMO Cc1c([C@H](C)[NH2+][C@H](CN(C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368977 1032251850 /nfs/dbraw/zinc/25/18/50/1032251850.db2.gz PVQVZKDNOAOGGV-KBXCAEBGSA-N 1 1 345.418 3.996 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2noc3ccccc32)C2CC2)cc1 ZINC000593968926 1032662728 /nfs/dbraw/zinc/66/27/28/1032662728.db2.gz ODODDGOHTAYHCE-UHFFFAOYSA-N 1 1 337.379 3.943 20 5 EHBDMO CC(C)[N@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236652518 1017525488 /nfs/dbraw/zinc/52/54/88/1017525488.db2.gz XRIZUKAUXZXHHC-UHFFFAOYSA-N 1 1 333.457 3.753 20 5 EHBDMO CC(C)[N@@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236652518 1017525501 /nfs/dbraw/zinc/52/55/01/1017525501.db2.gz XRIZUKAUXZXHHC-UHFFFAOYSA-N 1 1 333.457 3.753 20 5 EHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000549187613 1017558475 /nfs/dbraw/zinc/55/84/75/1017558475.db2.gz RGDGTXPTGWCJKJ-UHFFFAOYSA-N 1 1 334.416 3.539 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404510 1032776396 /nfs/dbraw/zinc/77/63/96/1032776396.db2.gz ZARRCMMRNNKBKZ-SUMWQHHRSA-N 1 1 332.375 3.817 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)s1 ZINC000102774569 1018600646 /nfs/dbraw/zinc/60/06/46/1018600646.db2.gz YXFXYRITYDNKFC-UHFFFAOYSA-N 1 1 347.440 3.734 20 5 EHBDMO CC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1F ZINC000594019550 1032793183 /nfs/dbraw/zinc/79/31/83/1032793183.db2.gz MMWKJTGDBMBTPT-OAHLLOKOSA-N 1 1 345.374 3.722 20 5 EHBDMO C[C@H](N[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997941 1018935557 /nfs/dbraw/zinc/93/55/57/1018935557.db2.gz CRGBNLRVOJOOIM-GJYPPUQNSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](N[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997941 1018935571 /nfs/dbraw/zinc/93/55/71/1018935571.db2.gz CRGBNLRVOJOOIM-GJYPPUQNSA-N 1 1 339.439 3.908 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433432 1019091469 /nfs/dbraw/zinc/09/14/69/1019091469.db2.gz JJJRSIYDRNRWIZ-SJLPKXTDSA-N 1 1 339.439 3.862 20 5 EHBDMO CC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427637 1032816625 /nfs/dbraw/zinc/81/66/25/1032816625.db2.gz LTBKCWBPURVAGN-CXAGYDPISA-N 1 1 345.468 3.883 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C(C)C)CC1 ZINC001167425622 1019768373 /nfs/dbraw/zinc/76/83/73/1019768373.db2.gz RVBQUUDJKAERGT-OAHLLOKOSA-N 1 1 333.432 3.600 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000610476528 1020421553 /nfs/dbraw/zinc/42/15/53/1020421553.db2.gz DEBQRVWYLIXFEB-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000610476528 1020421556 /nfs/dbraw/zinc/42/15/56/1020421556.db2.gz DEBQRVWYLIXFEB-GOSISDBHSA-N 1 1 330.359 3.698 20 5 EHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138305 1020727532 /nfs/dbraw/zinc/72/75/32/1020727532.db2.gz XTNUSENHHZKUON-KGLIPLIRSA-N 1 1 333.432 3.822 20 5 EHBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000348676117 1021222981 /nfs/dbraw/zinc/22/29/81/1021222981.db2.gz ROLIVRXUSWOWPX-UHFFFAOYSA-N 1 1 344.459 3.838 20 5 EHBDMO CN(C)C1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000437113679 1021569276 /nfs/dbraw/zinc/56/92/76/1021569276.db2.gz KGOJNLPCTFNNBF-IBGZPJMESA-N 1 1 339.439 3.758 20 5 EHBDMO CCC(CC)C[N@@H+](CC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172895693 1033004477 /nfs/dbraw/zinc/00/44/77/1033004477.db2.gz ZARQDLAYEMHPCX-UHFFFAOYSA-N 1 1 331.420 3.569 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCCc4sccc43)nc2c1 ZINC000602611344 1033025599 /nfs/dbraw/zinc/02/55/99/1033025599.db2.gz MULYRYHCUUJMFW-LBPRGKRZSA-N 1 1 329.381 3.965 20 5 EHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184454879 1022340736 /nfs/dbraw/zinc/34/07/36/1022340736.db2.gz JWGNADFEJGZPTM-GJZGRUSLSA-N 1 1 334.416 3.710 20 5 EHBDMO CC(C)c1ccc(CNC[C@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000517552663 1022438630 /nfs/dbraw/zinc/43/86/30/1022438630.db2.gz VRQJLKYNZCHZEI-INIZCTEOSA-N 1 1 333.476 3.928 20 5 EHBDMO Cn1ccnc1[C@H](C1CC1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000602686082 1033067075 /nfs/dbraw/zinc/06/70/75/1033067075.db2.gz VKHLNCMMLGMELX-WMZOPIPTSA-N 1 1 340.427 3.659 20 5 EHBDMO CC(C)[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000550186323 1022693031 /nfs/dbraw/zinc/69/30/31/1022693031.db2.gz DVAWTKAHIPJARO-OAHLLOKOSA-N 1 1 346.349 3.861 20 5 EHBDMO CC(C)[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCCO1 ZINC000550186323 1022693039 /nfs/dbraw/zinc/69/30/39/1022693039.db2.gz DVAWTKAHIPJARO-OAHLLOKOSA-N 1 1 346.349 3.861 20 5 EHBDMO C[C@H](c1ccccc1Cl)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000026486103 1033078888 /nfs/dbraw/zinc/07/88/88/1033078888.db2.gz HXXNKZGZXYYESH-CYBMUJFWSA-N 1 1 346.818 3.526 20 5 EHBDMO C[C@@H](c1ccccc1Cl)[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000026486109 1033079123 /nfs/dbraw/zinc/07/91/23/1033079123.db2.gz HXXNKZGZXYYESH-ZDUSSCGKSA-N 1 1 346.818 3.526 20 5 EHBDMO CN1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427925 1023121770 /nfs/dbraw/zinc/12/17/70/1023121770.db2.gz YTVVKTTXXKFSGH-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)C1 ZINC000127388480 1023147791 /nfs/dbraw/zinc/14/77/91/1023147791.db2.gz ZFYSHGAABDHQLO-QWHCGFSZSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H](C[N@H+](C)Cc1ccccc1)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256558 1023173729 /nfs/dbraw/zinc/17/37/29/1023173729.db2.gz FOHWHCSUULQSFA-CVEARBPZSA-N 1 1 327.428 3.766 20 5 EHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256558 1023173733 /nfs/dbraw/zinc/17/37/33/1023173733.db2.gz FOHWHCSUULQSFA-CVEARBPZSA-N 1 1 327.428 3.766 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@@H]12 ZINC000248417903 1023260826 /nfs/dbraw/zinc/26/08/26/1023260826.db2.gz JXUAFBHIIUQWAD-KCXAZCMYSA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccns1 ZINC000926303505 1023574840 /nfs/dbraw/zinc/57/48/40/1023574840.db2.gz MGGCQBRCLIXSSF-QMMMGPOBSA-N 1 1 331.319 3.921 20 5 EHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2c2cccc3ccccc32)n1 ZINC000176217114 1023882728 /nfs/dbraw/zinc/88/27/28/1023882728.db2.gz XXRBMIMTBRMPFU-SFHVURJKSA-N 1 1 336.395 3.782 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000237197738 1024204236 /nfs/dbraw/zinc/20/42/36/1024204236.db2.gz OWXGJJLRCRBCMK-UHFFFAOYSA-N 1 1 340.301 3.912 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(N(C)C)c1 ZINC000538724760 1024482469 /nfs/dbraw/zinc/48/24/69/1024482469.db2.gz AFCHKTIYHVUSOB-UHFFFAOYSA-N 1 1 343.427 3.692 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000538724760 1024482479 /nfs/dbraw/zinc/48/24/79/1024482479.db2.gz AFCHKTIYHVUSOB-UHFFFAOYSA-N 1 1 343.427 3.692 20 5 EHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957238 1024525294 /nfs/dbraw/zinc/52/52/94/1024525294.db2.gz ZMKBBUVSXQAOEL-IUODEOHRSA-N 1 1 346.818 3.891 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCC[C@H]1O ZINC000538812487 1024529063 /nfs/dbraw/zinc/52/90/63/1024529063.db2.gz RSVXKRXWDSVLFW-SUMWQHHRSA-N 1 1 346.452 3.916 20 5 EHBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185218943 1024653020 /nfs/dbraw/zinc/65/30/20/1024653020.db2.gz PXTLHDISBLRQBS-QGZVFWFLSA-N 1 1 330.384 3.590 20 5 EHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000065532902 1024665090 /nfs/dbraw/zinc/66/50/90/1024665090.db2.gz BVPWMOUXGJTRJZ-GOSISDBHSA-N 1 1 330.359 3.950 20 5 EHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)c1cncs1 ZINC000934197033 1024667787 /nfs/dbraw/zinc/66/77/87/1024667787.db2.gz YJTOTNRTHQTQEN-QMMMGPOBSA-N 1 1 342.218 3.665 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883984 1033233338 /nfs/dbraw/zinc/23/33/38/1033233338.db2.gz AFVYLFHFBCOFBK-INIZCTEOSA-N 1 1 334.379 3.528 20 5 EHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000520785197 1024793625 /nfs/dbraw/zinc/79/36/25/1024793625.db2.gz BJMXUPVBGVEIJB-KRWDZBQOSA-N 1 1 344.386 3.820 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3[C@H](O)CC[C@@H]3C2)s1 ZINC000895785209 1024832231 /nfs/dbraw/zinc/83/22/31/1024832231.db2.gz RUCXBYBMDPXONR-ISTRZQFTSA-N 1 1 344.436 3.526 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000515333664 1025176667 /nfs/dbraw/zinc/17/66/67/1025176667.db2.gz ZSWZTAMRQRHYIU-IBGZPJMESA-N 1 1 326.396 3.649 20 5 EHBDMO C[N@@H+](CCCCc1ccccc1)CCOc1ccccc1[N+](=O)[O-] ZINC000521184434 1025259324 /nfs/dbraw/zinc/25/93/24/1025259324.db2.gz VXKNHYCNOCOBQR-UHFFFAOYSA-N 1 1 328.412 3.928 20 5 EHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000072058781 1025283136 /nfs/dbraw/zinc/28/31/36/1025283136.db2.gz ZDRBPTVWHIVLRF-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000072058781 1025283145 /nfs/dbraw/zinc/28/31/45/1025283145.db2.gz ZDRBPTVWHIVLRF-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(Cc2nccs2)CC1 ZINC000602955974 1033279343 /nfs/dbraw/zinc/27/93/43/1033279343.db2.gz MYVHMALNKGQEST-UHFFFAOYSA-N 1 1 335.404 3.645 20 5 EHBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000346991361 1025394673 /nfs/dbraw/zinc/39/46/73/1025394673.db2.gz UMIOQVIPTJLWJM-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000346991361 1025394681 /nfs/dbraw/zinc/39/46/81/1025394681.db2.gz UMIOQVIPTJLWJM-MRXNPFEDSA-N 1 1 327.384 3.726 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436319136 1025583068 /nfs/dbraw/zinc/58/30/68/1025583068.db2.gz QPWCQKGTEGIZRN-NSHDSACASA-N 1 1 346.353 3.541 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000020813783 1025984825 /nfs/dbraw/zinc/98/48/25/1025984825.db2.gz VORQPUBZLVHVEV-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000020813783 1025984836 /nfs/dbraw/zinc/98/48/36/1025984836.db2.gz VORQPUBZLVHVEV-LBPRGKRZSA-N 1 1 347.802 3.880 20 5 EHBDMO COC(=O)c1oc([C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511122016 1026219562 /nfs/dbraw/zinc/21/95/62/1026219562.db2.gz LZDOZCGDIGEFGQ-ZDUSSCGKSA-N 1 1 346.383 3.518 20 5 EHBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718365 1026366196 /nfs/dbraw/zinc/36/61/96/1026366196.db2.gz PXQYOAHJBFLIAI-ZFWWWQNUSA-N 1 1 330.384 3.590 20 5 EHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000530901686 1026386001 /nfs/dbraw/zinc/38/60/01/1026386001.db2.gz QALZDDPMZPDKGL-DOTOQJQBSA-N 1 1 349.475 3.687 20 5 EHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C2CC2)O1 ZINC000475291887 1026436722 /nfs/dbraw/zinc/43/67/22/1026436722.db2.gz QJWQXMRRUCFXRF-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C2CC2)O1 ZINC000475291887 1026436729 /nfs/dbraw/zinc/43/67/29/1026436729.db2.gz QJWQXMRRUCFXRF-ORAYPTAESA-N 1 1 342.395 3.854 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)n1 ZINC000611616501 1026525253 /nfs/dbraw/zinc/52/52/53/1026525253.db2.gz ULTPPOBCNVRUNB-IRXDYDNUSA-N 1 1 346.475 3.697 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCCC1 ZINC000128072049 1026916323 /nfs/dbraw/zinc/91/63/23/1026916323.db2.gz VJCYMXHCUIKWQT-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1(O)CCCC1 ZINC000128076023 1026932608 /nfs/dbraw/zinc/93/26/08/1026932608.db2.gz OLCPWSQFCCUGPM-UHFFFAOYSA-N 1 1 330.384 3.592 20 5 EHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000548761144 1027408750 /nfs/dbraw/zinc/40/87/50/1027408750.db2.gz GJBLRZRYKSEPTP-BFYDXBDKSA-N 1 1 345.443 3.824 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000237095854 1027524874 /nfs/dbraw/zinc/52/48/74/1027524874.db2.gz DOKIZWFZECSRKJ-KRWDZBQOSA-N 1 1 341.411 3.680 20 5 EHBDMO CC(C)[N@@H+]1CCC[C@@H](Oc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001225611865 1027633740 /nfs/dbraw/zinc/63/37/40/1027633740.db2.gz XSDBUHHNNCRWAU-LLVKDONJSA-N 1 1 343.221 3.609 20 5 EHBDMO CC(C)[N@H+]1CCC[C@@H](Oc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001225611865 1027633752 /nfs/dbraw/zinc/63/37/52/1027633752.db2.gz XSDBUHHNNCRWAU-LLVKDONJSA-N 1 1 343.221 3.609 20 5 EHBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000078338098 1027687635 /nfs/dbraw/zinc/68/76/35/1027687635.db2.gz PBMBNLHBQZRWOB-MLGOLLRUSA-N 1 1 332.429 3.546 20 5 EHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435389 1027875113 /nfs/dbraw/zinc/87/51/13/1027875113.db2.gz WJKGYXCQRINMJF-GJZGRUSLSA-N 1 1 333.432 3.742 20 5 EHBDMO CC(C)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421009893 1027962905 /nfs/dbraw/zinc/96/29/05/1027962905.db2.gz NYJHDAZPIBATBN-GFCCVEGCSA-N 1 1 347.440 3.727 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421009893 1027962918 /nfs/dbraw/zinc/96/29/18/1027962918.db2.gz NYJHDAZPIBATBN-GFCCVEGCSA-N 1 1 347.440 3.727 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@H]3CCCc4ccccc43)C2)nc1 ZINC000440486077 1028066278 /nfs/dbraw/zinc/06/62/78/1028066278.db2.gz JBFKATVZRJARLJ-YJBOKZPZSA-N 1 1 338.411 3.554 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000444653933 1028116574 /nfs/dbraw/zinc/11/65/74/1028116574.db2.gz VUAYNUXDIAOCQX-OAHLLOKOSA-N 1 1 336.395 3.536 20 5 EHBDMO CCC1(CC)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCS1 ZINC000444685608 1028132257 /nfs/dbraw/zinc/13/22/57/1028132257.db2.gz ARSIXLZSQALORS-UHFFFAOYSA-N 1 1 334.445 3.579 20 5 EHBDMO CCC1(CC)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCS1 ZINC000444685608 1028132266 /nfs/dbraw/zinc/13/22/66/1028132266.db2.gz ARSIXLZSQALORS-UHFFFAOYSA-N 1 1 334.445 3.579 20 5 EHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681886 1028151087 /nfs/dbraw/zinc/15/10/87/1028151087.db2.gz RULKDUNXTZRSIV-RHSMWYFYSA-N 1 1 333.432 3.742 20 5 EHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681888 1028151784 /nfs/dbraw/zinc/15/17/84/1028151784.db2.gz RULKDUNXTZRSIV-YOEHRIQHSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H](N[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144923 1028205809 /nfs/dbraw/zinc/20/58/09/1028205809.db2.gz IITODWJQSXXXPY-POZUXBRTSA-N 1 1 325.412 3.739 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H](CCO)CC3)o2)c1 ZINC000421392488 1028367668 /nfs/dbraw/zinc/36/76/68/1028367668.db2.gz BYTZVBVWPFDEAJ-HNNXBMFYSA-N 1 1 344.411 3.839 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@H](C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895991 1029041566 /nfs/dbraw/zinc/04/15/66/1029041566.db2.gz WQJPLFVKAOLWEM-JKSUJKDBSA-N 1 1 349.475 3.765 20 5 EHBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739816 1029047546 /nfs/dbraw/zinc/04/75/46/1029047546.db2.gz JHNRTGOLNAWXPN-RYUDHWBXSA-N 1 1 336.823 3.606 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC4(CCCC4)C3)o2)cc1 ZINC000615000593 1029214035 /nfs/dbraw/zinc/21/40/35/1029214035.db2.gz GQCYCHOTPHQQAI-UHFFFAOYSA-N 1 1 342.399 3.801 20 5 EHBDMO CC(C)[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000533048794 1029231725 /nfs/dbraw/zinc/23/17/25/1029231725.db2.gz XCQNIGQWSICUBX-UHFFFAOYSA-N 1 1 345.443 3.527 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000446495908 1029662633 /nfs/dbraw/zinc/66/26/33/1029662633.db2.gz QKDUFAPNLJESCE-UHFFFAOYSA-N 1 1 348.447 3.679 20 5 EHBDMO C[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000525781216 1030118037 /nfs/dbraw/zinc/11/80/37/1030118037.db2.gz WYKVZGMWQWFGMT-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1csc([N+](=O)[O-])c1 ZINC000159362802 1030151214 /nfs/dbraw/zinc/15/12/14/1030151214.db2.gz DCDCMJUXLJFPFV-UHFFFAOYSA-N 1 1 333.457 3.657 20 5 EHBDMO CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000159362802 1030151222 /nfs/dbraw/zinc/15/12/22/1030151222.db2.gz DCDCMJUXLJFPFV-UHFFFAOYSA-N 1 1 333.457 3.657 20 5 EHBDMO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000482533361 1030513028 /nfs/dbraw/zinc/51/30/28/1030513028.db2.gz OVFXXUVDEYOHTR-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@@]1(C)COCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000482533361 1030513042 /nfs/dbraw/zinc/51/30/42/1030513042.db2.gz OVFXXUVDEYOHTR-SFHVURJKSA-N 1 1 330.384 3.856 20 5 EHBDMO C[NH+](C)C[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776186 1030704345 /nfs/dbraw/zinc/70/43/45/1030704345.db2.gz TXLRGRAJRBHTFZ-LZCIBIBXSA-N 1 1 343.402 3.640 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+]C1CC(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000550861376 1030749695 /nfs/dbraw/zinc/74/96/95/1030749695.db2.gz YLZFVCXJXVZIRJ-VMBOVVBDSA-N 1 1 342.443 3.832 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000551113174 1031043002 /nfs/dbraw/zinc/04/30/02/1031043002.db2.gz WXCYMLIRMLRESH-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483254982 1031067699 /nfs/dbraw/zinc/06/76/99/1031067699.db2.gz IWTQSZFLWAFKHE-UONOGXRCSA-N 1 1 333.432 3.680 20 5 EHBDMO CC[N@@H+](CCc1cccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343559061 1031397290 /nfs/dbraw/zinc/39/72/90/1031397290.db2.gz BMAWNEFCSFKXJG-CYBMUJFWSA-N 1 1 347.440 3.548 20 5 EHBDMO COc1cc(OC)c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000593602615 1033416582 /nfs/dbraw/zinc/41/65/82/1033416582.db2.gz WSLBAIPGLVWRFS-GFCCVEGCSA-N 1 1 348.374 3.910 20 5 EHBDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000594522099 1033429341 /nfs/dbraw/zinc/42/93/41/1033429341.db2.gz HLUGHZMUWFEJCV-OAHLLOKOSA-N 1 1 348.786 3.870 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCC[N@H+]4CCCC[C@@H]34)c2c1 ZINC000594599889 1033445920 /nfs/dbraw/zinc/44/59/20/1033445920.db2.gz KAYVLJIRRCHUNT-SJORKVTESA-N 1 1 326.400 3.572 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000063551554 1033446323 /nfs/dbraw/zinc/44/63/23/1033446323.db2.gz CGCHEFXYVMOJKL-GOSISDBHSA-N 1 1 345.443 3.886 20 5 EHBDMO Cc1nn(C[N@@H+](C)CCc2ccc(F)cc2)c2cc([N+](=O)[O-])ccc12 ZINC000761288583 1033483298 /nfs/dbraw/zinc/48/32/98/1033483298.db2.gz SWZKNIBNSCMMTQ-UHFFFAOYSA-N 1 1 342.374 3.524 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000026349244 1033536387 /nfs/dbraw/zinc/53/63/87/1033536387.db2.gz KBIBTIQEZYNZDD-UHFFFAOYSA-N 1 1 347.802 3.709 20 5 EHBDMO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595016638 1033609714 /nfs/dbraw/zinc/60/97/14/1033609714.db2.gz HYZRNUARANNFNT-ZDUSSCGKSA-N 1 1 345.399 3.638 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1COc2ccc(C)cc21 ZINC000595022885 1033616122 /nfs/dbraw/zinc/61/61/22/1033616122.db2.gz QDWJLKHZQJMGCF-MLGOLLRUSA-N 1 1 328.368 3.696 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054950 1033633025 /nfs/dbraw/zinc/63/30/25/1033633025.db2.gz XRZZHCUCIULDMU-HIFRSBDPSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054950 1033633032 /nfs/dbraw/zinc/63/30/32/1033633032.db2.gz XRZZHCUCIULDMU-HIFRSBDPSA-N 1 1 335.448 3.517 20 5 EHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@H]1CC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000593660531 1033636861 /nfs/dbraw/zinc/63/68/61/1033636861.db2.gz IRYGYDQSKXQCBN-USXIJHARSA-N 1 1 342.443 3.832 20 5 EHBDMO COc1cccc(OC)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000595071647 1033646551 /nfs/dbraw/zinc/64/65/51/1033646551.db2.gz CFFLDFATDITLPK-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO COCC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(C)o1 ZINC000595034166 1033655867 /nfs/dbraw/zinc/65/58/67/1033655867.db2.gz QCMBLXZADKBEAE-CJNGLKHVSA-N 1 1 348.399 3.933 20 5 EHBDMO C[N@@H+]1CCCC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068693 1033709949 /nfs/dbraw/zinc/70/99/49/1033709949.db2.gz CJHMXCIVKJMZTQ-RDTXWAMCSA-N 1 1 331.460 3.639 20 5 EHBDMO C[N@H+]1CCCC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068693 1033709964 /nfs/dbraw/zinc/70/99/64/1033709964.db2.gz CJHMXCIVKJMZTQ-RDTXWAMCSA-N 1 1 331.460 3.639 20 5 EHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327722 1033728708 /nfs/dbraw/zinc/72/87/08/1033728708.db2.gz RHQZDZMLUCNZRI-CVEARBPZSA-N 1 1 329.400 3.968 20 5 EHBDMO CCC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000595330861 1033729364 /nfs/dbraw/zinc/72/93/64/1033729364.db2.gz MZJZNLQYGHSMGD-OIISXLGYSA-N 1 1 336.407 3.759 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000595343396 1033734455 /nfs/dbraw/zinc/73/44/55/1033734455.db2.gz QBZXIUHVAYEXIB-SFHVURJKSA-N 1 1 344.386 3.606 20 5 EHBDMO Cc1noc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000595359379 1033780756 /nfs/dbraw/zinc/78/07/56/1033780756.db2.gz FEOKENLLZQSNEI-INIZCTEOSA-N 1 1 327.384 3.933 20 5 EHBDMO Cc1noc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)c1[N+](=O)[O-] ZINC000595359379 1033780770 /nfs/dbraw/zinc/78/07/70/1033780770.db2.gz FEOKENLLZQSNEI-INIZCTEOSA-N 1 1 327.384 3.933 20 5 EHBDMO Cc1noc(C[N@H+]2CCC[C@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484684 1033809561 /nfs/dbraw/zinc/80/95/61/1033809561.db2.gz MVSZBDSABIJPGH-SFHVURJKSA-N 1 1 329.400 3.835 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000595449931 1033813555 /nfs/dbraw/zinc/81/35/55/1033813555.db2.gz QYKMEYSAHCEEGQ-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000595449931 1033813569 /nfs/dbraw/zinc/81/35/69/1033813569.db2.gz QYKMEYSAHCEEGQ-IBGZPJMESA-N 1 1 342.370 3.755 20 5 EHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000603629041 1033814293 /nfs/dbraw/zinc/81/42/93/1033814293.db2.gz MYHSCTHOTDWUDG-UHFFFAOYSA-N 1 1 325.412 3.616 20 5 EHBDMO CCC[N@@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000550730489 1033956861 /nfs/dbraw/zinc/95/68/61/1033956861.db2.gz SZNIRWXUIWDTDV-HNNXBMFYSA-N 1 1 341.411 3.834 20 5 EHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787960 1033999007 /nfs/dbraw/zinc/99/90/07/1033999007.db2.gz LAZXWPQISLFDEP-AEFFLSMTSA-N 1 1 348.443 3.775 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689555 1034096064 /nfs/dbraw/zinc/09/60/64/1034096064.db2.gz JOCPQUGCCDNBNV-ABCZVMIZSA-N 1 1 331.416 3.520 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000599689555 1034096080 /nfs/dbraw/zinc/09/60/80/1034096080.db2.gz JOCPQUGCCDNBNV-ABCZVMIZSA-N 1 1 331.416 3.520 20 5 EHBDMO CCOC(=O)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000179320628 1034109205 /nfs/dbraw/zinc/10/92/05/1034109205.db2.gz OLRYAJIPYNIPSW-UHFFFAOYSA-N 1 1 346.383 3.775 20 5 EHBDMO CCOC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000179320628 1034109224 /nfs/dbraw/zinc/10/92/24/1034109224.db2.gz OLRYAJIPYNIPSW-UHFFFAOYSA-N 1 1 346.383 3.775 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141116 1034145914 /nfs/dbraw/zinc/14/59/14/1034145914.db2.gz BKZIGRNOIQSMRG-QZDDGCDVSA-N 1 1 344.333 3.651 20 5 EHBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141116 1034145921 /nfs/dbraw/zinc/14/59/21/1034145921.db2.gz BKZIGRNOIQSMRG-QZDDGCDVSA-N 1 1 344.333 3.651 20 5 EHBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000596308794 1034162140 /nfs/dbraw/zinc/16/21/40/1034162140.db2.gz VGYMOKPSNZQJMT-ZDUSSCGKSA-N 1 1 328.416 3.675 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000580984603 1035468440 /nfs/dbraw/zinc/46/84/40/1035468440.db2.gz OFXFYGGHCMQXGU-STISFXCESA-N 1 1 349.434 3.745 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000609157125 1035535392 /nfs/dbraw/zinc/53/53/92/1035535392.db2.gz VJHYHKDYKIUMSZ-UHFFFAOYSA-N 1 1 336.395 3.563 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cc[nH]n2)Cc2ccccc2)cc1 ZINC000609157125 1035535410 /nfs/dbraw/zinc/53/54/10/1035535410.db2.gz VJHYHKDYKIUMSZ-UHFFFAOYSA-N 1 1 336.395 3.563 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CSCCc2ccccc21 ZINC000122440073 1036361656 /nfs/dbraw/zinc/36/16/56/1036361656.db2.gz SJDMMXCOMDYKBL-KRWDZBQOSA-N 1 1 344.436 3.724 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000026224721 1036394040 /nfs/dbraw/zinc/39/40/40/1036394040.db2.gz VLEDPBRVADMARN-UHFFFAOYSA-N 1 1 345.374 3.503 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000589496692 1036439505 /nfs/dbraw/zinc/43/95/05/1036439505.db2.gz DJWJUABWHFPBSL-MRXNPFEDSA-N 1 1 332.400 3.536 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000589496690 1036440419 /nfs/dbraw/zinc/44/04/19/1036440419.db2.gz DJWJUABWHFPBSL-INIZCTEOSA-N 1 1 332.400 3.536 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000180334792 1036695283 /nfs/dbraw/zinc/69/52/83/1036695283.db2.gz AKKXLMYYLJCSSV-OAHLLOKOSA-N 1 1 347.459 3.514 20 5 EHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736837 1036695262 /nfs/dbraw/zinc/69/52/62/1036695262.db2.gz LTXPSCIYHXSGDB-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135584 1036784411 /nfs/dbraw/zinc/78/44/11/1036784411.db2.gz OASBPCYQDKYZBE-RYUDHWBXSA-N 1 1 343.349 3.961 20 5 EHBDMO CO[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000590173536 1036800983 /nfs/dbraw/zinc/80/09/83/1036800983.db2.gz ZRGHVRUSLXARKY-ZDUSSCGKSA-N 1 1 332.322 3.615 20 5 EHBDMO C[C@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000180469545 1036870577 /nfs/dbraw/zinc/87/05/77/1036870577.db2.gz MWVWBTBHKHNSBR-QRWLVFNGSA-N 1 1 339.439 3.757 20 5 EHBDMO C[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N(C)C1CC1 ZINC000180469545 1036870597 /nfs/dbraw/zinc/87/05/97/1036870597.db2.gz MWVWBTBHKHNSBR-QRWLVFNGSA-N 1 1 339.439 3.757 20 5 EHBDMO Cc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)s1 ZINC000076342873 1036938068 /nfs/dbraw/zinc/93/80/68/1036938068.db2.gz QHEVVXVBLRACIW-UHFFFAOYSA-N 1 1 347.440 3.734 20 5 EHBDMO C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233794 1036959372 /nfs/dbraw/zinc/95/93/72/1036959372.db2.gz UYHZXTBHFAACFG-BPAFIMBUSA-N 1 1 339.439 3.757 20 5 EHBDMO COc1cc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000542185222 1037144632 /nfs/dbraw/zinc/14/46/32/1037144632.db2.gz OCGKOWQRNATKOL-NWANDNLSSA-N 1 1 334.416 3.623 20 5 EHBDMO C[C@@H](O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867702 1037274748 /nfs/dbraw/zinc/27/47/48/1037274748.db2.gz XWODQLCQXLMUMB-TZMCWYRMSA-N 1 1 332.425 3.526 20 5 EHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850260 1037279908 /nfs/dbraw/zinc/27/99/08/1037279908.db2.gz LBHMWFDPMLXVSP-SFHVURJKSA-N 1 1 328.412 3.676 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCC[NH2+]CC2)s1 ZINC000591278507 1037318438 /nfs/dbraw/zinc/31/84/38/1037318438.db2.gz JJOFXAZZKLBCDT-CYBMUJFWSA-N 1 1 331.441 3.555 20 5 EHBDMO Cc1cc(C)cc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271807152 1037354344 /nfs/dbraw/zinc/35/43/44/1037354344.db2.gz XRQQLLYKIZIZLI-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462838719 1037463377 /nfs/dbraw/zinc/46/33/77/1037463377.db2.gz ZHTZOUYKINCVNN-CYBMUJFWSA-N 1 1 343.374 3.873 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccccc2F)CCC1 ZINC000592145022 1037867446 /nfs/dbraw/zinc/86/74/46/1037867446.db2.gz SRJNFUSMWVOJKM-UHFFFAOYSA-N 1 1 330.359 3.912 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@H]3C3CCC3)n2)c1 ZINC000592198798 1037943565 /nfs/dbraw/zinc/94/35/65/1037943565.db2.gz VNIWTCRFQSIQMN-INIZCTEOSA-N 1 1 342.399 3.799 20 5 EHBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000058525408 1038046215 /nfs/dbraw/zinc/04/62/15/1038046215.db2.gz PMDAPTNIVKIBRE-HNNXBMFYSA-N 1 1 332.425 3.872 20 5 EHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538731134 1038497677 /nfs/dbraw/zinc/49/76/77/1038497677.db2.gz DLSYTFNKWOQISM-OAHLLOKOSA-N 1 1 342.443 3.863 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](CCCO)Cc1ccccc1 ZINC000470176562 1038544418 /nfs/dbraw/zinc/54/44/18/1038544418.db2.gz XNLKTPTUVRBDLC-LGMDPLHJSA-N 1 1 340.423 3.883 20 5 EHBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000190227456 1038908886 /nfs/dbraw/zinc/90/88/86/1038908886.db2.gz MMXTWSWIUDZRAO-IBGZPJMESA-N 1 1 344.411 3.839 20 5 EHBDMO COc1cc(C[N@H+]2CCSC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000490061764 1040331927 /nfs/dbraw/zinc/33/19/27/1040331927.db2.gz TYMHUZJDNNTHLP-UHFFFAOYSA-N 1 1 336.457 3.855 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000614222942 1040745541 /nfs/dbraw/zinc/74/55/41/1040745541.db2.gz SZDJFSOKQIQYHF-UHFFFAOYSA-N 1 1 348.443 3.775 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000614222942 1040745591 /nfs/dbraw/zinc/74/55/91/1040745591.db2.gz SZDJFSOKQIQYHF-UHFFFAOYSA-N 1 1 348.443 3.775 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)nc1 ZINC000487183567 1040754801 /nfs/dbraw/zinc/75/48/01/1040754801.db2.gz DNLXUARJZOEAHN-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC001167754018 1040871991 /nfs/dbraw/zinc/87/19/91/1040871991.db2.gz SSFCPPMXTIGVCN-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO COc1cc(C[N@@H+](C)CC(C)(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491110188 1040904727 /nfs/dbraw/zinc/90/47/27/1040904727.db2.gz BXRITLPNFPEYSO-UHFFFAOYSA-N 1 1 346.374 3.725 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccccc1)C1CC1 ZINC000025121071 1041211258 /nfs/dbraw/zinc/21/12/58/1041211258.db2.gz STKIZKXDVBOZSG-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)C1CC1 ZINC000025121071 1041211271 /nfs/dbraw/zinc/21/12/71/1041211271.db2.gz STKIZKXDVBOZSG-UHFFFAOYSA-N 1 1 339.395 3.506 20 5 EHBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000428755044 1041355533 /nfs/dbraw/zinc/35/55/33/1041355533.db2.gz XBTMWCHUDSIEJK-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000428755044 1041355543 /nfs/dbraw/zinc/35/55/43/1041355543.db2.gz XBTMWCHUDSIEJK-UHFFFAOYSA-N 1 1 341.411 3.591 20 5 EHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C2)C1 ZINC000549572815 1042350211 /nfs/dbraw/zinc/35/02/11/1042350211.db2.gz UCSRZJBJFFXOOY-LJQANCHMSA-N 1 1 347.459 3.694 20 5 EHBDMO C[N@H+]1CCC[C@]2(CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000549576370 1042355648 /nfs/dbraw/zinc/35/56/48/1042355648.db2.gz MCQYETKJPYOVQI-HNNXBMFYSA-N 1 1 344.242 3.824 20 5 EHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034609 1042953855 /nfs/dbraw/zinc/95/38/55/1042953855.db2.gz JMIDJNIIKMRSAU-HUUCEWRRSA-N 1 1 335.423 3.825 20 5 EHBDMO COc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1F ZINC000182008655 1042999109 /nfs/dbraw/zinc/99/91/09/1042999109.db2.gz RYVFGWIPAUNPGJ-SNVBAGLBSA-N 1 1 345.330 3.735 20 5 EHBDMO CCC[C@@H](NCCC[N@@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421089 1043157718 /nfs/dbraw/zinc/15/77/18/1043157718.db2.gz FSRYGANXJJIWEW-VQIMIIECSA-N 1 1 349.475 3.527 20 5 EHBDMO CCC[C@@H](NCCC[N@H+]1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421089 1043157726 /nfs/dbraw/zinc/15/77/26/1043157726.db2.gz FSRYGANXJJIWEW-VQIMIIECSA-N 1 1 349.475 3.527 20 5 EHBDMO Cc1ccc(CN2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610159 /nfs/dbraw/zinc/61/01/59/1043610159.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 1 1 345.487 3.990 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3nsnc32)C2CC2)cc1 ZINC000764493727 1127499136 /nfs/dbraw/zinc/49/91/36/1127499136.db2.gz TZKLCYMPQNYXEO-UHFFFAOYSA-N 1 1 340.408 3.764 20 5 EHBDMO Cc1ccnc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415282 1127743073 /nfs/dbraw/zinc/74/30/73/1127743073.db2.gz LUXLRCNWWDHECX-CZUORRHYSA-N 1 1 346.456 3.855 20 5 EHBDMO CCOc1cc(NC[C@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698833 1128729967 /nfs/dbraw/zinc/72/99/67/1128729967.db2.gz UXRHJYUBBJYQNO-QGZVFWFLSA-N 1 1 341.411 3.680 20 5 EHBDMO CN(C(=O)c1cc2ccccc2c2cccnc12)[C@H]1CCC[N@@H+](C)C1 ZINC000172659536 1128774991 /nfs/dbraw/zinc/77/49/91/1128774991.db2.gz YBEUWLSSRCQSOP-INIZCTEOSA-N 1 1 333.435 3.554 20 5 EHBDMO Cc1nc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000301647361 1128814440 /nfs/dbraw/zinc/81/44/40/1128814440.db2.gz IHUVHKJOSYHKSK-YOEHRIQHSA-N 1 1 340.427 3.621 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494700710 1120725311 /nfs/dbraw/zinc/72/53/11/1120725311.db2.gz DBXAERLZHZPGOG-SFHVURJKSA-N 1 1 348.443 3.773 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000494700710 1120725317 /nfs/dbraw/zinc/72/53/17/1120725317.db2.gz DBXAERLZHZPGOG-SFHVURJKSA-N 1 1 348.443 3.773 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)nc1 ZINC000311225880 1128989365 /nfs/dbraw/zinc/98/93/65/1128989365.db2.gz POIWVMGPFMRQMR-KRWDZBQOSA-N 1 1 340.427 3.704 20 5 EHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301729234 1129000760 /nfs/dbraw/zinc/00/07/60/1129000760.db2.gz CHCIVCUCPJIDPD-GFCCVEGCSA-N 1 1 326.828 3.567 20 5 EHBDMO C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722560 1121961781 /nfs/dbraw/zinc/96/17/81/1121961781.db2.gz XSTVDMBNNZSCNK-JYJNAYRXSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccncc2)cs1 ZINC000076895686 1121970638 /nfs/dbraw/zinc/97/06/38/1121970638.db2.gz JTSPTLDVEJRIRX-GFCCVEGCSA-N 1 1 340.408 3.964 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000153801456 1122016164 /nfs/dbraw/zinc/01/61/64/1122016164.db2.gz HKBFEXFYPQVOCO-GFCCVEGCSA-N 1 1 333.388 3.956 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)C1 ZINC000301129846 1122022083 /nfs/dbraw/zinc/02/20/83/1122022083.db2.gz ZSUADSXMPRSQKP-HNNXBMFYSA-N 1 1 340.427 3.834 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000301184217 1122283264 /nfs/dbraw/zinc/28/32/64/1122283264.db2.gz IYYSHDYKRGIEFF-QGZVFWFLSA-N 1 1 325.412 3.571 20 5 EHBDMO CC(=O)N1CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000270851358 1129047959 /nfs/dbraw/zinc/04/79/59/1129047959.db2.gz HXNHQMSJEXEMQK-HNNXBMFYSA-N 1 1 345.443 3.523 20 5 EHBDMO CC(=O)N1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000270851358 1129047964 /nfs/dbraw/zinc/04/79/64/1129047964.db2.gz HXNHQMSJEXEMQK-HNNXBMFYSA-N 1 1 345.443 3.523 20 5 EHBDMO C[C@@H](c1ccccc1F)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000916987444 1122424182 /nfs/dbraw/zinc/42/41/82/1122424182.db2.gz TYZHHGJMSZFZEW-AWEZNQCLSA-N 1 1 329.375 3.617 20 5 EHBDMO CC(=O)c1ccc(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301196421 1122456938 /nfs/dbraw/zinc/45/69/38/1122456938.db2.gz UJRMMZNPQIPSAW-CYBMUJFWSA-N 1 1 333.432 3.720 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000557022407 1123268588 /nfs/dbraw/zinc/26/85/88/1123268588.db2.gz LDFOWTBAUHFVEU-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916579 1123691905 /nfs/dbraw/zinc/69/19/05/1123691905.db2.gz YCTABOITTRVVHU-ZBFHGGJFSA-N 1 1 344.386 3.991 20 5 EHBDMO CC(C)([NH2+]Cc1cnn(CC2CCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000922144408 1129151620 /nfs/dbraw/zinc/15/16/20/1129151620.db2.gz UYADHGSAMOIURL-UHFFFAOYSA-N 1 1 328.416 3.616 20 5 EHBDMO CC(C)(C)[N@H+]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000734835482 1131284179 /nfs/dbraw/zinc/28/41/79/1131284179.db2.gz YJXQZOPLRROKBH-UHFFFAOYSA-N 1 1 325.840 3.554 20 5 EHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920389 1129364874 /nfs/dbraw/zinc/36/48/74/1129364874.db2.gz DUNUAIVXJGJKQZ-RYUDHWBXSA-N 1 1 343.374 3.729 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000301944321 1129401579 /nfs/dbraw/zinc/40/15/79/1129401579.db2.gz ZFODGRVNGSNDGC-UHFFFAOYSA-N 1 1 335.404 3.508 20 5 EHBDMO O=[N+]([O-])c1ccsc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000301944321 1129401581 /nfs/dbraw/zinc/40/15/81/1129401581.db2.gz ZFODGRVNGSNDGC-UHFFFAOYSA-N 1 1 335.404 3.508 20 5 EHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC1CCCC1 ZINC000069227692 1129433723 /nfs/dbraw/zinc/43/37/23/1129433723.db2.gz FDZYFZNTDBLJDT-LBPRGKRZSA-N 1 1 330.388 3.828 20 5 EHBDMO O=[N+]([O-])c1ccsc1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000301974779 1129465104 /nfs/dbraw/zinc/46/51/04/1129465104.db2.gz BBSLKGWBCGOOFQ-HNNXBMFYSA-N 1 1 331.441 3.633 20 5 EHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000301994993 1129506032 /nfs/dbraw/zinc/50/60/32/1129506032.db2.gz HERAOQYGKIYAOJ-OAHLLOKOSA-N 1 1 342.443 3.620 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC1CC[NH+](C(C)(C)C)CC1 ZINC000468622475 1129644402 /nfs/dbraw/zinc/64/44/02/1129644402.db2.gz RNRBONOQDBGUBA-NTCAYCPXSA-N 1 1 331.460 3.851 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000156017039 1129688455 /nfs/dbraw/zinc/68/84/55/1129688455.db2.gz MVMGVWLHCOVKHT-LJQANCHMSA-N 1 1 344.386 3.507 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000156017039 1129688457 /nfs/dbraw/zinc/68/84/57/1129688457.db2.gz MVMGVWLHCOVKHT-LJQANCHMSA-N 1 1 344.386 3.507 20 5 EHBDMO CCN(CC)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000393178412 1129738156 /nfs/dbraw/zinc/73/81/56/1129738156.db2.gz SECTUPWONDWFOS-IBGZPJMESA-N 1 1 345.418 3.907 20 5 EHBDMO CCC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1 ZINC000021918647 1129739695 /nfs/dbraw/zinc/73/96/95/1129739695.db2.gz ZABGGMOWQWSRLP-UHFFFAOYSA-N 1 1 341.411 3.754 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034610 1129764791 /nfs/dbraw/zinc/76/47/91/1129764791.db2.gz JMIDJNIIKMRSAU-LSDHHAIUSA-N 1 1 335.423 3.825 20 5 EHBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475461 1129847986 /nfs/dbraw/zinc/84/79/86/1129847986.db2.gz RQXQHRXJYXVBLE-ZNMIVQPWSA-N 1 1 342.443 3.921 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303655729 1129861565 /nfs/dbraw/zinc/86/15/65/1129861565.db2.gz UZPSIHLCSQCQIK-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000304785581 1129902162 /nfs/dbraw/zinc/90/21/62/1129902162.db2.gz OKOPZWXTGXKPDX-HOCLYGCPSA-N 1 1 332.425 3.744 20 5 EHBDMO CCCC(=O)NC[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538850 1130232935 /nfs/dbraw/zinc/23/29/35/1130232935.db2.gz ZFPVKUUNPBDOFW-CVEARBPZSA-N 1 1 347.459 3.593 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000042332503 1130384025 /nfs/dbraw/zinc/38/40/25/1130384025.db2.gz OHEDTZZSISOYDO-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000042332503 1130384029 /nfs/dbraw/zinc/38/40/29/1130384029.db2.gz OHEDTZZSISOYDO-CYBMUJFWSA-N 1 1 345.374 3.501 20 5 EHBDMO CCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000740881780 1131553001 /nfs/dbraw/zinc/55/30/01/1131553001.db2.gz CWSQXBYFLXWXKI-UAGQMJEPSA-N 1 1 336.407 3.759 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154509 1131694134 /nfs/dbraw/zinc/69/41/34/1131694134.db2.gz KMEYHTLHRXOUIZ-HUUCEWRRSA-N 1 1 328.416 3.926 20 5 EHBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000742159582 1131694899 /nfs/dbraw/zinc/69/48/99/1131694899.db2.gz QEUWZUUJQZZDQT-OAHLLOKOSA-N 1 1 348.406 3.863 20 5 EHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000742159582 1131694902 /nfs/dbraw/zinc/69/49/02/1131694902.db2.gz QEUWZUUJQZZDQT-OAHLLOKOSA-N 1 1 348.406 3.863 20 5 EHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172905388 1131886685 /nfs/dbraw/zinc/88/66/85/1131886685.db2.gz RRBGIVNERGXJDI-GOSISDBHSA-N 1 1 340.423 3.983 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCc3cc(O)ccc3C1)CC2 ZINC001172906200 1131888329 /nfs/dbraw/zinc/88/83/29/1131888329.db2.gz WOFJQQVFJAJCLT-SFHVURJKSA-N 1 1 338.407 3.606 20 5 EHBDMO Cc1cnc2c(c1)C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172913217 1131919317 /nfs/dbraw/zinc/91/93/17/1131919317.db2.gz QHTJSGKIEDICEF-GOSISDBHSA-N 1 1 337.423 3.604 20 5 EHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC001173225014 1132005966 /nfs/dbraw/zinc/00/59/66/1132005966.db2.gz ARUOZBIDDPDJDI-WBVHZDCISA-N 1 1 325.412 3.800 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000744399623 1132088947 /nfs/dbraw/zinc/08/89/47/1132088947.db2.gz ULBVBPCFIUOOPX-AWEZNQCLSA-N 1 1 349.431 3.599 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000744399623 1132088951 /nfs/dbraw/zinc/08/89/51/1132088951.db2.gz ULBVBPCFIUOOPX-AWEZNQCLSA-N 1 1 349.431 3.599 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052022 1132642786 /nfs/dbraw/zinc/64/27/86/1132642786.db2.gz FOHUXDDFXMMXCI-TZMCWYRMSA-N 1 1 329.425 3.571 20 5 EHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052022 1132642791 /nfs/dbraw/zinc/64/27/91/1132642791.db2.gz FOHUXDDFXMMXCI-TZMCWYRMSA-N 1 1 329.425 3.571 20 5 EHBDMO Cc1cc([N@@H+]2c3ccccc3C=C3C(=O)C(N)=CC=C32)cc(C)c1N ZINC001175941060 1132791616 /nfs/dbraw/zinc/79/16/16/1132791616.db2.gz XZHLSQQYZKHUSZ-UHFFFAOYSA-N 1 1 329.403 3.877 20 5 EHBDMO Cc1cc([N@H+]2c3ccccc3C=C3C(=O)C(N)=CC=C32)cc(C)c1N ZINC001175941060 1132791619 /nfs/dbraw/zinc/79/16/19/1132791619.db2.gz XZHLSQQYZKHUSZ-UHFFFAOYSA-N 1 1 329.403 3.877 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC001169667942 1132814681 /nfs/dbraw/zinc/81/46/81/1132814681.db2.gz YFFZMRHXIDAXRE-UXHICEINSA-N 1 1 340.423 3.989 20 5 EHBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765171 1133050181 /nfs/dbraw/zinc/05/01/81/1133050181.db2.gz KHOHLPBIUORPEB-HOCLYGCPSA-N 1 1 343.431 3.711 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000768093613 1133091436 /nfs/dbraw/zinc/09/14/36/1133091436.db2.gz PABCGYAWAFGTPT-CABCVRRESA-N 1 1 335.448 3.519 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3nsnc32)C2CC2)c1 ZINC000768543709 1133158398 /nfs/dbraw/zinc/15/83/98/1133158398.db2.gz DUBHKDJQYHQCII-UHFFFAOYSA-N 1 1 340.408 3.764 20 5 EHBDMO CC[N@@H+](CCCNCc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC001179090447 1133227116 /nfs/dbraw/zinc/22/71/16/1133227116.db2.gz CZMZQTYERJGXLS-UHFFFAOYSA-N 1 1 349.475 3.738 20 5 EHBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126796 1133810841 /nfs/dbraw/zinc/81/08/41/1133810841.db2.gz UHWRNXWMLPYYCO-XFQXTVEOSA-N 1 1 340.423 3.815 20 5 EHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])cc2C)CC1 ZINC000774733210 1133913146 /nfs/dbraw/zinc/91/31/46/1133913146.db2.gz LPHMBNAMDUBOOD-UHFFFAOYSA-N 1 1 327.384 3.654 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000774832437 1134039602 /nfs/dbraw/zinc/03/96/02/1134039602.db2.gz PNYJIGGAOAVUOX-SNVBAGLBSA-N 1 1 334.759 3.828 20 5 EHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908571 1134116192 /nfs/dbraw/zinc/11/61/92/1134116192.db2.gz MEMMKLBYYVSNCK-INIZCTEOSA-N 1 1 343.383 3.956 20 5 EHBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476062 1134129739 /nfs/dbraw/zinc/12/97/39/1134129739.db2.gz MULKWSVVIPFKMT-MRXNPFEDSA-N 1 1 344.386 3.950 20 5 EHBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788614599 1134151946 /nfs/dbraw/zinc/15/19/46/1134151946.db2.gz SWHALRKVKXFSRF-GHMZBOCLSA-N 1 1 333.363 3.737 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455106 1134276965 /nfs/dbraw/zinc/27/69/65/1134276965.db2.gz IGJUKDHAXRUGEA-INIZCTEOSA-N 1 1 348.830 3.938 20 5 EHBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513474 1134289433 /nfs/dbraw/zinc/28/94/33/1134289433.db2.gz JZJGWRUGQURPFT-MRXNPFEDSA-N 1 1 326.824 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC=C(c4ccccc4)C3)c2c1 ZINC000789546077 1134294599 /nfs/dbraw/zinc/29/45/99/1134294599.db2.gz NZNLZNOSMVAGIJ-UHFFFAOYSA-N 1 1 334.379 3.691 20 5 EHBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC=C(c4ccccc4)C3)c2c1 ZINC000789546077 1134294602 /nfs/dbraw/zinc/29/46/02/1134294602.db2.gz NZNLZNOSMVAGIJ-UHFFFAOYSA-N 1 1 334.379 3.691 20 5 EHBDMO Cn1c2cc(F)ccc2[nH+]c1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000775161116 1134465459 /nfs/dbraw/zinc/46/54/59/1134465459.db2.gz YKDPEGKSHYQKFG-UHFFFAOYSA-N 1 1 334.738 3.886 20 5 EHBDMO CC(C)N(C)c1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cn1 ZINC000790976475 1134494862 /nfs/dbraw/zinc/49/48/62/1134494862.db2.gz DUEILUQSLZNBLC-UHFFFAOYSA-N 1 1 348.834 3.778 20 5 EHBDMO CCC1CCC([N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC001190399998 1134691766 /nfs/dbraw/zinc/69/17/66/1134691766.db2.gz TVNOEYTZTMXLMI-UHFFFAOYSA-N 1 1 345.443 3.967 20 5 EHBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](CC)c1ccccc1 ZINC001190581955 1134722795 /nfs/dbraw/zinc/72/27/95/1134722795.db2.gz KYXLKZUADUPMJV-QGZVFWFLSA-N 1 1 330.432 3.963 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341444 1134758393 /nfs/dbraw/zinc/75/83/93/1134758393.db2.gz IXJKRIIOJRTVGU-CQSZACIVSA-N 1 1 344.411 3.675 20 5 EHBDMO C[C@H]1CCC[C@H](C)[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069302 1134786252 /nfs/dbraw/zinc/78/62/52/1134786252.db2.gz GLVOZPMMMNVWSN-RYUDHWBXSA-N 1 1 339.823 3.697 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC001191075710 1134788808 /nfs/dbraw/zinc/78/88/08/1134788808.db2.gz CLXJFNCSLIKQJW-DVOMOZLQSA-N 1 1 332.400 3.534 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001191214068 1134818461 /nfs/dbraw/zinc/81/84/61/1134818461.db2.gz MAZLJVQMBFBLOU-ROUUACIJSA-N 1 1 342.443 3.676 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cccnc3F)o2)cc1 ZINC000793283433 1134894941 /nfs/dbraw/zinc/89/49/41/1134894941.db2.gz GDYBYUNJJIDJGL-UHFFFAOYSA-N 1 1 327.315 3.679 20 5 EHBDMO CC(C)C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001192200420 1134979233 /nfs/dbraw/zinc/97/92/33/1134979233.db2.gz RKNIRCUMWPCLJL-OAHLLOKOSA-N 1 1 333.432 3.682 20 5 EHBDMO CC[C@H]1Cc2ccccc2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001193119684 1135104186 /nfs/dbraw/zinc/10/41/86/1135104186.db2.gz YZXXWWCYLAWKQK-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO C[C@@]1(CNc2ccc(N)cc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000804624235 1135145074 /nfs/dbraw/zinc/14/50/74/1135145074.db2.gz KKFYTIQWDCEFMQ-IBGZPJMESA-N 1 1 340.427 3.644 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC2(CCC2)C1 ZINC001193954127 1135204921 /nfs/dbraw/zinc/20/49/21/1135204921.db2.gz IBAQIGRJTXIDRW-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC2(CCC2)C1 ZINC001193954127 1135204924 /nfs/dbraw/zinc/20/49/24/1135204924.db2.gz IBAQIGRJTXIDRW-UHFFFAOYSA-N 1 1 325.206 3.733 20 5 EHBDMO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287115 1135407187 /nfs/dbraw/zinc/40/71/87/1135407187.db2.gz APXAMQVWRIXMFT-ZBFHGGJFSA-N 1 1 348.443 3.580 20 5 EHBDMO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424184 1135428032 /nfs/dbraw/zinc/42/80/32/1135428032.db2.gz HXMKKWKEOXIZGJ-JQHSSLGASA-N 1 1 332.444 3.776 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC001196254033 1135536429 /nfs/dbraw/zinc/53/64/29/1135536429.db2.gz JBBYXFMZQSIDIE-INIZCTEOSA-N 1 1 345.443 3.744 20 5 EHBDMO CC[N@@H+]1CC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423214 1135551067 /nfs/dbraw/zinc/55/10/67/1135551067.db2.gz ROTMMRPKVDVILH-AWEZNQCLSA-N 1 1 345.468 3.755 20 5 EHBDMO CC[N@H+]1CC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423214 1135551074 /nfs/dbraw/zinc/55/10/74/1135551074.db2.gz ROTMMRPKVDVILH-AWEZNQCLSA-N 1 1 345.468 3.755 20 5 EHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000807916040 1135588689 /nfs/dbraw/zinc/58/86/89/1135588689.db2.gz KXMVLDLMOUKFQK-KRWDZBQOSA-N 1 1 343.383 3.639 20 5 EHBDMO CC[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC001197114126 1135651527 /nfs/dbraw/zinc/65/15/27/1135651527.db2.gz FBRUKQFIZXNOIQ-GOSISDBHSA-N 1 1 328.412 3.676 20 5 EHBDMO CC[C@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809985755 1135909084 /nfs/dbraw/zinc/90/90/84/1135909084.db2.gz RAHWCURMDMQDHK-CQSZACIVSA-N 1 1 333.215 3.639 20 5 EHBDMO CC[C@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809985755 1135909086 /nfs/dbraw/zinc/90/90/86/1135909086.db2.gz RAHWCURMDMQDHK-CQSZACIVSA-N 1 1 333.215 3.639 20 5 EHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000810224685 1135940323 /nfs/dbraw/zinc/94/03/23/1135940323.db2.gz ZSTWPYXLLBQEAY-JTQLQIEISA-N 1 1 336.189 3.603 20 5 EHBDMO C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254063 1136103950 /nfs/dbraw/zinc/10/39/50/1136103950.db2.gz QYEVCQLEMUGIGX-MSOLQXFVSA-N 1 1 345.830 3.783 20 5 EHBDMO C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254063 1136103953 /nfs/dbraw/zinc/10/39/53/1136103953.db2.gz QYEVCQLEMUGIGX-MSOLQXFVSA-N 1 1 345.830 3.783 20 5 EHBDMO C[C@@H](C1CC1)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271954 1136124486 /nfs/dbraw/zinc/12/44/86/1136124486.db2.gz PIGGULWUPYBOBQ-MGPUTAFESA-N 1 1 340.423 3.929 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583160 1136441663 /nfs/dbraw/zinc/44/16/63/1136441663.db2.gz YPNOSGWVYQUSKZ-MSOLQXFVSA-N 1 1 348.349 3.744 20 5 EHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583857 1136442445 /nfs/dbraw/zinc/44/24/45/1136442445.db2.gz GMKLKTWJRPXIIA-VQTJNVASSA-N 1 1 340.423 3.644 20 5 EHBDMO CC[C@H](C)[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579238 1136444007 /nfs/dbraw/zinc/44/40/07/1136444007.db2.gz KAYKLDLKDFZHPI-HNAYVOBHSA-N 1 1 328.412 3.929 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](Cc2ccccc2F)CC2CC2)cc1 ZINC000852564661 1136467020 /nfs/dbraw/zinc/46/70/20/1136467020.db2.gz QKYAILTVSXPKSQ-LJQANCHMSA-N 1 1 344.386 3.680 20 5 EHBDMO CC[N@@H+](c1ccc(Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)cc1)C(C)C ZINC000853084887 1136507144 /nfs/dbraw/zinc/50/71/44/1136507144.db2.gz BCIBDRDMXOQBSP-UHFFFAOYSA-N 1 1 342.399 3.672 20 5 EHBDMO CC[N@H+](c1ccc(Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)cc1)C(C)C ZINC000853084887 1136507148 /nfs/dbraw/zinc/50/71/48/1136507148.db2.gz BCIBDRDMXOQBSP-UHFFFAOYSA-N 1 1 342.399 3.672 20 5 EHBDMO C[C@H](OC(=O)[C@@H]1CCCC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445442 1136596495 /nfs/dbraw/zinc/59/64/95/1136596495.db2.gz YSCJKCLJXBIIKR-KSSFIOAISA-N 1 1 346.427 3.996 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nc1 ZINC000858012072 1136929839 /nfs/dbraw/zinc/92/98/39/1136929839.db2.gz CBRFEJAJKOTBMF-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)nc1 ZINC000858012072 1136929841 /nfs/dbraw/zinc/92/98/41/1136929841.db2.gz CBRFEJAJKOTBMF-OAHLLOKOSA-N 1 1 347.802 3.605 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@](C)(O)c1ccccc1 ZINC000822516309 1137064229 /nfs/dbraw/zinc/06/42/29/1137064229.db2.gz KGRXZPJUEDXXFO-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1Cl ZINC000824696253 1137148948 /nfs/dbraw/zinc/14/89/48/1137148948.db2.gz JHCMHNHIVMOSIB-FRFSOERESA-N 1 1 338.835 3.764 20 5 EHBDMO Cc1nn(C[NH+]2CCC(C)(c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] ZINC000794704924 1137240480 /nfs/dbraw/zinc/24/04/80/1137240480.db2.gz NXLGCKBCRBUTQF-UHFFFAOYSA-N 1 1 348.834 3.764 20 5 EHBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(OC)c1OC ZINC000865757922 1137309090 /nfs/dbraw/zinc/30/90/90/1137309090.db2.gz RSOIJAOVLCTUPN-INIZCTEOSA-N 1 1 348.374 3.992 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCc2c[nH]nc21 ZINC000872047682 1137567610 /nfs/dbraw/zinc/56/76/10/1137567610.db2.gz COJRLOYNOCUDQC-HZMBPMFUSA-N 1 1 332.429 3.768 20 5 EHBDMO CCn1c2ccccc2nc1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873044227 1137588753 /nfs/dbraw/zinc/58/87/53/1137588753.db2.gz HLKIUMBBMRVITD-UHFFFAOYSA-N 1 1 338.411 3.871 20 5 EHBDMO C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000877934088 1137696195 /nfs/dbraw/zinc/69/61/95/1137696195.db2.gz AZMPNMFXNQVFGS-JTQLQIEISA-N 1 1 336.779 3.530 20 5 EHBDMO CC(C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCC1 ZINC000878232861 1137708158 /nfs/dbraw/zinc/70/81/58/1137708158.db2.gz CLFGVPRRBFBBMW-UHFFFAOYSA-N 1 1 330.388 3.798 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](C3CCC3)C2)o1 ZINC000878994658 1137734507 /nfs/dbraw/zinc/73/45/07/1137734507.db2.gz XBLPMTXCKMZSDF-AWEZNQCLSA-N 1 1 342.399 3.657 20 5 EHBDMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000881822059 1137816064 /nfs/dbraw/zinc/81/60/64/1137816064.db2.gz XFOJMSOFLSASFF-IJEWVQPXSA-N 1 1 345.443 3.639 20 5 EHBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824704 1137922011 /nfs/dbraw/zinc/92/20/11/1137922011.db2.gz QAKPTFDMNZWLRR-DYVFJYSZSA-N 1 1 328.416 3.843 20 5 EHBDMO COCC[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332367252 1137941722 /nfs/dbraw/zinc/94/17/22/1137941722.db2.gz WCKCRHAAJZOUCW-ZDUSSCGKSA-N 1 1 326.824 3.887 20 5 EHBDMO COC[C@H](C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886302812 1138066066 /nfs/dbraw/zinc/06/60/66/1138066066.db2.gz WYEPYRYQHWDJIV-KBXCAEBGSA-N 1 1 341.411 3.514 20 5 EHBDMO COC[C@H](C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000886302812 1138066069 /nfs/dbraw/zinc/06/60/69/1138066069.db2.gz WYEPYRYQHWDJIV-KBXCAEBGSA-N 1 1 341.411 3.514 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000336965386 1138436600 /nfs/dbraw/zinc/43/66/00/1138436600.db2.gz JADPNDIUFXVTTR-KRWDZBQOSA-N 1 1 339.395 3.543 20 5 EHBDMO O=C(CC[N@H+]1CCC[C@@]2(CC=CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337211485 1138496174 /nfs/dbraw/zinc/49/61/74/1138496174.db2.gz DORXUPKSUBJCQI-IBGZPJMESA-N 1 1 343.427 3.746 20 5 EHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC(C)(C)CC1 ZINC000337254058 1138509818 /nfs/dbraw/zinc/50/98/18/1138509818.db2.gz QHNXUZVEVUAKTK-UHFFFAOYSA-N 1 1 333.432 3.824 20 5 EHBDMO Cc1noc([C@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685685 1139986215 /nfs/dbraw/zinc/98/62/15/1139986215.db2.gz RLFWDKNBSQVDCM-JSGCOSHPSA-N 1 1 330.388 3.535 20 5 EHBDMO C[C@@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186653 1140019344 /nfs/dbraw/zinc/01/93/44/1140019344.db2.gz BPFDIQXJBPXMOY-HLLBOEOZSA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H](c1cccc(NCc2ccccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000266989818 1140747396 /nfs/dbraw/zinc/74/73/96/1140747396.db2.gz TULFMXUEABDJEZ-HNNXBMFYSA-N 1 1 341.411 3.600 20 5 EHBDMO CC(C)(C)c1nnc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000268193184 1140900248 /nfs/dbraw/zinc/90/02/48/1140900248.db2.gz LGDHBWJFHUFTGK-SOFGYWHQSA-N 1 1 332.429 3.547 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309596 1140918868 /nfs/dbraw/zinc/91/88/68/1140918868.db2.gz XAKOPLIAXABHPX-RDJZCZTQSA-N 1 1 330.384 3.584 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCc4c[nH]nc43)o2)cc1 ZINC000268883846 1141017321 /nfs/dbraw/zinc/01/73/21/1141017321.db2.gz YMBNAKKVYCNFFY-INIZCTEOSA-N 1 1 338.367 3.745 20 5 EHBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000269633872 1141129766 /nfs/dbraw/zinc/12/97/66/1141129766.db2.gz GNBCBKDESGSINQ-IRXDYDNUSA-N 1 1 330.384 3.839 20 5 EHBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115120 1141501961 /nfs/dbraw/zinc/50/19/61/1141501961.db2.gz YVOZLVAZHHZQKL-ZETOZRRWSA-N 1 1 346.349 3.595 20 5 EHBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339115120 1141501967 /nfs/dbraw/zinc/50/19/67/1141501967.db2.gz YVOZLVAZHHZQKL-ZETOZRRWSA-N 1 1 346.349 3.595 20 5 EHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000283052307 1141544448 /nfs/dbraw/zinc/54/44/48/1141544448.db2.gz JAWJFCBLWYAXGX-CQSZACIVSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C1CC1)C1CCCCC1 ZINC000048008822 1014314727 /nfs/dbraw/zinc/31/47/27/1014314727.db2.gz RZEREEBLASYJOC-UHFFFAOYSA-N 1 1 331.416 3.639 20 5 EHBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430206430 1014915564 /nfs/dbraw/zinc/91/55/64/1014915564.db2.gz OKKKWVYIYGLUBI-UHFFFAOYSA-N 1 1 330.384 3.637 20 5 EHBDMO Cc1ccccc1OCCC[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001167086105 1015533820 /nfs/dbraw/zinc/53/38/20/1015533820.db2.gz WNLPKCUEMCZSDQ-UHFFFAOYSA-N 1 1 344.411 3.683 20 5 EHBDMO NC1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840523 1017232352 /nfs/dbraw/zinc/23/23/52/1017232352.db2.gz KLPJAGSMMDDKII-DOTOQJQBSA-N 1 1 331.460 3.557 20 5 EHBDMO COCc1cnc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449503987 1032687246 /nfs/dbraw/zinc/68/72/46/1032687246.db2.gz VIEHCKSZGVMYFI-CQSZACIVSA-N 1 1 347.440 3.577 20 5 EHBDMO COCc1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449503987 1032687254 /nfs/dbraw/zinc/68/72/54/1032687254.db2.gz VIEHCKSZGVMYFI-CQSZACIVSA-N 1 1 347.440 3.577 20 5 EHBDMO [NH3+][C@H]1CCC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930672 1017326436 /nfs/dbraw/zinc/32/64/36/1017326436.db2.gz TXVKHLAYCHGIDX-RYUDHWBXSA-N 1 1 349.818 3.868 20 5 EHBDMO C[C@@H]1CCN(c2ccsc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610284382 1017657057 /nfs/dbraw/zinc/65/70/57/1017657057.db2.gz QGTQGPAUBOPQOQ-CQSZACIVSA-N 1 1 331.441 3.757 20 5 EHBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171263 1017807937 /nfs/dbraw/zinc/80/79/37/1017807937.db2.gz SXHCYJDMZDYKIA-NSHDSACASA-N 1 1 327.340 3.635 20 5 EHBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171263 1017807947 /nfs/dbraw/zinc/80/79/47/1017807947.db2.gz SXHCYJDMZDYKIA-NSHDSACASA-N 1 1 327.340 3.635 20 5 EHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000593069976 1032767633 /nfs/dbraw/zinc/76/76/33/1032767633.db2.gz MIUIELICYXDGTQ-CYBMUJFWSA-N 1 1 332.322 3.615 20 5 EHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000610367961 1018535255 /nfs/dbraw/zinc/53/52/55/1018535255.db2.gz SAAWRGAYDFTKDR-YESZJQIVSA-N 1 1 337.423 3.724 20 5 EHBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])c2cccnc12)Cc1ccccc1 ZINC000064916265 1018714987 /nfs/dbraw/zinc/71/49/87/1018714987.db2.gz XUNSFIFCRXFBAK-UHFFFAOYSA-N 1 1 336.395 3.687 20 5 EHBDMO C[C@@]1(CNCc2ccccc2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1 ZINC000397867097 1018912335 /nfs/dbraw/zinc/91/23/35/1018912335.db2.gz GOSPQKBDQRLDBQ-FQEVSTJZSA-N 1 1 339.439 3.739 20 5 EHBDMO C[C@@]1(CNCc2ccccc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000397867097 1018912344 /nfs/dbraw/zinc/91/23/44/1018912344.db2.gz GOSPQKBDQRLDBQ-FQEVSTJZSA-N 1 1 339.439 3.739 20 5 EHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000433606508 1019435999 /nfs/dbraw/zinc/43/59/99/1019435999.db2.gz GPBLWTPQKXPZGS-QGZVFWFLSA-N 1 1 339.439 3.864 20 5 EHBDMO COc1ccc(OCC[N@@H+]([C@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119133536 1019451409 /nfs/dbraw/zinc/45/14/09/1019451409.db2.gz QPZHTXTVZZUHAD-CYBMUJFWSA-N 1 1 346.383 3.801 20 5 EHBDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449616046 1032887767 /nfs/dbraw/zinc/88/77/67/1032887767.db2.gz BMSTXRAFPXJPKU-INIZCTEOSA-N 1 1 344.411 3.838 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513696560 1020428469 /nfs/dbraw/zinc/42/84/69/1020428469.db2.gz ALMFUQFPGILGSV-SFHVURJKSA-N 1 1 342.443 3.978 20 5 EHBDMO CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449617288 1032901452 /nfs/dbraw/zinc/90/14/52/1032901452.db2.gz GRMHERDVTPMAIE-MRXNPFEDSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169791 1020498609 /nfs/dbraw/zinc/49/86/09/1020498609.db2.gz MGICBUAQHOGBFX-CXAGYDPISA-N 1 1 328.416 3.515 20 5 EHBDMO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488554 1032916156 /nfs/dbraw/zinc/91/61/56/1032916156.db2.gz ZHKFHFQPDXPOKO-NEPJUHHUSA-N 1 1 336.823 3.606 20 5 EHBDMO O=C(CC[N@H+]1CCCC12CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000500983468 1020632696 /nfs/dbraw/zinc/63/26/96/1020632696.db2.gz KIICPFSCNZEBPV-UHFFFAOYSA-N 1 1 331.416 3.722 20 5 EHBDMO COc1ccc(OCC[N@@H+]2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505522 1020869096 /nfs/dbraw/zinc/86/90/96/1020869096.db2.gz NFNWCBHPQYIUEN-INIZCTEOSA-N 1 1 346.358 3.568 20 5 EHBDMO COc1ccc(OCC[N@H+]2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505522 1020869099 /nfs/dbraw/zinc/86/90/99/1020869099.db2.gz NFNWCBHPQYIUEN-INIZCTEOSA-N 1 1 346.358 3.568 20 5 EHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(Cl)c1 ZINC000051120913 1021178153 /nfs/dbraw/zinc/17/81/53/1021178153.db2.gz JHEOSQZNOGFXOD-SNVBAGLBSA-N 1 1 330.775 3.975 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCC1CCCCC1 ZINC000507601305 1021390369 /nfs/dbraw/zinc/39/03/69/1021390369.db2.gz REKQHKGXVMXLRD-UHFFFAOYSA-N 1 1 333.432 3.744 20 5 EHBDMO Cc1c(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000518834897 1021604155 /nfs/dbraw/zinc/60/41/55/1021604155.db2.gz JNMRZYGEXSSSOZ-IFXJQAMLSA-N 1 1 326.396 3.865 20 5 EHBDMO Cc1c(C[N@@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000518834897 1021604161 /nfs/dbraw/zinc/60/41/61/1021604161.db2.gz JNMRZYGEXSSSOZ-IFXJQAMLSA-N 1 1 326.396 3.865 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)cs1 ZINC000054173459 1021711400 /nfs/dbraw/zinc/71/14/00/1021711400.db2.gz KJZJSKNSQUCYIV-QGZVFWFLSA-N 1 1 332.425 3.602 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000506705389 1021784085 /nfs/dbraw/zinc/78/40/85/1021784085.db2.gz GHVBPMFZJAIISQ-ZDUSSCGKSA-N 1 1 330.384 3.805 20 5 EHBDMO COc1c(O)ccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000891535138 1021862719 /nfs/dbraw/zinc/86/27/19/1021862719.db2.gz AEMMLPYAGLKZNR-NSHDSACASA-N 1 1 334.347 3.641 20 5 EHBDMO COc1c(O)ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000891535138 1021862730 /nfs/dbraw/zinc/86/27/30/1021862730.db2.gz AEMMLPYAGLKZNR-NSHDSACASA-N 1 1 334.347 3.641 20 5 EHBDMO COc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000506771381 1021985054 /nfs/dbraw/zinc/98/50/54/1021985054.db2.gz DSJQZFIHRQDWHS-SOFGYWHQSA-N 1 1 342.395 3.757 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2C2CC2)c(Cl)c1 ZINC000293784728 1022164022 /nfs/dbraw/zinc/16/40/22/1022164022.db2.gz ZLHWIUBNWCXSCD-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)c(Cl)c1 ZINC000293784728 1022164029 /nfs/dbraw/zinc/16/40/29/1022164029.db2.gz ZLHWIUBNWCXSCD-INIZCTEOSA-N 1 1 336.819 3.639 20 5 EHBDMO COc1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184233640 1022605532 /nfs/dbraw/zinc/60/55/32/1022605532.db2.gz JOCTYIWNKJCBKK-XJKSGUPXSA-N 1 1 340.420 3.603 20 5 EHBDMO COc1cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F ZINC000184233640 1022605537 /nfs/dbraw/zinc/60/55/37/1022605537.db2.gz JOCTYIWNKJCBKK-XJKSGUPXSA-N 1 1 340.420 3.603 20 5 EHBDMO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266489134 1022661879 /nfs/dbraw/zinc/66/18/79/1022661879.db2.gz RUIDUSKUUNXZBS-STQMWFEESA-N 1 1 327.384 3.965 20 5 EHBDMO COc1cccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932543 1033086908 /nfs/dbraw/zinc/08/69/08/1033086908.db2.gz FDHXMDMTPRCGKJ-LJQANCHMSA-N 1 1 342.395 3.819 20 5 EHBDMO Cc1c(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686557 1022886254 /nfs/dbraw/zinc/88/62/54/1022886254.db2.gz QCWRQZGESOCVRQ-HXUWFJFHSA-N 1 1 340.423 3.775 20 5 EHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072803160 1022963968 /nfs/dbraw/zinc/96/39/68/1022963968.db2.gz AZVOCWVVGYFKJF-KRWDZBQOSA-N 1 1 330.388 3.657 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248392858 1023011827 /nfs/dbraw/zinc/01/18/27/1023011827.db2.gz DKNFGLYDYGIMST-UXLLHSPISA-N 1 1 331.460 3.898 20 5 EHBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248392858 1023011838 /nfs/dbraw/zinc/01/18/38/1023011838.db2.gz DKNFGLYDYGIMST-UXLLHSPISA-N 1 1 331.460 3.898 20 5 EHBDMO C[N@@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506381861 1023044353 /nfs/dbraw/zinc/04/43/53/1023044353.db2.gz PFQCEXBDFFSOQN-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO CN1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427959 1023128369 /nfs/dbraw/zinc/12/83/69/1023128369.db2.gz NITYVFKZEREGIY-CQSZACIVSA-N 1 1 345.468 3.755 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)CCO2 ZINC000507123284 1023141243 /nfs/dbraw/zinc/14/12/43/1023141243.db2.gz YMSOURFKRCQDLE-UHFFFAOYSA-N 1 1 326.396 3.940 20 5 EHBDMO COC(=O)c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000507155009 1023160796 /nfs/dbraw/zinc/16/07/96/1023160796.db2.gz MRPVJXCUNMYUOC-UHFFFAOYSA-N 1 1 340.379 3.546 20 5 EHBDMO Cc1ncccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602724592 1033110781 /nfs/dbraw/zinc/11/07/81/1033110781.db2.gz IBWXARRRSZDNLI-UHFFFAOYSA-N 1 1 325.290 3.607 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccsc2[N+](=O)[O-])cc1F ZINC000063265192 1033134758 /nfs/dbraw/zinc/13/47/58/1033134758.db2.gz MKLTZLJSBWNTPI-UHFFFAOYSA-N 1 1 332.360 3.902 20 5 EHBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000458159333 1023606201 /nfs/dbraw/zinc/60/62/01/1023606201.db2.gz FBKWQFPWVABHDD-INIZCTEOSA-N 1 1 347.462 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)cc1 ZINC000277024192 1023707199 /nfs/dbraw/zinc/70/71/99/1023707199.db2.gz LVLBBGPYKRLGQQ-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO CC[C@]1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000443862922 1024065717 /nfs/dbraw/zinc/06/57/17/1024065717.db2.gz PLZZXPBDFRVQJM-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000443862922 1024065731 /nfs/dbraw/zinc/06/57/31/1024065731.db2.gz PLZZXPBDFRVQJM-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](c4cccnc4)C3)nc2c1 ZINC000602857404 1033212178 /nfs/dbraw/zinc/21/21/78/1033212178.db2.gz VZHRRYOYPXWILR-CQSZACIVSA-N 1 1 338.367 3.511 20 5 EHBDMO CC(=O)c1cc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232315 1024498223 /nfs/dbraw/zinc/49/82/23/1024498223.db2.gz YCYNPBUTAGAKOU-AWEZNQCLSA-N 1 1 341.411 3.730 20 5 EHBDMO COc1c(O)ccc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000895482806 1024561573 /nfs/dbraw/zinc/56/15/73/1024561573.db2.gz YQFIDFWYAQVLAB-LJQANCHMSA-N 1 1 342.395 3.724 20 5 EHBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319060 1024619375 /nfs/dbraw/zinc/61/93/75/1024619375.db2.gz DGJNAZASLOLAEC-CYBMUJFWSA-N 1 1 346.383 3.628 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(-c3cc[nH]n3)o2)C2CC2)cc1 ZINC000435138028 1024648195 /nfs/dbraw/zinc/64/81/95/1024648195.db2.gz PJJOYUYWCKDJCC-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(-c3cc[nH]n3)o2)C2CC2)cc1 ZINC000435138028 1024648205 /nfs/dbraw/zinc/64/82/05/1024648205.db2.gz PJJOYUYWCKDJCC-UHFFFAOYSA-N 1 1 338.367 3.743 20 5 EHBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343884 1024666649 /nfs/dbraw/zinc/66/66/49/1024666649.db2.gz WDPPMVPAQJPMLM-ZDUSSCGKSA-N 1 1 346.383 3.628 20 5 EHBDMO COCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000505636406 1024713198 /nfs/dbraw/zinc/71/31/98/1024713198.db2.gz KQYHNEMBSYYBCF-YRNVUSSQSA-N 1 1 326.396 3.757 20 5 EHBDMO C[N@@H+](CCCOc1ccc(F)cc1)CCOc1ccccc1[N+](=O)[O-] ZINC000520785388 1024780253 /nfs/dbraw/zinc/78/02/53/1024780253.db2.gz OQLGMGPAJODIQR-UHFFFAOYSA-N 1 1 348.374 3.514 20 5 EHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895844049 1024891875 /nfs/dbraw/zinc/89/18/75/1024891875.db2.gz LOBOKPPTPOVYLV-DOMZBBRYSA-N 1 1 344.333 3.615 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)c1cncs1 ZINC000897935359 1033250690 /nfs/dbraw/zinc/25/06/90/1033250690.db2.gz VIEBBLUNURKOES-MRVPVSSYSA-N 1 1 329.328 3.504 20 5 EHBDMO CC(C)OC(=O)C[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000248618747 1025041318 /nfs/dbraw/zinc/04/13/18/1025041318.db2.gz JWGNADFEJGZPTM-HUUCEWRRSA-N 1 1 334.416 3.710 20 5 EHBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000346782352 1025093599 /nfs/dbraw/zinc/09/35/99/1025093599.db2.gz YFRBDNSSSVLVKL-CVEARBPZSA-N 1 1 347.462 3.943 20 5 EHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCOC1 ZINC000119773113 1025181246 /nfs/dbraw/zinc/18/12/46/1025181246.db2.gz QNVZBFUFISIMCK-CQSZACIVSA-N 1 1 330.384 3.713 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(OC(F)F)c1 ZINC000511071243 1025219592 /nfs/dbraw/zinc/21/95/92/1025219592.db2.gz BJSVRAOOYAVWNK-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO Cc1cccc(Cl)c1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602962751 1033280947 /nfs/dbraw/zinc/28/09/47/1033280947.db2.gz OKBYBGYTQCVJFJ-QGZVFWFLSA-N 1 1 334.803 3.554 20 5 EHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000185582989 1025442470 /nfs/dbraw/zinc/44/24/70/1025442470.db2.gz DQXYVPNYDFFAQC-FSNWXROXSA-N 1 1 346.427 3.662 20 5 EHBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318938 1025581416 /nfs/dbraw/zinc/58/14/16/1025581416.db2.gz PXQAMXQWYDQGOR-GHMZBOCLSA-N 1 1 346.353 3.541 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000342536600 1026168006 /nfs/dbraw/zinc/16/80/06/1026168006.db2.gz AYLNIHOJEARJJT-UHFFFAOYSA-N 1 1 325.393 3.804 20 5 EHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000451963208 1026398864 /nfs/dbraw/zinc/39/88/64/1026398864.db2.gz IMLDTFIWSBAXCW-QWHCGFSZSA-N 1 1 330.388 3.655 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCCO)[C@@H]2CCCc3ccccc32)c1 ZINC000531164427 1026638488 /nfs/dbraw/zinc/63/84/88/1026638488.db2.gz NZMKIVXXADUGGY-HXUWFJFHSA-N 1 1 340.423 3.857 20 5 EHBDMO CCc1ccc(C[NH+]2CCN(c3sccc3[N+](=O)[O-])CC2)s1 ZINC000301991521 1027017441 /nfs/dbraw/zinc/01/74/41/1027017441.db2.gz GBVLGZWDRQXTHL-UHFFFAOYSA-N 1 1 337.470 3.602 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)c(F)c(F)c2)c(Cl)c1 ZINC000183807865 1027109464 /nfs/dbraw/zinc/10/94/64/1027109464.db2.gz QOOCQRIVRDLYEQ-UHFFFAOYSA-N 1 1 330.693 3.955 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(OC(F)F)c1)CC2 ZINC000531782071 1027370186 /nfs/dbraw/zinc/37/01/86/1027370186.db2.gz YOADFNZLQNVZAY-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(OC(F)F)c1)CC2 ZINC000531782071 1027370194 /nfs/dbraw/zinc/37/01/94/1027370194.db2.gz YOADFNZLQNVZAY-UHFFFAOYSA-N 1 1 334.322 3.755 20 5 EHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000475556003 1027597230 /nfs/dbraw/zinc/59/72/30/1027597230.db2.gz ZRJJDNKSXBPNMV-GJZGRUSLSA-N 1 1 348.447 3.596 20 5 EHBDMO Cc1nc(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781587 1027789219 /nfs/dbraw/zinc/78/92/19/1027789219.db2.gz BQOJWUNUAQKKFM-RHSMWYFYSA-N 1 1 340.427 3.621 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174538 1027911757 /nfs/dbraw/zinc/91/17/57/1027911757.db2.gz FTRCTTWJOZAUOI-FZKQIMNGSA-N 1 1 330.359 3.948 20 5 EHBDMO Cc1ccccc1C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444580922 1028059879 /nfs/dbraw/zinc/05/98/79/1028059879.db2.gz FGGLBHWWWZYTQB-UHFFFAOYSA-N 1 1 336.395 3.944 20 5 EHBDMO Cc1ccccc1C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000444580922 1028059897 /nfs/dbraw/zinc/05/98/97/1028059897.db2.gz FGGLBHWWWZYTQB-UHFFFAOYSA-N 1 1 336.395 3.944 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4ccc(Cl)cc4)CC3)nc2c1 ZINC000444682251 1028154393 /nfs/dbraw/zinc/15/43/93/1028154393.db2.gz ZLTVXPDTJLEWMX-UHFFFAOYSA-N 1 1 342.786 3.903 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC(C)(C)Cc2occc21 ZINC000178729110 1028377080 /nfs/dbraw/zinc/37/70/80/1028377080.db2.gz ZXEWFDCUAPZQGG-HNNXBMFYSA-N 1 1 330.384 4.000 20 5 EHBDMO CCc1ccc([C@@H](N[C@@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456743 1028449134 /nfs/dbraw/zinc/44/91/34/1028449134.db2.gz OEPGIVILPAXUCI-UGSOOPFHSA-N 1 1 331.416 3.557 20 5 EHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C(C)C)N2CCCC2)cc1[N+](=O)[O-] ZINC000504906031 1029049457 /nfs/dbraw/zinc/04/94/57/1029049457.db2.gz RQQSDTYTUNCIDO-YJBOKZPZSA-N 1 1 349.475 3.765 20 5 EHBDMO CCOc1ccc([C@H](C)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000504911322 1029052106 /nfs/dbraw/zinc/05/21/06/1029052106.db2.gz DTPOKLWSMGJLFH-HNNXBMFYSA-N 1 1 349.475 3.909 20 5 EHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000324882191 1029358780 /nfs/dbraw/zinc/35/87/80/1029358780.db2.gz QRRLXVIMQJPTJJ-AWEZNQCLSA-N 1 1 328.416 3.819 20 5 EHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524894994 1029587506 /nfs/dbraw/zinc/58/75/06/1029587506.db2.gz ZHDFBNKVZALTKC-NXHRZFHOSA-N 1 1 332.444 3.929 20 5 EHBDMO CC[C@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000533299189 1029600767 /nfs/dbraw/zinc/60/07/67/1029600767.db2.gz GDFSTKMSHRDIMI-LBPRGKRZSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000533299189 1029600777 /nfs/dbraw/zinc/60/07/77/1029600777.db2.gz GDFSTKMSHRDIMI-LBPRGKRZSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000533299188 1029600895 /nfs/dbraw/zinc/60/08/95/1029600895.db2.gz GDFSTKMSHRDIMI-GFCCVEGCSA-N 1 1 339.823 3.699 20 5 EHBDMO CC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000533299188 1029600902 /nfs/dbraw/zinc/60/09/02/1029600902.db2.gz GDFSTKMSHRDIMI-GFCCVEGCSA-N 1 1 339.823 3.699 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000446488544 1029659476 /nfs/dbraw/zinc/65/94/76/1029659476.db2.gz NVYYDQFDQDUMAW-CYBMUJFWSA-N 1 1 348.447 3.535 20 5 EHBDMO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000192480582 1029684669 /nfs/dbraw/zinc/68/46/69/1029684669.db2.gz HDPGSRLYTSFHNX-JSGCOSHPSA-N 1 1 332.429 3.516 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncc([N+](=O)[O-])s2)cc1 ZINC000192480392 1029684995 /nfs/dbraw/zinc/68/49/95/1029684995.db2.gz HLUOKKYOLSUBMB-JTQLQIEISA-N 1 1 329.385 3.719 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)[C@H]1C=C[C@@H](CO)C1 ZINC000347387823 1029721065 /nfs/dbraw/zinc/72/10/65/1029721065.db2.gz ZOXCAMRCBVLWBC-ZBFHGGJFSA-N 1 1 344.436 3.596 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)[C@H]1C=C[C@@H](CO)C1 ZINC000347387823 1029721071 /nfs/dbraw/zinc/72/10/71/1029721071.db2.gz ZOXCAMRCBVLWBC-ZBFHGGJFSA-N 1 1 344.436 3.596 20 5 EHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407734 1029839638 /nfs/dbraw/zinc/83/96/38/1029839638.db2.gz HLAMISMXLMIVHU-GJZGRUSLSA-N 1 1 326.824 3.884 20 5 EHBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890944 1029842563 /nfs/dbraw/zinc/84/25/63/1029842563.db2.gz RKEAYSJBNSWOIL-XSBJJCPUSA-N 1 1 346.427 3.519 20 5 EHBDMO CC(C)OC(=O)c1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000441150620 1029843922 /nfs/dbraw/zinc/84/39/22/1029843922.db2.gz SFQXXAOMVOMFDC-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO CC(C)OC(=O)c1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000441150620 1029843930 /nfs/dbraw/zinc/84/39/30/1029843930.db2.gz SFQXXAOMVOMFDC-UHFFFAOYSA-N 1 1 342.395 3.792 20 5 EHBDMO CC(C)(C)Oc1cc(N2CCC(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000343254020 1029911998 /nfs/dbraw/zinc/91/19/98/1029911998.db2.gz RLJCXQNBWSBYIX-UHFFFAOYSA-N 1 1 344.415 3.879 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000611774608 1029993844 /nfs/dbraw/zinc/99/38/44/1029993844.db2.gz DZYOIIZOMOHFCD-CQSZACIVSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000611774608 1029993851 /nfs/dbraw/zinc/99/38/51/1029993851.db2.gz DZYOIIZOMOHFCD-CQSZACIVSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1[nH+]ccn1CCCCSCCOc1ccc([N+](=O)[O-])cc1 ZINC000600568526 1029998390 /nfs/dbraw/zinc/99/83/90/1029998390.db2.gz IFCFQJBWWCTYGW-UHFFFAOYSA-N 1 1 335.429 3.692 20 5 EHBDMO CCc1ccc([C@H]([NH2+]CC2=CCOCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453284352 1030024084 /nfs/dbraw/zinc/02/40/84/1030024084.db2.gz IJAYVHUUSSWTMB-LJQANCHMSA-N 1 1 342.395 3.776 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccc2c(c1)CCO2)C1CC1 ZINC000441248425 1030154770 /nfs/dbraw/zinc/15/47/70/1030154770.db2.gz AISPZZBLFROJPN-UHFFFAOYSA-N 1 1 338.407 3.737 20 5 EHBDMO C[N@H+](Cc1ccoc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159420828 1030197977 /nfs/dbraw/zinc/19/79/77/1030197977.db2.gz CJALAWHDQSOYLC-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO C[N@@H+](Cc1ccoc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159420828 1030197997 /nfs/dbraw/zinc/19/79/97/1030197997.db2.gz CJALAWHDQSOYLC-UHFFFAOYSA-N 1 1 325.162 3.582 20 5 EHBDMO CC[C@]1(C(C)C)C[C@H]1[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453439731 1030256687 /nfs/dbraw/zinc/25/66/87/1030256687.db2.gz MILYNYARJRFALQ-ZHALLVOQSA-N 1 1 342.443 3.832 20 5 EHBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000472297620 1030381097 /nfs/dbraw/zinc/38/10/97/1030381097.db2.gz WBIXLBSAGRSCPS-ZDUSSCGKSA-N 1 1 329.400 3.913 20 5 EHBDMO CC[C@]1(C)COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000482526116 1030504434 /nfs/dbraw/zinc/50/44/34/1030504434.db2.gz SOLNBPVTEBNEGO-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC[C@]1(C)COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000482526116 1030504445 /nfs/dbraw/zinc/50/44/45/1030504445.db2.gz SOLNBPVTEBNEGO-GOSISDBHSA-N 1 1 330.384 3.856 20 5 EHBDMO CC(C)[N@H+](Cc1cn2ccsc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000171079578 1030837981 /nfs/dbraw/zinc/83/79/81/1030837981.db2.gz HJYUXFZCMTUVEZ-UHFFFAOYSA-N 1 1 330.413 3.715 20 5 EHBDMO CC(C)[N@@H+](Cc1cn2ccsc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000171079578 1030838004 /nfs/dbraw/zinc/83/80/04/1030838004.db2.gz HJYUXFZCMTUVEZ-UHFFFAOYSA-N 1 1 330.413 3.715 20 5 EHBDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000343440271 1030900488 /nfs/dbraw/zinc/90/04/88/1030900488.db2.gz JFLAKDJQKYNELE-INIZCTEOSA-N 1 1 330.384 3.856 20 5 EHBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343458384 1030974798 /nfs/dbraw/zinc/97/47/98/1030974798.db2.gz CRRKQLGESBGNNC-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000448373542 1031008549 /nfs/dbraw/zinc/00/85/49/1031008549.db2.gz QXENEWKJHXDPNB-MRXNPFEDSA-N 1 1 332.425 3.526 20 5 EHBDMO CCc1ccc([C@@H]([NH2+]C[C@H](OC)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551275502 1031170691 /nfs/dbraw/zinc/17/06/91/1031170691.db2.gz UNLGLAKUKGGSBJ-OALUTQOASA-N 1 1 344.411 3.854 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c(F)cccc2OC(F)(F)F)cc1 ZINC000551538642 1031418558 /nfs/dbraw/zinc/41/85/58/1031418558.db2.gz ZJZZAQDCHWIIJD-UHFFFAOYSA-N 1 1 344.264 3.922 20 5 EHBDMO CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC[C@@H]1C(F)(F)F ZINC000484340120 1031535791 /nfs/dbraw/zinc/53/57/91/1031535791.db2.gz MPDNKLKYRMMMNR-AWEZNQCLSA-N 1 1 346.349 3.884 20 5 EHBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000052907657 1032000740 /nfs/dbraw/zinc/00/07/40/1032000740.db2.gz APTCORVEGMEDKO-OAHLLOKOSA-N 1 1 341.411 3.559 20 5 EHBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c2ccncc21 ZINC000594596696 1033444454 /nfs/dbraw/zinc/44/44/54/1033444454.db2.gz BEDQPNFWQPHNQO-WMZOPIPTSA-N 1 1 326.400 3.572 20 5 EHBDMO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCC[N@H+]4CCCC[C@H]34)c2c1 ZINC000594599886 1033445881 /nfs/dbraw/zinc/44/58/81/1033445881.db2.gz KAYVLJIRRCHUNT-DLBZAZTESA-N 1 1 326.400 3.572 20 5 EHBDMO CCCn1nccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000594935587 1033586511 /nfs/dbraw/zinc/58/65/11/1033586511.db2.gz BFNGVISJSCRZJZ-UHFFFAOYSA-N 1 1 342.321 3.510 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000595020486 1033612336 /nfs/dbraw/zinc/61/23/36/1033612336.db2.gz ZNLRWEJHLOSXKL-MEDUHNTESA-N 1 1 346.358 3.917 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054952 1033632110 /nfs/dbraw/zinc/63/21/10/1033632110.db2.gz XRZZHCUCIULDMU-ZFWWWQNUSA-N 1 1 335.448 3.517 20 5 EHBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054952 1033632120 /nfs/dbraw/zinc/63/21/20/1033632120.db2.gz XRZZHCUCIULDMU-ZFWWWQNUSA-N 1 1 335.448 3.517 20 5 EHBDMO CCSc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)ccn1 ZINC000595034221 1033655422 /nfs/dbraw/zinc/65/54/22/1033655422.db2.gz WDEZQJZVHLUIOO-GFCCVEGCSA-N 1 1 347.440 3.961 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000595040484 1033660784 /nfs/dbraw/zinc/66/07/84/1033660784.db2.gz LJURFBSCEGBZMU-BDJLRTHQSA-N 1 1 346.358 3.917 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(C)c1OC ZINC000595049160 1033665642 /nfs/dbraw/zinc/66/56/42/1033665642.db2.gz ZFZSYWBXAHZLKO-CYBMUJFWSA-N 1 1 330.384 3.771 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595327386 1033728574 /nfs/dbraw/zinc/72/85/74/1033728574.db2.gz RDXQXUQOGUIZPT-ZDUSSCGKSA-N 1 1 333.413 3.505 20 5 EHBDMO Cc1noc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595327385 1033729675 /nfs/dbraw/zinc/72/96/75/1033729675.db2.gz RDXQXUQOGUIZPT-CYBMUJFWSA-N 1 1 333.413 3.505 20 5 EHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC000595304125 1033738475 /nfs/dbraw/zinc/73/84/75/1033738475.db2.gz NUUAWWUZWAIALO-AWEZNQCLSA-N 1 1 330.359 3.732 20 5 EHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000593714636 1033822266 /nfs/dbraw/zinc/82/22/66/1033822266.db2.gz IODILSKDWOLKSC-VEVIJQCQSA-N 1 1 332.375 3.815 20 5 EHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(CO)ccc1F ZINC000599271464 1033851408 /nfs/dbraw/zinc/85/14/08/1033851408.db2.gz YEISMGWOUSDNBW-UHFFFAOYSA-N 1 1 332.375 3.637 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(CO)ccc1F ZINC000599271464 1033851424 /nfs/dbraw/zinc/85/14/24/1033851424.db2.gz YEISMGWOUSDNBW-UHFFFAOYSA-N 1 1 332.375 3.637 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000547332436 1033882039 /nfs/dbraw/zinc/88/20/39/1033882039.db2.gz KYRUKLZDRZJSPC-UHFFFAOYSA-N 1 1 348.447 3.550 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)s1 ZINC000064029356 1033944322 /nfs/dbraw/zinc/94/43/22/1033944322.db2.gz ONNNBDFPNASOKL-UHFFFAOYSA-N 1 1 335.404 3.508 20 5 EHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000595783462 1033998081 /nfs/dbraw/zinc/99/80/81/1033998081.db2.gz ONSLEMHHASMHTA-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059435 1034086772 /nfs/dbraw/zinc/08/67/72/1034086772.db2.gz OEXFUMALCSBQDM-GDBMZVCRSA-N 1 1 346.818 3.809 20 5 EHBDMO Cc1cnc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000534059435 1034086782 /nfs/dbraw/zinc/08/67/82/1034086782.db2.gz OEXFUMALCSBQDM-GDBMZVCRSA-N 1 1 346.818 3.809 20 5 EHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000596168105 1034116026 /nfs/dbraw/zinc/11/60/26/1034116026.db2.gz KREUFOZHKROQKL-BXUZGUMPSA-N 1 1 343.349 3.534 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000612403793 1034894588 /nfs/dbraw/zinc/89/45/88/1034894588.db2.gz CUADPUGCSXSWJX-QGZVFWFLSA-N 1 1 330.359 3.696 20 5 EHBDMO C[N@@H+](CCCOCc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000548935474 1034997314 /nfs/dbraw/zinc/99/73/14/1034997314.db2.gz MTKMZKUGZSQIIB-UHFFFAOYSA-N 1 1 328.412 3.676 20 5 EHBDMO CC1(C)C[C@H](N[C@H]2CC[N@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390420 1035434341 /nfs/dbraw/zinc/43/43/41/1035434341.db2.gz XJCHAXOGYFCURI-OKZBNKHCSA-N 1 1 329.444 3.534 20 5 EHBDMO CC1(C)C[C@H]([NH2+][C@H]2CCN3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390420 1035434343 /nfs/dbraw/zinc/43/43/43/1035434343.db2.gz XJCHAXOGYFCURI-OKZBNKHCSA-N 1 1 329.444 3.534 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000511460749 1035473045 /nfs/dbraw/zinc/47/30/45/1035473045.db2.gz MUDQTTOAUDYIRC-RMKNXTFCSA-N 1 1 337.423 3.820 20 5 EHBDMO CC(C)(C)Oc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000443422987 1035777949 /nfs/dbraw/zinc/77/79/49/1035777949.db2.gz AIPVKCZTZVDCHD-GJZGRUSLSA-N 1 1 333.432 3.811 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000589300214 1036329096 /nfs/dbraw/zinc/32/90/96/1036329096.db2.gz DZPLUVRBFZUSFE-QGTPRVQTSA-N 1 1 330.428 3.998 20 5 EHBDMO CC(C)(C)C1=CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000535377804 1036418693 /nfs/dbraw/zinc/41/86/93/1036418693.db2.gz BUCRMYUHIMSRKX-UHFFFAOYSA-N 1 1 332.400 3.640 20 5 EHBDMO CC(C)(C)C1=CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000535377804 1036418701 /nfs/dbraw/zinc/41/87/01/1036418701.db2.gz BUCRMYUHIMSRKX-UHFFFAOYSA-N 1 1 332.400 3.640 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000589500077 1036440812 /nfs/dbraw/zinc/44/08/12/1036440812.db2.gz QXFGMDVUMSYHOA-IBGZPJMESA-N 1 1 344.411 3.704 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000464681205 1036656653 /nfs/dbraw/zinc/65/66/53/1036656653.db2.gz ZNLMJFWDZZBWSE-ZDUSSCGKSA-N 1 1 348.349 3.871 20 5 EHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135534 1036785366 /nfs/dbraw/zinc/78/53/66/1036785366.db2.gz OASBPCYQDKYZBE-NEPJUHHUSA-N 1 1 343.349 3.961 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000166154010 1036931644 /nfs/dbraw/zinc/93/16/44/1036931644.db2.gz HROHAZDULIOATJ-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO COc1cccc([C@H](C)[NH+]2CCN(c3ccsc3[N+](=O)[O-])CC2)c1 ZINC000609143800 1036954436 /nfs/dbraw/zinc/95/44/36/1036954436.db2.gz UBQFZIAQMHWAQU-ZDUSSCGKSA-N 1 1 347.440 3.548 20 5 EHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000130247309 1037219857 /nfs/dbraw/zinc/21/98/57/1037219857.db2.gz HSUGGOVKZYAFTP-CQSZACIVSA-N 1 1 330.388 3.655 20 5 EHBDMO Cc1ccc(Sc2ccc(C[N@H+](C)C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462830259 1037433545 /nfs/dbraw/zinc/43/35/45/1037433545.db2.gz BMBLDALHLYUYJE-CQSZACIVSA-N 1 1 346.452 3.867 20 5 EHBDMO CCOc1cc(C[N@@H+](CCOC)[C@@H]2CC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601345 1037486315 /nfs/dbraw/zinc/48/63/15/1037486315.db2.gz BOXHHPOAESDGLA-GDBMZVCRSA-N 1 1 336.432 3.631 20 5 EHBDMO CC1(C)[C@@H](O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000462871957 1037500835 /nfs/dbraw/zinc/50/08/35/1037500835.db2.gz RTAWQAVWLLEQSQ-INIZCTEOSA-N 1 1 332.425 3.669 20 5 EHBDMO Cc1ccnc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311171153 1037516688 /nfs/dbraw/zinc/51/66/88/1037516688.db2.gz SUQSETMRCZAANT-KRWDZBQOSA-N 1 1 340.427 3.622 20 5 EHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587416 1037709496 /nfs/dbraw/zinc/70/94/96/1037709496.db2.gz ZHWWHSHKFOILSK-HIFRSBDPSA-N 1 1 333.432 3.742 20 5 EHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000463080537 1037727337 /nfs/dbraw/zinc/72/73/37/1037727337.db2.gz ZNOAWBRTYTWJPJ-LBPRGKRZSA-N 1 1 343.374 3.507 20 5 EHBDMO C[N@@H+](CCC(C)(C)C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000592145362 1037866456 /nfs/dbraw/zinc/86/64/56/1037866456.db2.gz WFSGMZKCMKVNSF-UHFFFAOYSA-N 1 1 327.812 3.555 20 5 EHBDMO CC(C)(C)OC(=O)C1(C)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000592157478 1037897559 /nfs/dbraw/zinc/89/75/59/1037897559.db2.gz AFOSNGWCHWQKHN-UHFFFAOYSA-N 1 1 334.416 3.539 20 5 EHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@H+](C)C1CCCCC1 ZINC000443365803 1038125275 /nfs/dbraw/zinc/12/52/75/1038125275.db2.gz AHTXBHAITLYRFS-UHFFFAOYSA-N 1 1 348.447 3.598 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000467553709 1038365615 /nfs/dbraw/zinc/36/56/15/1038365615.db2.gz KHEJSCKKFSNPGU-MRXNPFEDSA-N 1 1 330.384 3.856 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCC[C@@H]1O ZINC000538812485 1038548429 /nfs/dbraw/zinc/54/84/29/1038548429.db2.gz RSVXKRXWDSVLFW-DYVFJYSZSA-N 1 1 346.452 3.916 20 5 EHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H](C)CO ZINC000552124418 1039006304 /nfs/dbraw/zinc/00/63/04/1039006304.db2.gz RWQOWPAJMNUDKQ-NSHDSACASA-N 1 1 338.791 3.711 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](CO)CC2)s1 ZINC000552146504 1039023726 /nfs/dbraw/zinc/02/37/26/1039023726.db2.gz LHSAWLJQGQMDJW-CQSZACIVSA-N 1 1 346.452 3.918 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000485772918 1039526570 /nfs/dbraw/zinc/52/65/70/1039526570.db2.gz OAAIJRWMLUGSSP-KRWDZBQOSA-N 1 1 326.396 3.811 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cn3ccsc3n1)CCCC2 ZINC000417309525 1039663888 /nfs/dbraw/zinc/66/38/88/1039663888.db2.gz FABCHYQJVAKILY-MRXNPFEDSA-N 1 1 342.424 3.861 20 5 EHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccs2)n1 ZINC000554848645 1039830396 /nfs/dbraw/zinc/83/03/96/1039830396.db2.gz QEWUZDZIPIHFPY-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccs2)n1 ZINC000554848645 1039830424 /nfs/dbraw/zinc/83/04/24/1039830424.db2.gz QEWUZDZIPIHFPY-UHFFFAOYSA-N 1 1 343.408 3.986 20 5 EHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2[nH]c(=O)[nH]c2c1 ZINC000893946298 1039869867 /nfs/dbraw/zinc/86/98/67/1039869867.db2.gz WISQTLCGCRTYSH-UHFFFAOYSA-N 1 1 340.383 3.587 20 5 EHBDMO C[C@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000480676580 1039874082 /nfs/dbraw/zinc/87/40/82/1039874082.db2.gz NWTOVLDFKKJMNZ-NSHDSACASA-N 1 1 344.802 3.986 20 5 EHBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)CCO2 ZINC000614100926 1040118262 /nfs/dbraw/zinc/11/82/62/1040118262.db2.gz DEHQFIWOEJXUAJ-QGZVFWFLSA-N 1 1 346.358 3.746 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031074 1040298661 /nfs/dbraw/zinc/29/86/61/1040298661.db2.gz NKLOBAOYFVQVLA-HNNXBMFYSA-N 1 1 330.359 3.732 20 5 EHBDMO COc1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)ccc1[N+](=O)[O-] ZINC000490105807 1040344377 /nfs/dbraw/zinc/34/43/77/1040344377.db2.gz ZLNQKXAYPJQYCH-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO CC(C)CC[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070901 1040425946 /nfs/dbraw/zinc/42/59/46/1040425946.db2.gz SHXDMCSZTJPNKH-HNNXBMFYSA-N 1 1 333.432 3.824 20 5 EHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(c2ccccc2)C1 ZINC000490366293 1040516118 /nfs/dbraw/zinc/51/61/18/1040516118.db2.gz KMBOUHGWJJVUCQ-SFHVURJKSA-N 1 1 343.402 3.835 20 5 EHBDMO COc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC1CC1 ZINC000600112136 1040674053 /nfs/dbraw/zinc/67/40/53/1040674053.db2.gz OUQKTWNLGCWUNW-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC1CC1 ZINC000600112136 1040674056 /nfs/dbraw/zinc/67/40/56/1040674056.db2.gz OUQKTWNLGCWUNW-UHFFFAOYSA-N 1 1 342.395 3.777 20 5 EHBDMO COC(=O)c1cc([C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202496 1041054229 /nfs/dbraw/zinc/05/42/29/1041054229.db2.gz RBTQPBKBJYBRJY-GFCCVEGCSA-N 1 1 346.383 3.518 20 5 EHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1 ZINC000481682994 1041230474 /nfs/dbraw/zinc/23/04/74/1041230474.db2.gz BWZIIGNESLIDGG-HXUWFJFHSA-N 1 1 338.407 3.659 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](c1ccccc1F)[C@@H](C)O ZINC000571289425 1041256720 /nfs/dbraw/zinc/25/67/20/1041256720.db2.gz BCLNJESRCNVZAB-VEVIJQCQSA-N 1 1 332.375 3.815 20 5 EHBDMO Cc1ccc(C[N@@H+](C)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000511674080 1041452103 /nfs/dbraw/zinc/45/21/03/1041452103.db2.gz XJBJWVNYFIHJSW-LJQANCHMSA-N 1 1 326.396 3.649 20 5 EHBDMO CCN1CCC([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000125225928 1041920683 /nfs/dbraw/zinc/92/06/83/1041920683.db2.gz HDFRGVNEAMHLNP-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000125225928 1041920694 /nfs/dbraw/zinc/92/06/94/1041920694.db2.gz HDFRGVNEAMHLNP-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CCN1CCC([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000125250222 1041927151 /nfs/dbraw/zinc/92/71/51/1041927151.db2.gz VXPZCOQJPQPCPW-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000125250222 1041927159 /nfs/dbraw/zinc/92/71/59/1041927159.db2.gz VXPZCOQJPQPCPW-UHFFFAOYSA-N 1 1 343.427 3.771 20 5 EHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111312369 1042261108 /nfs/dbraw/zinc/26/11/08/1042261108.db2.gz IVMKGCAFDLAYOZ-INIZCTEOSA-N 1 1 331.441 3.912 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1F ZINC000291235464 1042789065 /nfs/dbraw/zinc/78/90/65/1042789065.db2.gz UMBLVXLIQURAOC-QGPMSJSTSA-N 1 1 336.407 3.640 20 5 EHBDMO Cc1cccc(C)c1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000342285196 1042846877 /nfs/dbraw/zinc/84/68/77/1042846877.db2.gz SGPNHFPDUNJINJ-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051709647 1042859188 /nfs/dbraw/zinc/85/91/88/1042859188.db2.gz FZLUXNXTXAWEBD-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051709647 1042859193 /nfs/dbraw/zinc/85/91/93/1042859193.db2.gz FZLUXNXTXAWEBD-ZDUSSCGKSA-N 1 1 338.367 3.838 20 5 EHBDMO COC(=O)c1coc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000278908056 1042906011 /nfs/dbraw/zinc/90/60/11/1042906011.db2.gz ZWSASJXXRYYQLJ-RYUDHWBXSA-N 1 1 332.356 3.695 20 5 EHBDMO CCOc1cc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000278918713 1042945771 /nfs/dbraw/zinc/94/57/71/1042945771.db2.gz WNJLOHKCQXIRIN-LBPRGKRZSA-N 1 1 332.322 3.768 20 5 EHBDMO Cc1nccnc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279391764 1044034753 /nfs/dbraw/zinc/03/47/53/1044034753.db2.gz CFHPBMHFLVNXRU-JTQLQIEISA-N 1 1 340.305 3.563 20 5 EHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccn1 ZINC000279412904 1044063707 /nfs/dbraw/zinc/06/37/07/1044063707.db2.gz FAWJOSZKLOEZEP-SNVBAGLBSA-N 1 1 325.290 3.859 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210856 1044163671 /nfs/dbraw/zinc/16/36/71/1044163671.db2.gz FWIQXLHOROAZRZ-DLBZAZTESA-N 1 1 331.460 3.681 20 5 EHBDMO CC(C)[N@@H+](CCCCCn1cccn1)Cc1ccc([N+](=O)[O-])cc1 ZINC000170913950 1126924064 /nfs/dbraw/zinc/92/40/64/1126924064.db2.gz NZILRGBKKHOPEM-UHFFFAOYSA-N 1 1 330.432 3.872 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506897 1128484256 /nfs/dbraw/zinc/48/42/56/1128484256.db2.gz CYWKYZJRUCPULH-HNAYVOBHSA-N 1 1 325.412 3.917 20 5 EHBDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819739 1128661283 /nfs/dbraw/zinc/66/12/83/1128661283.db2.gz AQBUEXDDIUHGNW-HIFRSBDPSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1nc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000301626269 1128762933 /nfs/dbraw/zinc/76/29/33/1128762933.db2.gz HKRXUJCIUSJDKB-CQSZACIVSA-N 1 1 346.456 3.684 20 5 EHBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@H](c2ccccc2)C1 ZINC000301066215 1121298117 /nfs/dbraw/zinc/29/81/17/1121298117.db2.gz JTHGGNYVZYEQCQ-FQEVSTJZSA-N 1 1 348.406 3.636 20 5 EHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@H]21 ZINC000301726917 1128998529 /nfs/dbraw/zinc/99/85/29/1128998529.db2.gz VMMSMZOUGUFLHJ-SMDDNHRTSA-N 1 1 343.349 3.534 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301788532 1129073224 /nfs/dbraw/zinc/07/32/24/1129073224.db2.gz PWIIBULWHPASRI-WFASDCNBSA-N 1 1 335.835 3.701 20 5 EHBDMO C[C@@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136462 1123167582 /nfs/dbraw/zinc/16/75/82/1123167582.db2.gz IWCAWLSRKOURNS-AEFFLSMTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136462 1123167584 /nfs/dbraw/zinc/16/75/84/1123167584.db2.gz IWCAWLSRKOURNS-AEFFLSMTSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136462 1123167587 /nfs/dbraw/zinc/16/75/87/1123167587.db2.gz IWCAWLSRKOURNS-AEFFLSMTSA-N 1 1 339.439 3.768 20 5 EHBDMO Cc1nn(C[N@H+](CCc2ccccc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000921056182 1123459627 /nfs/dbraw/zinc/45/96/27/1123459627.db2.gz CAEMYKHLYQAKEU-UHFFFAOYSA-N 1 1 330.432 3.566 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000609631771 1123635075 /nfs/dbraw/zinc/63/50/75/1123635075.db2.gz WFDQFRPVCDOBBW-CWRNSKLLSA-N 1 1 345.443 3.742 20 5 EHBDMO CN(CC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000609705091 1123647856 /nfs/dbraw/zinc/64/78/56/1123647856.db2.gz PHLMYVLLKWVQAL-UHFFFAOYSA-N 1 1 333.819 3.816 20 5 EHBDMO CN(CC[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000609705091 1123647858 /nfs/dbraw/zinc/64/78/58/1123647858.db2.gz PHLMYVLLKWVQAL-UHFFFAOYSA-N 1 1 333.819 3.816 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000615834450 1123883954 /nfs/dbraw/zinc/88/39/54/1123883954.db2.gz VBABGCYVUULLML-KAPURRDVSA-N 1 1 326.400 3.532 20 5 EHBDMO CCn1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000616785311 1124033988 /nfs/dbraw/zinc/03/39/88/1124033988.db2.gz MZWUGLMAVVNYAJ-UHFFFAOYSA-N 1 1 331.416 3.835 20 5 EHBDMO CCn1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000616785311 1124033991 /nfs/dbraw/zinc/03/39/91/1124033991.db2.gz MZWUGLMAVVNYAJ-UHFFFAOYSA-N 1 1 331.416 3.835 20 5 EHBDMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccccc1 ZINC000181670870 1125008902 /nfs/dbraw/zinc/00/89/02/1125008902.db2.gz ULVFCKCKSKTMBE-SFHVURJKSA-N 1 1 344.411 3.859 20 5 EHBDMO Cc1nc(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000716229532 1131372229 /nfs/dbraw/zinc/37/22/29/1131372229.db2.gz NMPVILUDZPTSDS-PBHICJAKSA-N 1 1 340.427 3.621 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000922467485 1129542800 /nfs/dbraw/zinc/54/28/00/1129542800.db2.gz VTNZUFFSBLRXSU-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO Cn1cc(C[N@H+]2CCC[C@H]2C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092780764 1129560998 /nfs/dbraw/zinc/56/09/98/1129560998.db2.gz HJCBCZLAMHUJHV-SFHVURJKSA-N 1 1 340.427 3.760 20 5 EHBDMO CC(C)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H](O)c1ccc(F)cc1 ZINC000735872693 1131384990 /nfs/dbraw/zinc/38/49/90/1131384990.db2.gz QKEPYWBOEBLFCQ-IBGZPJMESA-N 1 1 346.402 3.926 20 5 EHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304728 1129659887 /nfs/dbraw/zinc/65/98/87/1129659887.db2.gz UJLAKCPTEFGDAT-GJZGRUSLSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125434078 1129691852 /nfs/dbraw/zinc/69/18/52/1129691852.db2.gz FOXKSGOKCFWXCY-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO CCOc1cccc(NCC[N@@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000302225566 1129751474 /nfs/dbraw/zinc/75/14/74/1129751474.db2.gz OWQRWCCVQBAXNU-UHFFFAOYSA-N 1 1 347.440 3.525 20 5 EHBDMO CCOc1cccc(NCC[N@H+]2CCc3sccc3C2)c1[N+](=O)[O-] ZINC000302225566 1129751478 /nfs/dbraw/zinc/75/14/78/1129751478.db2.gz OWQRWCCVQBAXNU-UHFFFAOYSA-N 1 1 347.440 3.525 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000302811462 1129793472 /nfs/dbraw/zinc/79/34/72/1129793472.db2.gz QQIHIPHWMLWNTJ-HNNXBMFYSA-N 1 1 336.395 3.974 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cnn(-c2ccccc2)c1 ZINC000302811462 1129793476 /nfs/dbraw/zinc/79/34/76/1129793476.db2.gz QQIHIPHWMLWNTJ-HNNXBMFYSA-N 1 1 336.395 3.974 20 5 EHBDMO CCCCc1noc([C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000282460112 1129894212 /nfs/dbraw/zinc/89/42/12/1129894212.db2.gz MSSBXKHCDCUELY-ZDUSSCGKSA-N 1 1 332.404 3.556 20 5 EHBDMO CCCCc1noc([C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)n1 ZINC000282460112 1129894217 /nfs/dbraw/zinc/89/42/17/1129894217.db2.gz MSSBXKHCDCUELY-ZDUSSCGKSA-N 1 1 332.404 3.556 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3)CC2)c(F)c1 ZINC000352692379 1129907275 /nfs/dbraw/zinc/90/72/75/1129907275.db2.gz FTFKVKDUUWEBEH-UHFFFAOYSA-N 1 1 344.386 3.915 20 5 EHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2C1 ZINC000172957475 1130169014 /nfs/dbraw/zinc/16/90/14/1130169014.db2.gz YYIMYFGEZMLBRT-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2C1 ZINC000172957475 1130169019 /nfs/dbraw/zinc/16/90/19/1130169019.db2.gz YYIMYFGEZMLBRT-UHFFFAOYSA-N 1 1 339.395 3.502 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000733196383 1131003617 /nfs/dbraw/zinc/00/36/17/1131003617.db2.gz CROPIKLWIXIISA-CQSZACIVSA-N 1 1 349.431 3.599 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000733196383 1131003622 /nfs/dbraw/zinc/00/36/22/1131003622.db2.gz CROPIKLWIXIISA-CQSZACIVSA-N 1 1 349.431 3.599 20 5 EHBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000733300582 1131018792 /nfs/dbraw/zinc/01/87/92/1131018792.db2.gz SPWDFKAHTVADJV-UHFFFAOYSA-N 1 1 344.802 3.730 20 5 EHBDMO COCC[C@H]1CCCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914775 1131902843 /nfs/dbraw/zinc/90/28/43/1131902843.db2.gz ISFWITFZGABKJF-MSOLQXFVSA-N 1 1 332.444 3.733 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3ccsc3C1)CC2 ZINC001172914604 1131903040 /nfs/dbraw/zinc/90/30/40/1131903040.db2.gz IFCFVGBJZLZNSZ-INIZCTEOSA-N 1 1 328.437 3.962 20 5 EHBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCc3ccccc3C2)c1F ZINC001173184440 1131993971 /nfs/dbraw/zinc/99/39/71/1131993971.db2.gz NHODXDAGIXSQNL-ZDUSSCGKSA-N 1 1 344.386 3.732 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001173226136 1132006416 /nfs/dbraw/zinc/00/64/16/1132006416.db2.gz HUTWEKMCTRLATB-LBPRGKRZSA-N 1 1 331.803 3.633 20 5 EHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]1COCc1ccccc1 ZINC001173225934 1132006452 /nfs/dbraw/zinc/00/64/52/1132006452.db2.gz GTJQWEGJIAHDJY-JXFKEZNVSA-N 1 1 340.423 3.817 20 5 EHBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054559 1132551266 /nfs/dbraw/zinc/55/12/66/1132551266.db2.gz SRISFMQUXGQWFE-LPUOJRKPSA-N 1 1 331.416 3.600 20 5 EHBDMO COc1ccc(Cl)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169666838 1132814078 /nfs/dbraw/zinc/81/40/78/1132814078.db2.gz PEQPLUXRJJWMQH-UHFFFAOYSA-N 1 1 334.803 3.931 20 5 EHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768555190 1133155292 /nfs/dbraw/zinc/15/52/92/1133155292.db2.gz OCMHGKBYLOKVAI-CYBMUJFWSA-N 1 1 334.803 3.631 20 5 EHBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC001180332805 1133362483 /nfs/dbraw/zinc/36/24/83/1133362483.db2.gz UMTRUPSFZBQVBH-SWLSCSKDSA-N 1 1 346.349 3.597 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C/C=C\c2ccc(F)cc2)CC1 ZINC001180497391 1133385545 /nfs/dbraw/zinc/38/55/45/1133385545.db2.gz IPNQRYPEBLNUEQ-ARJAWSKDSA-N 1 1 341.386 3.569 20 5 EHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000786574916 1133876621 /nfs/dbraw/zinc/87/66/21/1133876621.db2.gz RTBGQTNQKVECCP-QGZVFWFLSA-N 1 1 343.383 3.639 20 5 EHBDMO CC[N@@H+](CCc1ccccn1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000787408103 1134003752 /nfs/dbraw/zinc/00/37/52/1134003752.db2.gz YNRDEGSOVCALKS-DTQAZKPQSA-N 1 1 325.412 3.958 20 5 EHBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455109 1134276927 /nfs/dbraw/zinc/27/69/27/1134276927.db2.gz IGJUKDHAXRUGEA-MRXNPFEDSA-N 1 1 348.830 3.938 20 5 EHBDMO O=[N+]([O-])c1c(NC[C@H]2CC[N@H+]2C2CCCCC2)ccc2cnccc21 ZINC001187063621 1134291380 /nfs/dbraw/zinc/29/13/80/1134291380.db2.gz KQQLRVQOHNTLFB-MRXNPFEDSA-N 1 1 340.427 3.962 20 5 EHBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1CCC=N1 ZINC001187371270 1134327480 /nfs/dbraw/zinc/32/74/80/1134327480.db2.gz YDVNTQADNKSMJL-KRWDZBQOSA-N 1 1 346.434 3.934 20 5 EHBDMO C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+]1C1CCCC1 ZINC001187624173 1134357429 /nfs/dbraw/zinc/35/74/29/1134357429.db2.gz ASYOSGKBFHFGSC-LBPRGKRZSA-N 1 1 346.456 3.658 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348450 1134759751 /nfs/dbraw/zinc/75/97/51/1134759751.db2.gz XBUUVKXJTJUNPW-GFCCVEGCSA-N 1 1 332.425 3.654 20 5 EHBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3c(F)cccc3C2)c([N+](=O)[O-])c1 ZINC001170351729 1134760500 /nfs/dbraw/zinc/76/05/00/1134760500.db2.gz HIEJGDNUWRGUHS-ZDUSSCGKSA-N 1 1 344.386 3.732 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC001191075715 1134788439 /nfs/dbraw/zinc/78/84/39/1134788439.db2.gz CLXJFNCSLIKQJW-XJKCOSOUSA-N 1 1 332.400 3.534 20 5 EHBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202045 1134815380 /nfs/dbraw/zinc/81/53/80/1134815380.db2.gz DVWWPENSWUUDDL-HOCLYGCPSA-N 1 1 326.824 3.884 20 5 EHBDMO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])o1 ZINC001191258264 1134826338 /nfs/dbraw/zinc/82/63/38/1134826338.db2.gz LSCZMNCPGUKWSX-CZUORRHYSA-N 1 1 346.431 3.728 20 5 EHBDMO Cc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n(C)n1 ZINC000793563605 1134958812 /nfs/dbraw/zinc/95/88/12/1134958812.db2.gz DFAREAGTIPALTE-SNVBAGLBSA-N 1 1 342.321 3.506 20 5 EHBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CCCC1 ZINC001194176595 1135237808 /nfs/dbraw/zinc/23/78/08/1135237808.db2.gz OMVVTGCARCXUED-AWEZNQCLSA-N 1 1 328.416 3.834 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)ccc1Cl ZINC001195515643 1135436359 /nfs/dbraw/zinc/43/63/59/1135436359.db2.gz GAWGLBDBLKXILI-HNNXBMFYSA-N 1 1 332.787 3.902 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)ccc1Cl ZINC001195515643 1135436361 /nfs/dbraw/zinc/43/63/61/1135436361.db2.gz GAWGLBDBLKXILI-HNNXBMFYSA-N 1 1 332.787 3.902 20 5 EHBDMO C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001195809868 1135474133 /nfs/dbraw/zinc/47/41/33/1135474133.db2.gz OSVACOKPYYDYOE-OAHLLOKOSA-N 1 1 326.396 3.635 20 5 EHBDMO C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939167 1135486934 /nfs/dbraw/zinc/48/69/34/1135486934.db2.gz WXYJXKKZGOANJM-QMTHXVAHSA-N 1 1 347.242 3.885 20 5 EHBDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939167 1135486936 /nfs/dbraw/zinc/48/69/36/1135486936.db2.gz WXYJXKKZGOANJM-QMTHXVAHSA-N 1 1 347.242 3.885 20 5 EHBDMO COC(=O)CC[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468854 1135693456 /nfs/dbraw/zinc/69/34/56/1135693456.db2.gz OMFCEDPZEFFEGA-CABCVRRESA-N 1 1 334.416 3.629 20 5 EHBDMO CCC1(CC)CCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC001197514708 1135697140 /nfs/dbraw/zinc/69/71/40/1135697140.db2.gz QKCOIFUDXWIGLB-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H](O)c1ccc(C)cc1 ZINC000747531237 1135744121 /nfs/dbraw/zinc/74/41/21/1135744121.db2.gz SVYTUTIBLDVKCU-SFHVURJKSA-N 1 1 332.375 3.598 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001198818840 1135859661 /nfs/dbraw/zinc/85/96/61/1135859661.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 1 1 343.471 3.772 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859672 /nfs/dbraw/zinc/85/96/72/1135859672.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 1 1 343.471 3.772 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@]23CN(C)C[C@]2(C1)CCCC3 ZINC001198818840 1135859674 /nfs/dbraw/zinc/85/96/74/1135859674.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 1 1 343.471 3.772 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000809954154 1135905791 /nfs/dbraw/zinc/90/57/91/1135905791.db2.gz QHUDKABSEGTORW-YGRLFVJLSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000809954154 1135905792 /nfs/dbraw/zinc/90/57/92/1135905792.db2.gz QHUDKABSEGTORW-YGRLFVJLSA-N 1 1 345.226 3.903 20 5 EHBDMO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000776234252 1136092002 /nfs/dbraw/zinc/09/20/02/1136092002.db2.gz OYTCYADHHAAEEC-SOIVGHGOSA-N 1 1 349.394 3.540 20 5 EHBDMO CCC[N@H+]1CC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476039 1136096360 /nfs/dbraw/zinc/09/63/60/1136096360.db2.gz WKFSFKPNLSHIIS-NSHDSACASA-N 1 1 346.258 3.723 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276942 1136130485 /nfs/dbraw/zinc/13/04/85/1136130485.db2.gz LXKCYTDSODXMBI-MSOLQXFVSA-N 1 1 330.359 3.604 20 5 EHBDMO CC[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277925 1136131026 /nfs/dbraw/zinc/13/10/26/1136131026.db2.gz QVGNDOKYQUYEKI-QGZVFWFLSA-N 1 1 334.803 3.804 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847475 1136259794 /nfs/dbraw/zinc/25/97/94/1136259794.db2.gz DDMSFPDZTCEGED-LIRRHRJNSA-N 1 1 344.411 3.547 20 5 EHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849009 1136260220 /nfs/dbraw/zinc/26/02/20/1136260220.db2.gz NSPWHADXAJSQLL-LIRRHRJNSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)cc1 ZINC000813312797 1136317602 /nfs/dbraw/zinc/31/76/02/1136317602.db2.gz JTSLZCCZVBCNOW-UHFFFAOYSA-N 1 1 345.830 3.961 20 5 EHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC([C@@H](O)c2ccccc2)CC1 ZINC000851719547 1136401193 /nfs/dbraw/zinc/40/11/93/1136401193.db2.gz MLACXFNWWWUXOS-IBGZPJMESA-N 1 1 344.386 3.680 20 5 EHBDMO CCC[N@H+](Cc1ccc(C)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575503 1136439077 /nfs/dbraw/zinc/43/90/77/1136439077.db2.gz RODRITJXFKKGNT-LJQANCHMSA-N 1 1 328.412 3.849 20 5 EHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585280 1136442610 /nfs/dbraw/zinc/44/26/10/1136442610.db2.gz SXEMQMUQDHNZJK-VVFCZOMOSA-N 1 1 344.386 3.645 20 5 EHBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000776579581 1136444594 /nfs/dbraw/zinc/44/45/94/1136444594.db2.gz NRNUGIQQOYBPDW-IFXJQAMLSA-N 1 1 344.411 3.720 20 5 EHBDMO CCC[N@H+](Cc1ccc(OC)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580008 1136444715 /nfs/dbraw/zinc/44/47/15/1136444715.db2.gz QLDZYKZRYACGCZ-IBGZPJMESA-N 1 1 344.411 3.549 20 5 EHBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592486 1136454094 /nfs/dbraw/zinc/45/40/94/1136454094.db2.gz OXCPKEBBPPXBKE-MOXGXCLJSA-N 1 1 340.423 3.581 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3ccco3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000853527442 1136541466 /nfs/dbraw/zinc/54/14/66/1136541466.db2.gz UGKBKYPDBDFCSD-UHFFFAOYSA-N 1 1 340.383 3.683 20 5 EHBDMO C[C@@H](OC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448826 1136596917 /nfs/dbraw/zinc/59/69/17/1136596917.db2.gz VGJNTCBBHHMVRF-RDTXWAMCSA-N 1 1 346.427 3.996 20 5 EHBDMO COC(OC)c1ccc(F)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000818201396 1136866210 /nfs/dbraw/zinc/86/62/10/1136866210.db2.gz VMYATCJCBCKGQQ-GFCCVEGCSA-N 1 1 348.374 3.876 20 5 EHBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093525 1137043908 /nfs/dbraw/zinc/04/39/08/1137043908.db2.gz CSSSCTKJTPVJBS-STQMWFEESA-N 1 1 337.420 3.501 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@](C)(O)c1ccccc1 ZINC000822516254 1137064087 /nfs/dbraw/zinc/06/40/87/1137064087.db2.gz JHXVENZBQQPACQ-QGZVFWFLSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@](C)(O)c1ccccc1 ZINC000822516253 1137064127 /nfs/dbraw/zinc/06/41/27/1137064127.db2.gz JHXVENZBQQPACQ-KRWDZBQOSA-N 1 1 334.803 3.588 20 5 EHBDMO C[N@H+]1CCCC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481997 1137146291 /nfs/dbraw/zinc/14/62/91/1137146291.db2.gz CFEWSYSUCVMEJH-NSHDSACASA-N 1 1 346.258 3.723 20 5 EHBDMO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC)c1OC ZINC000865758816 1137309172 /nfs/dbraw/zinc/30/91/72/1137309172.db2.gz OSKGCVJQOYPLOF-ZDUSSCGKSA-N 1 1 336.413 3.914 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2c(Cl)n(C)nc2C(C)C)cc1[N+](=O)[O-] ZINC000865787030 1137312068 /nfs/dbraw/zinc/31/20/68/1137312068.db2.gz YZIRUWPFCRCCPV-UHFFFAOYSA-N 1 1 336.823 3.703 20 5 EHBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000866290660 1137342949 /nfs/dbraw/zinc/34/29/49/1137342949.db2.gz WGGWFXZWRRGMRS-CYBMUJFWSA-N 1 1 337.439 3.517 20 5 EHBDMO Cn1cc([C@H]2C[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846932793 1137376126 /nfs/dbraw/zinc/37/61/26/1137376126.db2.gz UJDXWKRGWBLTDS-OAHLLOKOSA-N 1 1 348.834 3.607 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ccccc2[C@@H](C)C1 ZINC001171740830 1137511128 /nfs/dbraw/zinc/51/11/28/1137511128.db2.gz IIMQJDBWPTYHSA-AWEZNQCLSA-N 1 1 326.396 3.765 20 5 EHBDMO COc1ccc([C@H](CCO)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872042270 1137567274 /nfs/dbraw/zinc/56/72/74/1137567274.db2.gz AEJVGVKBXAIZBD-WBMJQRKESA-N 1 1 348.374 3.517 20 5 EHBDMO CC(C)Oc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000876943075 1137665833 /nfs/dbraw/zinc/66/58/33/1137665833.db2.gz AZQBDKLHHGMHDH-UHFFFAOYSA-N 1 1 341.367 3.813 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCCC[C@@H]2C2CCC2)o1 ZINC000878771858 1137727807 /nfs/dbraw/zinc/72/78/07/1137727807.db2.gz XXADHGIQHSROFB-OAHLLOKOSA-N 1 1 342.399 3.799 20 5 EHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066648 1137736877 /nfs/dbraw/zinc/73/68/77/1137736877.db2.gz QMBGXUOBVWUHQV-HSWBROFVSA-N 1 1 342.399 3.823 20 5 EHBDMO C[C@@H]1c2sccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376967 1137777130 /nfs/dbraw/zinc/77/71/30/1137777130.db2.gz NBDHJYBJCBLCOW-GFCCVEGCSA-N 1 1 345.424 3.604 20 5 EHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287538 1137900085 /nfs/dbraw/zinc/90/00/85/1137900085.db2.gz UUPQLSVEJGNSPO-PSASIEDQSA-N 1 1 329.278 3.509 20 5 EHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000348287538 1137900086 /nfs/dbraw/zinc/90/00/86/1137900086.db2.gz UUPQLSVEJGNSPO-PSASIEDQSA-N 1 1 329.278 3.509 20 5 EHBDMO C[C@@H](NC(=O)[C@H]1CCCC[N@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708411 1137917860 /nfs/dbraw/zinc/91/78/60/1137917860.db2.gz BWGDENVWHVUCBW-RDTXWAMCSA-N 1 1 345.443 3.569 20 5 EHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802680 1137960800 /nfs/dbraw/zinc/96/08/00/1137960800.db2.gz CWZZOVNBHGBCGR-MJGOQNOKSA-N 1 1 344.386 3.822 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)c1c(F)cccc1F)C1CC1 ZINC000135231639 1137964758 /nfs/dbraw/zinc/96/47/58/1137964758.db2.gz JPRXWEAXDIFHIF-KRWDZBQOSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1c(F)cccc1F)C1CC1 ZINC000135231639 1137964759 /nfs/dbraw/zinc/96/47/59/1137964759.db2.gz JPRXWEAXDIFHIF-KRWDZBQOSA-N 1 1 348.349 3.571 20 5 EHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000886048967 1138035074 /nfs/dbraw/zinc/03/50/74/1138035074.db2.gz BZUWHZFLPAMGBJ-CQSZACIVSA-N 1 1 338.367 3.511 20 5 EHBDMO COc1cc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])ccc1OC(C)C ZINC000886107423 1138047419 /nfs/dbraw/zinc/04/74/19/1138047419.db2.gz QZRJBQZXJBUVPC-ZDUSSCGKSA-N 1 1 345.399 3.636 20 5 EHBDMO CCOc1cccc2cc([C@H](C)[NH2+]Cc3cccnc3[N+](=O)[O-])oc21 ZINC000886127854 1138050094 /nfs/dbraw/zinc/05/00/94/1138050094.db2.gz VFUJYKDDWBKUHN-LBPRGKRZSA-N 1 1 341.367 3.986 20 5 EHBDMO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091413796 1138219420 /nfs/dbraw/zinc/21/94/20/1138219420.db2.gz UBSCZOBBSNQOFO-DIFFPNOSSA-N 1 1 336.338 3.911 20 5 EHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc([C@H]2CCCO2)s1 ZINC000283026490 1138879740 /nfs/dbraw/zinc/87/97/40/1138879740.db2.gz MPWDMRZLMLBJGG-MRXNPFEDSA-N 1 1 347.440 3.577 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000178729886 1139715269 /nfs/dbraw/zinc/71/52/69/1139715269.db2.gz QDOPWEJGIPEJSK-MRXNPFEDSA-N 1 1 328.368 3.607 20 5 EHBDMO CCc1nc(C)c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)s1 ZINC000178728258 1139715358 /nfs/dbraw/zinc/71/53/58/1139715358.db2.gz GXWSRMLKYITDBT-SNVBAGLBSA-N 1 1 335.429 3.782 20 5 EHBDMO CCOc1ccc([C@@H](C)[NH2+]C2CCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403445 1139832207 /nfs/dbraw/zinc/83/22/07/1139832207.db2.gz WLVXRACUKDAIRG-CQSZACIVSA-N 1 1 335.448 3.517 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(c2nccs2)CC1 ZINC000182693056 1139986851 /nfs/dbraw/zinc/98/68/51/1139986851.db2.gz DLINWJOSWTVKKN-CQSZACIVSA-N 1 1 346.456 3.633 20 5 EHBDMO COc1cc(F)c([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000183496300 1140042366 /nfs/dbraw/zinc/04/23/66/1140042366.db2.gz CKZXMZULOZMHTL-LBPRGKRZSA-N 1 1 348.374 3.910 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000184004013 1140073396 /nfs/dbraw/zinc/07/33/96/1140073396.db2.gz DHEDWPUIICLGAF-GFCCVEGCSA-N 1 1 335.429 3.686 20 5 EHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccnc(SCC)c1 ZINC000189590345 1140354097 /nfs/dbraw/zinc/35/40/97/1140354097.db2.gz DDRCTHPFLHFDSV-UHFFFAOYSA-N 1 1 347.440 3.790 20 5 EHBDMO C[C@H](c1cccc(NCc2ccccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000266989820 1140747413 /nfs/dbraw/zinc/74/74/13/1140747413.db2.gz TULFMXUEABDJEZ-OAHLLOKOSA-N 1 1 341.411 3.600 20 5 EHBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636330 1141129852 /nfs/dbraw/zinc/12/98/52/1141129852.db2.gz AOPCBQVRUAMYFF-PIGZYNQJSA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634846 1141129934 /nfs/dbraw/zinc/12/99/34/1141129934.db2.gz AFDRQEPHEWTHAP-DIFFPNOSSA-N 1 1 336.338 3.599 20 5 EHBDMO C[C@H](c1cc(F)ccc1F)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269634846 1141129936 /nfs/dbraw/zinc/12/99/36/1141129936.db2.gz AFDRQEPHEWTHAP-DIFFPNOSSA-N 1 1 336.338 3.599 20 5 EHBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1C(F)(F)F ZINC000270115626 1141181443 /nfs/dbraw/zinc/18/14/43/1141181443.db2.gz FQBLZPJCSCXVRW-SNVBAGLBSA-N 1 1 340.305 3.721 20 5 EHBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575520 1141521165 /nfs/dbraw/zinc/52/11/65/1141521165.db2.gz VOGCUFNGAHPJMZ-CMPLNLGQSA-N 1 1 344.358 3.825 20 5 EHBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051180361 214081517 /nfs/dbraw/zinc/08/15/17/214081517.db2.gz MLBKTIFDQIYMPD-KRWDZBQOSA-N 1 1 342.395 3.949 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000430193116 1014762166 /nfs/dbraw/zinc/76/21/66/1014762166.db2.gz FCXUWFCERMBEHA-HNNXBMFYSA-N 1 1 347.440 3.878 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000430193116 1014762176 /nfs/dbraw/zinc/76/21/76/1014762176.db2.gz FCXUWFCERMBEHA-HNNXBMFYSA-N 1 1 347.440 3.878 20 5 EHBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430203383 1014889147 /nfs/dbraw/zinc/88/91/47/1014889147.db2.gz FKTGMKOMHGGOGL-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430203383 1014889161 /nfs/dbraw/zinc/88/91/61/1014889161.db2.gz FKTGMKOMHGGOGL-UHFFFAOYSA-N 1 1 330.384 3.634 20 5 EHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000032801281 1015736058 /nfs/dbraw/zinc/73/60/58/1015736058.db2.gz VSOQYFKMUAAMKV-RYUDHWBXSA-N 1 1 347.802 3.926 20 5 EHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC001167707977 1016408330 /nfs/dbraw/zinc/40/83/30/1016408330.db2.gz IXFSSFGTNQFINF-SFHVURJKSA-N 1 1 340.427 3.642 20 5 EHBDMO CC1(C)C[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@@H]1O ZINC000275435429 1016771642 /nfs/dbraw/zinc/77/16/42/1016771642.db2.gz JPPADSZWJPZAOK-SFHVURJKSA-N 1 1 337.419 3.539 20 5 EHBDMO Cc1[nH]c(CSc2ccc(Br)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC000917162737 1122541887 /nfs/dbraw/zinc/54/18/87/1122541887.db2.gz CHNYJFGTYDNMOQ-UHFFFAOYSA-N 1 1 342.218 3.990 20 5 EHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cccc4nccn43)C2)cc1 ZINC000449497632 1032668059 /nfs/dbraw/zinc/66/80/59/1032668059.db2.gz ISNPWGZRWUEOGL-MRXNPFEDSA-N 1 1 336.395 3.622 20 5 EHBDMO COCc1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501944 1032677411 /nfs/dbraw/zinc/67/74/11/1032677411.db2.gz QNPANMIQKOLNCY-AWEZNQCLSA-N 1 1 347.440 3.577 20 5 EHBDMO COCc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501944 1032677418 /nfs/dbraw/zinc/67/74/18/1032677418.db2.gz QNPANMIQKOLNCY-AWEZNQCLSA-N 1 1 347.440 3.577 20 5 EHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593459077 1032703037 /nfs/dbraw/zinc/70/30/37/1032703037.db2.gz XDHNLGHACKTDQW-UHFFFAOYSA-N 1 1 342.443 3.700 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCC[N@H+]3C3CCCC3)n2)cc1 ZINC000275643007 1017874556 /nfs/dbraw/zinc/87/45/56/1017874556.db2.gz ORTIKRVOXRALMZ-OAHLLOKOSA-N 1 1 328.372 3.724 20 5 EHBDMO C[N@H+](Cc1ccc(O)cc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000290297697 1017887222 /nfs/dbraw/zinc/88/72/22/1017887222.db2.gz AXTINGVPQOFLEB-UHFFFAOYSA-N 1 1 338.310 3.534 20 5 EHBDMO C[N@@H+](Cc1ccc(O)cc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000290297697 1017887239 /nfs/dbraw/zinc/88/72/39/1017887239.db2.gz AXTINGVPQOFLEB-UHFFFAOYSA-N 1 1 338.310 3.534 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610433516 1019126587 /nfs/dbraw/zinc/12/65/87/1019126587.db2.gz PJCFFHQZCSWPFS-JXFKEZNVSA-N 1 1 339.439 3.862 20 5 EHBDMO Cc1cccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513392154 1019602356 /nfs/dbraw/zinc/60/23/56/1019602356.db2.gz LZKUJEVBFXHYIV-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cc1cccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513392154 1019602368 /nfs/dbraw/zinc/60/23/68/1019602368.db2.gz LZKUJEVBFXHYIV-UHFFFAOYSA-N 1 1 341.411 3.752 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513682549 1019934185 /nfs/dbraw/zinc/93/41/85/1019934185.db2.gz AJJWVZIJLZGJTO-SFHVURJKSA-N 1 1 342.443 3.978 20 5 EHBDMO CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449617287 1032903062 /nfs/dbraw/zinc/90/30/62/1032903062.db2.gz GRMHERDVTPMAIE-INIZCTEOSA-N 1 1 344.411 3.838 20 5 EHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138307 1020727751 /nfs/dbraw/zinc/72/77/51/1020727751.db2.gz XTNUSENHHZKUON-ZIAGYGMSSA-N 1 1 333.432 3.822 20 5 EHBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccccc1 ZINC000135226289 1020919261 /nfs/dbraw/zinc/91/92/61/1020919261.db2.gz HYJZXUOCVSRGLG-UHFFFAOYSA-N 1 1 339.395 3.588 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000084134082 1021005873 /nfs/dbraw/zinc/00/58/73/1021005873.db2.gz OCTBBUHPCZBUMF-MRXNPFEDSA-N 1 1 344.386 3.568 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000084134082 1021005880 /nfs/dbraw/zinc/00/58/80/1021005880.db2.gz OCTBBUHPCZBUMF-MRXNPFEDSA-N 1 1 344.386 3.568 20 5 EHBDMO CC(C)c1ccc(C[N@H+](CCO)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000426379428 1021418362 /nfs/dbraw/zinc/41/83/62/1021418362.db2.gz PWQMMVNQYNDZRJ-UHFFFAOYSA-N 1 1 346.402 3.852 20 5 EHBDMO CC(C)c1ccc(C[N@@H+](CCO)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000426379428 1021418369 /nfs/dbraw/zinc/41/83/69/1021418369.db2.gz PWQMMVNQYNDZRJ-UHFFFAOYSA-N 1 1 346.402 3.852 20 5 EHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)cs1 ZINC000054173458 1021520975 /nfs/dbraw/zinc/52/09/75/1021520975.db2.gz KJZJSKNSQUCYIV-KRWDZBQOSA-N 1 1 332.425 3.602 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000469470463 1021937537 /nfs/dbraw/zinc/93/75/37/1021937537.db2.gz KTFPNLUITSCKCE-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000469470463 1021937546 /nfs/dbraw/zinc/93/75/46/1021937546.db2.gz KTFPNLUITSCKCE-GFCCVEGCSA-N 1 1 348.349 3.871 20 5 EHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000441429212 1022533933 /nfs/dbraw/zinc/53/39/33/1022533933.db2.gz NQMMMCVNPUAKIZ-OAHLLOKOSA-N 1 1 344.411 3.545 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)[C@@H](C)O1 ZINC000438371685 1022615713 /nfs/dbraw/zinc/61/57/13/1022615713.db2.gz GSBWAKXEFRFKSM-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)[C@@H](C)O1 ZINC000438371685 1022615721 /nfs/dbraw/zinc/61/57/21/1022615721.db2.gz GSBWAKXEFRFKSM-MGPQQGTHSA-N 1 1 330.384 3.853 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3c3ccc(O)cc3)nc2c1 ZINC000610580947 1022787725 /nfs/dbraw/zinc/78/77/25/1022787725.db2.gz KFAOUFASUOLGTA-MRXNPFEDSA-N 1 1 339.351 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]3c3ccc(O)cc3)nc2c1 ZINC000610580947 1022787740 /nfs/dbraw/zinc/78/77/40/1022787740.db2.gz KFAOUFASUOLGTA-MRXNPFEDSA-N 1 1 339.351 3.779 20 5 EHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](C[C@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582759 1022824602 /nfs/dbraw/zinc/82/46/02/1022824602.db2.gz VSTDMEQYGZDITG-OAHLLOKOSA-N 1 1 345.399 3.660 20 5 EHBDMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000535799467 1023646299 /nfs/dbraw/zinc/64/62/99/1023646299.db2.gz QDNHRWUFFNRLCY-CABCVRRESA-N 1 1 342.443 3.863 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC=C(c4ccccc4)C3)nc2c1 ZINC000341994585 1023747364 /nfs/dbraw/zinc/74/73/64/1023747364.db2.gz QYWXECMRPVPYPQ-UHFFFAOYSA-N 1 1 334.379 3.760 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC=C(c4ccccc4)C3)nc2c1 ZINC000341994585 1023747369 /nfs/dbraw/zinc/74/73/69/1023747369.db2.gz QYWXECMRPVPYPQ-UHFFFAOYSA-N 1 1 334.379 3.760 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450381271 1024511918 /nfs/dbraw/zinc/51/19/18/1024511918.db2.gz ULDKJSBLZKZNHY-AWEZNQCLSA-N 1 1 328.416 3.533 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@H]21 ZINC000248454931 1024768959 /nfs/dbraw/zinc/76/89/59/1024768959.db2.gz ZOMHRVPJMGIDPC-UHOFOFEASA-N 1 1 342.399 3.655 20 5 EHBDMO C[C@H]1C[C@H](C[NH3+])CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371216 1024856802 /nfs/dbraw/zinc/85/68/02/1024856802.db2.gz LYFSNRFNLKWPGL-NWDGAFQWSA-N 1 1 349.818 3.677 20 5 EHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)CO1 ZINC000508042008 1024868262 /nfs/dbraw/zinc/86/82/62/1024868262.db2.gz QUYKRFXKIVUNQK-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)CO1 ZINC000508042008 1024868276 /nfs/dbraw/zinc/86/82/76/1024868276.db2.gz QUYKRFXKIVUNQK-QWHCGFSZSA-N 1 1 332.425 3.933 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425373054 1024901623 /nfs/dbraw/zinc/90/16/23/1024901623.db2.gz PGLCYOMVBYFQCY-GOSISDBHSA-N 1 1 330.428 3.684 20 5 EHBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310359403 1025131311 /nfs/dbraw/zinc/13/13/11/1025131311.db2.gz JMDZSCXHTSNBFJ-HNNXBMFYSA-N 1 1 329.375 3.668 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000053232645 1025193041 /nfs/dbraw/zinc/19/30/41/1025193041.db2.gz KYNJOTKUFOIWAG-IBGZPJMESA-N 1 1 326.396 3.776 20 5 EHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000896280837 1025314511 /nfs/dbraw/zinc/31/45/11/1025314511.db2.gz LVKSHYUTKPXXRP-UHFFFAOYSA-N 1 1 331.803 3.812 20 5 EHBDMO C[N@@H+](CCCOc1ccc(F)cc1)CCOc1cccc([N+](=O)[O-])c1 ZINC000521423277 1025372650 /nfs/dbraw/zinc/37/26/50/1025372650.db2.gz HZFIOAPDOURLCS-UHFFFAOYSA-N 1 1 348.374 3.514 20 5 EHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000551709686 1025420645 /nfs/dbraw/zinc/42/06/45/1025420645.db2.gz PKCKYUUBXHIVJQ-UHFFFAOYSA-N 1 1 332.322 3.768 20 5 EHBDMO CC[NH+](CC)[C@H](CNCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000521819155 1025706073 /nfs/dbraw/zinc/70/60/73/1025706073.db2.gz UHKHHWMBKMTBLC-FQEVSTJZSA-N 1 1 341.455 3.638 20 5 EHBDMO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c2cc([N+](=O)[O-])ccc2n1 ZINC000521847962 1025717565 /nfs/dbraw/zinc/71/75/65/1025717565.db2.gz CHPUTPHEIWYELX-GDBMZVCRSA-N 1 1 340.427 3.514 20 5 EHBDMO Cc1c(C[N@@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000425547439 1025720578 /nfs/dbraw/zinc/72/05/78/1025720578.db2.gz IDSSMKVMBIWGSC-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO Cc1c(C[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000425547439 1025720592 /nfs/dbraw/zinc/72/05/92/1025720592.db2.gz IDSSMKVMBIWGSC-QZTJIDSGSA-N 1 1 346.814 3.865 20 5 EHBDMO CC(C)C1CC[NH+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000444193040 1025907992 /nfs/dbraw/zinc/90/79/92/1025907992.db2.gz HOFNQMXCCNVLAT-UHFFFAOYSA-N 1 1 339.823 3.555 20 5 EHBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789394 1026044530 /nfs/dbraw/zinc/04/45/30/1026044530.db2.gz MCQOUCOXQPPUKP-LBTNJELSSA-N 1 1 344.411 3.836 20 5 EHBDMO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544356 1026092530 /nfs/dbraw/zinc/09/25/30/1026092530.db2.gz DYUHQBKSZYUJLL-WFASDCNBSA-N 1 1 342.399 3.796 20 5 EHBDMO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544356 1026092547 /nfs/dbraw/zinc/09/25/47/1026092547.db2.gz DYUHQBKSZYUJLL-WFASDCNBSA-N 1 1 342.399 3.796 20 5 EHBDMO COCCSCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550452 1026102144 /nfs/dbraw/zinc/10/21/44/1026102144.db2.gz RTLUEPSCFZWVPI-MRXNPFEDSA-N 1 1 338.473 3.544 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCN(c2ccccc2F)CC1 ZINC000582453525 1026309209 /nfs/dbraw/zinc/30/92/09/1026309209.db2.gz ONUCUVRPKHEFRU-UHFFFAOYSA-N 1 1 343.402 3.755 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000523010914 1026357292 /nfs/dbraw/zinc/35/72/92/1026357292.db2.gz ZSNBQSLSJYTZNR-OAHLLOKOSA-N 1 1 344.386 3.807 20 5 EHBDMO COc1cccc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354945 1026509765 /nfs/dbraw/zinc/50/97/65/1026509765.db2.gz SYEYGSMTLNSUBY-GOEBONIOSA-N 1 1 341.411 3.851 20 5 EHBDMO Cc1[nH+]ccn1-c1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cn1 ZINC000366571310 1027443422 /nfs/dbraw/zinc/44/34/22/1027443422.db2.gz GPMVXCOPUQWNGH-UHFFFAOYSA-N 1 1 343.774 3.749 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000783597400 1027627372 /nfs/dbraw/zinc/62/73/72/1027627372.db2.gz MRGYVHMMRDAZTI-CQSZACIVSA-N 1 1 331.803 3.708 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533429056 1027858568 /nfs/dbraw/zinc/85/85/68/1027858568.db2.gz BCMKPZMBCNLTSC-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533429056 1027858587 /nfs/dbraw/zinc/85/85/87/1027858587.db2.gz BCMKPZMBCNLTSC-NWDGAFQWSA-N 1 1 339.823 3.697 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420954831 1027922035 /nfs/dbraw/zinc/92/20/35/1027922035.db2.gz VMTXDZHAAKRYIR-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420954831 1027922048 /nfs/dbraw/zinc/92/20/48/1027922048.db2.gz VMTXDZHAAKRYIR-NSHDSACASA-N 1 1 332.322 3.768 20 5 EHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)cc1 ZINC000444587979 1028065088 /nfs/dbraw/zinc/06/50/88/1028065088.db2.gz BWBOLVGJPJLQEF-UHFFFAOYSA-N 1 1 340.383 3.502 20 5 EHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)cc1 ZINC000444587979 1028065107 /nfs/dbraw/zinc/06/51/07/1028065107.db2.gz BWBOLVGJPJLQEF-UHFFFAOYSA-N 1 1 340.383 3.502 20 5 EHBDMO Cc1ccc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000612403792 1028075396 /nfs/dbraw/zinc/07/53/96/1028075396.db2.gz 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CC[N@H+](C)[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000504261656 1028517445 /nfs/dbraw/zinc/51/74/45/1028517445.db2.gz YDYVDGQNKFWGJN-MRXNPFEDSA-N 1 1 338.367 3.686 20 5 EHBDMO CC[N@@H+](C)[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000504261656 1028517452 /nfs/dbraw/zinc/51/74/52/1028517452.db2.gz YDYVDGQNKFWGJN-MRXNPFEDSA-N 1 1 338.367 3.686 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613179300 1028578437 /nfs/dbraw/zinc/57/84/37/1028578437.db2.gz SLKYQLLHTDNKSB-DOTOQJQBSA-N 1 1 325.412 3.924 20 5 EHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000514892761 1029047743 /nfs/dbraw/zinc/04/77/43/1029047743.db2.gz BAPUVPWRCTZNCY-UONOGXRCSA-N 1 1 348.447 3.542 20 5 EHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC(F)F)cc1 ZINC000524425762 1029180895 /nfs/dbraw/zinc/18/08/95/1029180895.db2.gz SVEZVYPPBAHLMT-UHFFFAOYSA-N 1 1 336.338 3.871 20 5 EHBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 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YNGPCEUNNPKQLO-GOSISDBHSA-N 1 1 329.400 3.736 20 5 EHBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)ccc1[N+](=O)[O-] ZINC000537606440 1033950898 /nfs/dbraw/zinc/95/08/98/1033950898.db2.gz UBGKZCJWILNCEG-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(C)n2)ccc1[N+](=O)[O-] ZINC000537606440 1033950913 /nfs/dbraw/zinc/95/09/13/1033950913.db2.gz UBGKZCJWILNCEG-INIZCTEOSA-N 1 1 327.384 3.644 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754773 1033983543 /nfs/dbraw/zinc/98/35/43/1033983543.db2.gz BULVCDAIMWZLBJ-OLZOCXBDSA-N 1 1 348.378 3.777 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599570026 1034003926 /nfs/dbraw/zinc/00/39/26/1034003926.db2.gz SHGRIVHVLZJEJS-GOSISDBHSA-N 1 1 327.384 3.629 20 5 EHBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000599599244 1034034331 /nfs/dbraw/zinc/03/43/31/1034034331.db2.gz YMLUGOLERILNGC-UHFFFAOYSA-N 1 1 348.374 3.776 20 5 EHBDMO 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C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397378 1034279261 /nfs/dbraw/zinc/27/92/61/1034279261.db2.gz IVNIQRFEIFZRBQ-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO C[C@@H]1CCC[N@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CO)c1 ZINC000596634288 1034338996 /nfs/dbraw/zinc/33/89/96/1034338996.db2.gz IIXYFJAZHUAKRP-CQSZACIVSA-N 1 1 326.396 3.738 20 5 EHBDMO CCc1cc(CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)on1 ZINC000450495940 1034429775 /nfs/dbraw/zinc/42/97/75/1034429775.db2.gz CGPBTFRIVZFCNC-UHFFFAOYSA-N 1 1 329.400 3.742 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOc2ccc(O)cc2C1 ZINC000597232758 1034612663 /nfs/dbraw/zinc/61/26/63/1034612663.db2.gz WWWXWLHJKCQHDP-NTEUORMPSA-N 1 1 340.379 3.598 20 5 EHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCOc2ccc(O)cc2C1 ZINC000597232758 1034612673 /nfs/dbraw/zinc/61/26/73/1034612673.db2.gz WWWXWLHJKCQHDP-NTEUORMPSA-N 1 1 340.379 3.598 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCCc3n[nH]cc3C2)o1 ZINC000597259088 1034632015 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3.605 20 5 EHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2c(s1)CCCC2 ZINC000589184973 1036298051 /nfs/dbraw/zinc/29/80/51/1036298051.db2.gz HGIOBIMBOLESTK-UHFFFAOYSA-N 1 1 331.441 3.605 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](C(C)C)C1 ZINC000464768907 1036758870 /nfs/dbraw/zinc/75/88/70/1036758870.db2.gz CKODGWTZWSKJFR-QGZVFWFLSA-N 1 1 338.473 3.955 20 5 EHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C(C)C)C1 ZINC000464768907 1036758884 /nfs/dbraw/zinc/75/88/84/1036758884.db2.gz CKODGWTZWSKJFR-QGZVFWFLSA-N 1 1 338.473 3.955 20 5 EHBDMO Cc1cc(N[C@@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140314 1036786056 /nfs/dbraw/zinc/78/60/56/1036786056.db2.gz ZFYREXTUHVEOBS-SNVBAGLBSA-N 1 1 340.305 3.545 20 5 EHBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000026233084 1036837946 /nfs/dbraw/zinc/83/79/46/1036837946.db2.gz XBHVZMWIYTWYAC-QGZVFWFLSA-N 1 1 336.395 3.609 20 5 EHBDMO C[C@@H]1C[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233796 1036958217 /nfs/dbraw/zinc/95/82/17/1036958217.db2.gz UYHZXTBHFAACFG-XFQXTVEOSA-N 1 1 339.439 3.757 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000542049072 1037026991 /nfs/dbraw/zinc/02/69/91/1037026991.db2.gz QBNUFHDVKNYMBN-LESCRADOSA-N 1 1 345.443 3.742 20 5 EHBDMO CCOc1cccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000180695476 1037088710 /nfs/dbraw/zinc/08/87/10/1037088710.db2.gz ZZTSMQMNPMOAJW-LBPRGKRZSA-N 1 1 341.367 3.986 20 5 EHBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000465052460 1037089972 /nfs/dbraw/zinc/08/99/72/1037089972.db2.gz ITNDUCREBREZMK-LBPRGKRZSA-N 1 1 343.374 3.586 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000542252164 1037200997 /nfs/dbraw/zinc/20/09/97/1037200997.db2.gz VNWNGCSEMUGCLC-HNNXBMFYSA-N 1 1 331.416 3.520 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@H]43)o2)cc1 ZINC000539891303 1037313791 /nfs/dbraw/zinc/31/37/91/1037313791.db2.gz RUDYXGBYVIUFIZ-CRAIPNDOSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)o2)cc1 ZINC000539891305 1037314647 /nfs/dbraw/zinc/31/46/47/1037314647.db2.gz RUDYXGBYVIUFIZ-QAPCUYQASA-N 1 1 342.395 3.856 20 5 EHBDMO CC1(C)[C@H](O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000462871958 1037500782 /nfs/dbraw/zinc/50/07/82/1037500782.db2.gz RTAWQAVWLLEQSQ-MRXNPFEDSA-N 1 1 332.425 3.669 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC(C)(C)[NH+]1CCCCC1 ZINC000468638905 1037602455 /nfs/dbraw/zinc/60/24/55/1037602455.db2.gz CSASZBUGIGLMQI-VBKFSLOCSA-N 1 1 331.460 3.852 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000532571304 1037671502 /nfs/dbraw/zinc/67/15/02/1037671502.db2.gz LWZWJXVAISYVKV-ZFWWWQNUSA-N 1 1 333.432 3.742 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000592144489 1037862163 /nfs/dbraw/zinc/86/21/63/1037862163.db2.gz HNPILQIMBJLDIR-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccc(C)nc1)CC1CC1 ZINC000592144489 1037862178 /nfs/dbraw/zinc/86/21/78/1037862178.db2.gz HNPILQIMBJLDIR-UHFFFAOYSA-N 1 1 341.411 3.719 20 5 EHBDMO CC[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058452117 1037917855 /nfs/dbraw/zinc/91/78/55/1037917855.db2.gz OUVUTAFDCXTQLD-LBPRGKRZSA-N 1 1 344.358 3.969 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000341437178 1038295909 /nfs/dbraw/zinc/29/59/09/1038295909.db2.gz YONLYWZINBWXEK-UHFFFAOYSA-N 1 1 340.358 3.633 20 5 EHBDMO C[C@H]1C[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730127 1038497502 /nfs/dbraw/zinc/49/75/02/1038497502.db2.gz IGCPDLKCHAJVQI-LBPRGKRZSA-N 1 1 349.818 3.644 20 5 EHBDMO C[C@H]1CN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730127 1038497509 /nfs/dbraw/zinc/49/75/09/1038497509.db2.gz IGCPDLKCHAJVQI-LBPRGKRZSA-N 1 1 349.818 3.644 20 5 EHBDMO C[C@H]1CN(C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730127 1038497514 /nfs/dbraw/zinc/49/75/14/1038497514.db2.gz IGCPDLKCHAJVQI-LBPRGKRZSA-N 1 1 349.818 3.644 20 5 EHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCC[C@H]1O ZINC000538812484 1038548352 /nfs/dbraw/zinc/54/83/52/1038548352.db2.gz RSVXKRXWDSVLFW-CXAGYDPISA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1cccc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)c1[N+](=O)[O-] ZINC000378527090 1038700776 /nfs/dbraw/zinc/70/07/76/1038700776.db2.gz SNLZFRHCQRCHQO-UHFFFAOYSA-N 1 1 337.379 3.634 20 5 EHBDMO CC(C)(CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000026725626 1038818380 /nfs/dbraw/zinc/81/83/80/1038818380.db2.gz PYOLEDQSUJJXDV-UHFFFAOYSA-N 1 1 325.412 3.844 20 5 EHBDMO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1C ZINC000539380112 1038871324 /nfs/dbraw/zinc/87/13/24/1038871324.db2.gz GSARSZFONUJCRV-CQSZACIVSA-N 1 1 327.384 3.501 20 5 EHBDMO Cc1c(CN[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494831 1039483206 /nfs/dbraw/zinc/48/32/06/1039483206.db2.gz BEICKWFBVRKEGU-VQIMIIECSA-N 1 1 339.439 3.828 20 5 EHBDMO Cc1c(CN[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494831 1039483215 /nfs/dbraw/zinc/48/32/15/1039483215.db2.gz BEICKWFBVRKEGU-VQIMIIECSA-N 1 1 339.439 3.828 20 5 EHBDMO COc1cc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000485772919 1039526481 /nfs/dbraw/zinc/52/64/81/1039526481.db2.gz OAAIJRWMLUGSSP-QGZVFWFLSA-N 1 1 326.396 3.811 20 5 EHBDMO Cc1c(C[NH2+]Cc2c(F)cccc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000480450686 1039567667 /nfs/dbraw/zinc/56/76/67/1039567667.db2.gz BMFLIHBDPWXIQU-UHFFFAOYSA-N 1 1 343.402 3.932 20 5 EHBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000489093887 1039618071 /nfs/dbraw/zinc/61/80/71/1039618071.db2.gz HPBQPIAVJOVSPD-MRXNPFEDSA-N 1 1 326.396 3.901 20 5 EHBDMO CCc1ccc([C@@H]([NH2+][C@H]2CCCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000489954075 1040254412 /nfs/dbraw/zinc/25/44/12/1040254412.db2.gz DOLQZJKHPDBOGI-KSSFIOAISA-N 1 1 330.384 3.608 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000486805188 1040475027 /nfs/dbraw/zinc/47/50/27/1040475027.db2.gz YWIPFGDGGREUQI-HNNXBMFYSA-N 1 1 333.432 3.742 20 5 EHBDMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000433025968 1040490199 /nfs/dbraw/zinc/49/01/99/1040490199.db2.gz NJHPGRRHCAXDPG-AWEZNQCLSA-N 1 1 340.427 3.760 20 5 EHBDMO O=[N+]([O-])c1cccc(-c2nc(Cn3c[nH+]c4c3CCCC4)cs2)c1 ZINC000600178752 1040784300 /nfs/dbraw/zinc/78/43/00/1040784300.db2.gz FWQMHMQWAPADOB-UHFFFAOYSA-N 1 1 340.408 3.842 20 5 EHBDMO CC[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796933 1040835557 /nfs/dbraw/zinc/83/55/57/1040835557.db2.gz FAVHCOGAYRRVFF-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796933 1040835573 /nfs/dbraw/zinc/83/55/73/1040835573.db2.gz FAVHCOGAYRRVFF-CYBMUJFWSA-N 1 1 332.425 3.934 20 5 EHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000500425583 1041438186 /nfs/dbraw/zinc/43/81/86/1041438186.db2.gz UMTRTEUVERITSI-CQSZACIVSA-N 1 1 328.416 3.819 20 5 EHBDMO O=[N+]([O-])c1cccc2c(NC[C@@H]3CCCC[N@H+]3C3CC3)ccnc21 ZINC000432152549 1041653873 /nfs/dbraw/zinc/65/38/73/1041653873.db2.gz KBPCWMDEGNUOFR-AWEZNQCLSA-N 1 1 326.400 3.572 20 5 EHBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000511881141 1041847446 /nfs/dbraw/zinc/84/74/46/1041847446.db2.gz YVIVGZIVKGBHAZ-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000511881141 1041847452 /nfs/dbraw/zinc/84/74/52/1041847452.db2.gz YVIVGZIVKGBHAZ-XJKSGUPXSA-N 1 1 330.384 3.854 20 5 EHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000053778608 1041851184 /nfs/dbraw/zinc/85/11/84/1041851184.db2.gz IUGFEZCFLJOAFT-JTQLQIEISA-N 1 1 330.331 3.579 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000053814012 1042544621 /nfs/dbraw/zinc/54/46/21/1042544621.db2.gz DFFTYZCORJQFRZ-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](C)c1cccs1 ZINC000053814012 1042544623 /nfs/dbraw/zinc/54/46/23/1042544623.db2.gz DFFTYZCORJQFRZ-GFCCVEGCSA-N 1 1 333.413 3.596 20 5 EHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000344030521 1043125328 /nfs/dbraw/zinc/12/53/28/1043125328.db2.gz BUJRFLLTAWBUPM-KGLIPLIRSA-N 1 1 342.399 3.994 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000182061900 1043258468 /nfs/dbraw/zinc/25/84/68/1043258468.db2.gz RSXJWXFSOCAVIX-MRXNPFEDSA-N 1 1 346.358 3.746 20 5 EHBDMO CC(C)COC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182077519 1043399203 /nfs/dbraw/zinc/39/92/03/1043399203.db2.gz XMEZZMLOZITUDJ-UHFFFAOYSA-N 1 1 326.824 3.885 20 5 EHBDMO Cn1cnc2cc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)ccc21 ZINC000342682118 1043716981 /nfs/dbraw/zinc/71/69/81/1043716981.db2.gz VPNMSQMOCZYWHF-UHFFFAOYSA-N 1 1 336.395 3.646 20 5 EHBDMO CC(C)[N@H+](C)C[C@@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000572083610 1043892340 /nfs/dbraw/zinc/89/23/40/1043892340.db2.gz POSZPILMHMIOPM-CQSZACIVSA-N 1 1 331.416 3.673 20 5 EHBDMO CC(C)N(C)C[C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000572083610 1043892361 /nfs/dbraw/zinc/89/23/61/1043892361.db2.gz POSZPILMHMIOPM-CQSZACIVSA-N 1 1 331.416 3.673 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000512212893 1044173863 /nfs/dbraw/zinc/17/38/63/1044173863.db2.gz MFSWSWYNDNOWLH-IBGZPJMESA-N 1 1 343.427 3.664 20 5 EHBDMO O=[N+]([O-])c1ccc(CNC[C@H](c2ccco2)[NH+]2CCCC2)c(Cl)c1 ZINC000183383794 1125549795 /nfs/dbraw/zinc/54/97/95/1125549795.db2.gz MPEBUPLQKHZRRO-MRXNPFEDSA-N 1 1 349.818 3.768 20 5 EHBDMO Cc1nn(C[N@H+]2CC[C@@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946921 1127558192 /nfs/dbraw/zinc/55/81/92/1127558192.db2.gz YVCKSHGHAKJKHG-MRXNPFEDSA-N 1 1 336.395 3.700 20 5 EHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302454 1127735538 /nfs/dbraw/zinc/73/55/38/1127735538.db2.gz VWTSCTYGMWVORQ-GJZGRUSLSA-N 1 1 335.423 3.825 20 5 EHBDMO CCC[N@H+]1CCC[C@H]1CN[C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336578 1127750321 /nfs/dbraw/zinc/75/03/21/1127750321.db2.gz FYIQYYADWXGVFM-HOCLYGCPSA-N 1 1 335.448 3.519 20 5 EHBDMO CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336578 1127750326 /nfs/dbraw/zinc/75/03/26/1127750326.db2.gz FYIQYYADWXGVFM-HOCLYGCPSA-N 1 1 335.448 3.519 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000007929585 1127757110 /nfs/dbraw/zinc/75/71/10/1127757110.db2.gz QTPLIBWRTQRXHL-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)Cc1ccc(Cl)cc1 ZINC000007929585 1127757112 /nfs/dbraw/zinc/75/71/12/1127757112.db2.gz QTPLIBWRTQRXHL-UHFFFAOYSA-N 1 1 347.802 3.627 20 5 EHBDMO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000301602884 1128519801 /nfs/dbraw/zinc/51/98/01/1128519801.db2.gz WQSNJLKTWAHSHV-MAUKXSAKSA-N 1 1 340.427 3.621 20 5 EHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(C)ccc1OC ZINC000172580841 1128651851 /nfs/dbraw/zinc/65/18/51/1128651851.db2.gz YOZVJAPGKLRMMP-ZDUSSCGKSA-N 1 1 330.384 3.771 20 5 EHBDMO C[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819743 1128661198 /nfs/dbraw/zinc/66/11/98/1128661198.db2.gz AQBUEXDDIUHGNW-ZFWWWQNUSA-N 1 1 346.452 3.916 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)C1CCCCC1 ZINC000554839629 1128712641 /nfs/dbraw/zinc/71/26/41/1128712641.db2.gz KHKKFINUKZPARO-CQSZACIVSA-N 1 1 333.432 3.742 20 5 EHBDMO Cn1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C2CCCC2)n1 ZINC000921834994 1128797900 /nfs/dbraw/zinc/79/79/00/1128797900.db2.gz KYEXIDLFRUTGBY-UHFFFAOYSA-N 1 1 348.834 3.929 20 5 EHBDMO Cc1ccc2[nH]c3c(c2c1)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC3 ZINC000609195911 1120548634 /nfs/dbraw/zinc/54/86/34/1120548634.db2.gz KPYRCLIEBSNMIL-UHFFFAOYSA-N 1 1 335.407 3.985 20 5 EHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCSc1ccc(Cl)cc1)CC2 ZINC000542550684 1121098841 /nfs/dbraw/zinc/09/88/41/1121098841.db2.gz MPRNETVFPRUQBW-UHFFFAOYSA-N 1 1 349.843 3.794 20 5 EHBDMO O=[N+]([O-])c1ccccc1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000311001846 1128975482 /nfs/dbraw/zinc/97/54/82/1128975482.db2.gz INDGZJRTCYIUPE-ROUUACIJSA-N 1 1 337.423 3.553 20 5 EHBDMO COC(=O)c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)oc1C ZINC000193507657 1121371240 /nfs/dbraw/zinc/37/12/40/1121371240.db2.gz NNADSIGPLBNBRF-UHFFFAOYSA-N 1 1 346.383 3.693 20 5 EHBDMO COC(=O)c1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)oc1C ZINC000193507657 1121371249 /nfs/dbraw/zinc/37/12/49/1121371249.db2.gz NNADSIGPLBNBRF-UHFFFAOYSA-N 1 1 346.383 3.693 20 5 EHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCCC1 ZINC000027286590 1121625332 /nfs/dbraw/zinc/62/53/32/1121625332.db2.gz JLHORVIROYFEPP-UHFFFAOYSA-N 1 1 349.431 3.587 20 5 EHBDMO Cn1ccnc1[C@@H]([NH2+]CCSC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272484930 1121661815 /nfs/dbraw/zinc/66/18/15/1121661815.db2.gz CSEOGDWYYDBDHJ-HNNXBMFYSA-N 1 1 348.472 3.539 20 5 EHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H]1CCOC1 ZINC000132016194 1129032536 /nfs/dbraw/zinc/03/25/36/1129032536.db2.gz VUSPUBYAVLKADS-LBPRGKRZSA-N 1 1 336.775 3.729 20 5 EHBDMO CC(C)[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176369 1122356907 /nfs/dbraw/zinc/35/69/07/1122356907.db2.gz AJDHYCUBDAYEHU-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176369 1122356911 /nfs/dbraw/zinc/35/69/11/1122356911.db2.gz AJDHYCUBDAYEHU-GOSISDBHSA-N 1 1 330.384 3.712 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc4[nH]cnc4c3)C2)cc1 ZINC000556165306 1122853201 /nfs/dbraw/zinc/85/32/01/1122853201.db2.gz MGRSVIYHPIHTCP-INIZCTEOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccc4nc[nH]c4c3)C2)cc1 ZINC000556165306 1122853203 /nfs/dbraw/zinc/85/32/03/1122853203.db2.gz MGRSVIYHPIHTCP-INIZCTEOSA-N 1 1 336.395 3.851 20 5 EHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc4nc[nH]c4c3)C2)cc1 ZINC000556165306 1122853204 /nfs/dbraw/zinc/85/32/04/1122853204.db2.gz MGRSVIYHPIHTCP-INIZCTEOSA-N 1 1 336.395 3.851 20 5 EHBDMO C[C@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131957 1123165580 /nfs/dbraw/zinc/16/55/80/1123165580.db2.gz BTHPXNWILXEPAA-FUHWJXTLSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131957 1123165583 /nfs/dbraw/zinc/16/55/83/1123165583.db2.gz BTHPXNWILXEPAA-FUHWJXTLSA-N 1 1 339.439 3.768 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000609354281 1123553693 /nfs/dbraw/zinc/55/36/93/1123553693.db2.gz NLXOCADLNIOGCH-OKILXGFUSA-N 1 1 328.416 3.818 20 5 EHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000609631772 1123634703 /nfs/dbraw/zinc/63/47/03/1123634703.db2.gz WFDQFRPVCDOBBW-IMJJTQAJSA-N 1 1 345.443 3.742 20 5 EHBDMO C[C@@H]1c2ccc(F)cc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610003990 1123711323 /nfs/dbraw/zinc/71/13/23/1123711323.db2.gz WXJLZTDKVMKZEJ-CYBMUJFWSA-N 1 1 330.359 3.732 20 5 EHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1Cc1ccccc1[N+](=O)[O-] ZINC000610133868 1123738993 /nfs/dbraw/zinc/73/89/93/1123738993.db2.gz BFANPTYLBITACB-KRWDZBQOSA-N 1 1 339.439 3.691 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000114468435 1129149300 /nfs/dbraw/zinc/14/93/00/1129149300.db2.gz KQZJQEWFKBTXGV-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000114468435 1129149304 /nfs/dbraw/zinc/14/93/04/1129149304.db2.gz KQZJQEWFKBTXGV-GOSISDBHSA-N 1 1 344.386 3.606 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000735490889 1131348083 /nfs/dbraw/zinc/34/80/83/1131348083.db2.gz UEJSFMPFARXPEC-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000735490889 1131348089 /nfs/dbraw/zinc/34/80/89/1131348089.db2.gz UEJSFMPFARXPEC-ZDUSSCGKSA-N 1 1 346.818 3.726 20 5 EHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569531 1125363781 /nfs/dbraw/zinc/36/37/81/1125363781.db2.gz FMHJDRJJZXLORY-OAOYMFHYSA-N 1 1 332.444 3.746 20 5 EHBDMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000069063747 1129419774 /nfs/dbraw/zinc/41/97/74/1129419774.db2.gz GXZHICVHUDNBNK-NEPJUHHUSA-N 1 1 347.802 3.926 20 5 EHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000093387553 1129586666 /nfs/dbraw/zinc/58/66/66/1129586666.db2.gz BIQNSRBUGIDAHR-FKIZTMCRSA-N 1 1 338.407 3.590 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000281116675 1129703543 /nfs/dbraw/zinc/70/35/43/1129703543.db2.gz XFGUYLVWYCAWSQ-JQHSSLGASA-N 1 1 336.407 3.640 20 5 EHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000281116678 1129703572 /nfs/dbraw/zinc/70/35/72/1129703572.db2.gz XFGUYLVWYCAWSQ-KBAYOESNSA-N 1 1 336.407 3.640 20 5 EHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000157327483 1129758176 /nfs/dbraw/zinc/75/81/76/1129758176.db2.gz PLUVQNUSPDYSNX-CQSZACIVSA-N 1 1 330.388 3.799 20 5 EHBDMO C[N@@H+](CCCNc1ncc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000303091791 1129816175 /nfs/dbraw/zinc/81/61/75/1129816175.db2.gz DWXFICJPQCRAJJ-UHFFFAOYSA-N 1 1 334.807 3.577 20 5 EHBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCCC1 ZINC000039536604 1130139710 /nfs/dbraw/zinc/13/97/10/1130139710.db2.gz RWXBYVLXUSYLOY-UHFFFAOYSA-N 1 1 339.823 3.841 20 5 EHBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892952 1130857737 /nfs/dbraw/zinc/85/77/37/1130857737.db2.gz LDMRXZVQNJNGRD-GUXCAODWSA-N 1 1 340.423 3.988 20 5 EHBDMO CO[C@@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(F)(F)F ZINC000733329167 1131027092 /nfs/dbraw/zinc/02/70/92/1131027092.db2.gz OHMLVECNFBYPHR-AWEZNQCLSA-N 1 1 344.289 3.522 20 5 EHBDMO CCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000740881777 1131552570 /nfs/dbraw/zinc/55/25/70/1131552570.db2.gz CWSQXBYFLXWXKI-DJIMGWMZSA-N 1 1 336.407 3.759 20 5 EHBDMO CC1(C)CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000741804244 1131652815 /nfs/dbraw/zinc/65/28/15/1131652815.db2.gz FRZCHIZZCZKSAT-UHFFFAOYSA-N 1 1 339.823 3.699 20 5 EHBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000742420127 1131722234 /nfs/dbraw/zinc/72/22/34/1131722234.db2.gz ZGHRLRWKKKDEEM-GFCCVEGCSA-N 1 1 334.445 3.515 20 5 EHBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905336 1131886745 /nfs/dbraw/zinc/88/67/45/1131886745.db2.gz RFKALELCSMBZLM-ZBFHGGJFSA-N 1 1 342.361 3.911 20 5 EHBDMO O=C1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@H]12 ZINC001172908402 1131888146 /nfs/dbraw/zinc/88/81/46/1131888146.db2.gz MDOITLZGSHBJDY-NEWSRXKRSA-N 1 1 342.439 3.676 20 5 EHBDMO CC[C@@H](C)[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011932 1131935643 /nfs/dbraw/zinc/93/56/43/1131935643.db2.gz AYZLGINLTQGOJA-LLVKDONJSA-N 1 1 327.375 3.572 20 5 EHBDMO C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(C)(C)C ZINC001173012643 1131936231 /nfs/dbraw/zinc/93/62/31/1131936231.db2.gz HYNBOJIFEZUMIK-UHFFFAOYSA-N 1 1 327.375 3.572 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@@H+]1CCC[C@@H](C)C1 ZINC001177474816 1133066374 /nfs/dbraw/zinc/06/63/74/1133066374.db2.gz HCKJYVKLBDDKOT-ZTUONRJZSA-N 1 1 331.460 3.708 20 5 EHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001177474816 1133066381 /nfs/dbraw/zinc/06/63/81/1133066381.db2.gz HCKJYVKLBDDKOT-ZTUONRJZSA-N 1 1 331.460 3.708 20 5 EHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209610 1133107923 /nfs/dbraw/zinc/10/79/23/1133107923.db2.gz SFNKWSYRDFLPRO-OAHLLOKOSA-N 1 1 327.428 3.849 20 5 EHBDMO Cc1c(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cccc1[N+](=O)[O-] ZINC000768543567 1133158199 /nfs/dbraw/zinc/15/81/99/1133158199.db2.gz AUHSTAFJWAITSJ-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO Cc1c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cccc1[N+](=O)[O-] ZINC000768543567 1133158203 /nfs/dbraw/zinc/15/82/03/1133158203.db2.gz AUHSTAFJWAITSJ-UHFFFAOYSA-N 1 1 341.367 3.976 20 5 EHBDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769402990 1133277567 /nfs/dbraw/zinc/27/75/67/1133277567.db2.gz GEZAAXMJSYDNEU-GOSISDBHSA-N 1 1 332.447 3.951 20 5 EHBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000769853826 1133351255 /nfs/dbraw/zinc/35/12/55/1133351255.db2.gz KEEWQWGWRLNFBI-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO C[N@H+](Cc1cc(Cl)ccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000769853826 1133351262 /nfs/dbraw/zinc/35/12/62/1133351262.db2.gz KEEWQWGWRLNFBI-INIZCTEOSA-N 1 1 338.766 3.553 20 5 EHBDMO Cc1nn(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)c(C)c1[N+](=O)[O-] ZINC000774638781 1133813543 /nfs/dbraw/zinc/81/35/43/1133813543.db2.gz WBGCLVMICDJQGR-UHFFFAOYSA-N 1 1 348.834 3.899 20 5 EHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC001184252510 1133915965 /nfs/dbraw/zinc/91/59/65/1133915965.db2.gz QEIBLZXQABJSQE-SJORKVTESA-N 1 1 332.444 3.850 20 5 EHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)cc1F ZINC000788481763 1134130105 /nfs/dbraw/zinc/13/01/05/1134130105.db2.gz TYDIKUVRVPTQAK-UHFFFAOYSA-N 1 1 348.349 3.916 20 5 EHBDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788566211 1134145269 /nfs/dbraw/zinc/14/52/69/1134145269.db2.gz ZDDHYDRRLIPUHL-ZDUSSCGKSA-N 1 1 344.415 3.602 20 5 EHBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789457006 1134278105 /nfs/dbraw/zinc/27/81/05/1134278105.db2.gz PZYVNJZTYSWLJK-KRWDZBQOSA-N 1 1 348.830 3.938 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC(F)(F)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329843 1134749833 /nfs/dbraw/zinc/74/98/33/1134749833.db2.gz VRCMLUXFOADKFF-VXGBXAGGSA-N 1 1 328.359 3.512 20 5 EHBDMO COc1ccc(C[C@@H](C)[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334091 1134751389 /nfs/dbraw/zinc/75/13/89/1134751389.db2.gz BDHZDVCKBOOIAA-KYOSRNDESA-N 1 1 340.370 3.512 20 5 EHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069299 1134786347 /nfs/dbraw/zinc/78/63/47/1134786347.db2.gz GLVOZPMMMNVWSN-NEPJUHHUSA-N 1 1 339.823 3.697 20 5 EHBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202043 1134814770 /nfs/dbraw/zinc/81/47/70/1134814770.db2.gz DVWWPENSWUUDDL-GDBMZVCRSA-N 1 1 326.824 3.884 20 5 EHBDMO COc1ccc(C[C@@H]2CC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001191498683 1134883161 /nfs/dbraw/zinc/88/31/61/1134883161.db2.gz YXEPVEHIUCWDGT-INIZCTEOSA-N 1 1 330.359 3.560 20 5 EHBDMO COc1ccc(C[C@@H]2CC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001191498683 1134883167 /nfs/dbraw/zinc/88/31/67/1134883167.db2.gz YXEPVEHIUCWDGT-INIZCTEOSA-N 1 1 330.359 3.560 20 5 EHBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834346 1135332390 /nfs/dbraw/zinc/33/23/90/1135332390.db2.gz FWOAMEDKWYVDSD-ZWKOTPCHSA-N 1 1 344.411 3.720 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCSC[C@H]2C2CCC2)c1 ZINC001195315920 1135413015 /nfs/dbraw/zinc/41/30/15/1135413015.db2.gz VHGMJUWODKBFQC-HNNXBMFYSA-N 1 1 326.849 3.966 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC[C@H]2C2CCC2)c1 ZINC001195315920 1135413017 /nfs/dbraw/zinc/41/30/17/1135413017.db2.gz VHGMJUWODKBFQC-HNNXBMFYSA-N 1 1 326.849 3.966 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](C4CCCCC4)C3)nc2c1 ZINC001195892631 1135481800 /nfs/dbraw/zinc/48/18/00/1135481800.db2.gz IKLZXVHIBXXBDI-AWEZNQCLSA-N 1 1 328.416 3.873 20 5 EHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC[C@H](O)c1ccccc1)C1CC1 ZINC000808740904 1135734391 /nfs/dbraw/zinc/73/43/91/1135734391.db2.gz RMTMTOLBRVOGEL-IBGZPJMESA-N 1 1 326.396 3.683 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000808790651 1135738023 /nfs/dbraw/zinc/73/80/23/1135738023.db2.gz XDFUYPOKPFXCOX-XEZPLFJOSA-N 1 1 349.431 3.643 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]1C ZINC000808790651 1135738026 /nfs/dbraw/zinc/73/80/26/1135738026.db2.gz XDFUYPOKPFXCOX-XEZPLFJOSA-N 1 1 349.431 3.643 20 5 EHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563865 1135831196 /nfs/dbraw/zinc/83/11/96/1135831196.db2.gz TXPOPYPMTOLTCL-CABCVRRESA-N 1 1 338.835 3.887 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000809954148 1135906131 /nfs/dbraw/zinc/90/61/31/1135906131.db2.gz QHUDKABSEGTORW-IINYFYTJSA-N 1 1 345.226 3.903 20 5 EHBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000809954148 1135906133 /nfs/dbraw/zinc/90/61/33/1135906133.db2.gz QHUDKABSEGTORW-IINYFYTJSA-N 1 1 345.226 3.903 20 5 EHBDMO CC(C)(C)c1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810847385 1136014389 /nfs/dbraw/zinc/01/43/89/1136014389.db2.gz OHCIFOMJJGDRAO-LSDHHAIUSA-N 1 1 346.427 3.676 20 5 EHBDMO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000851791486 1136407736 /nfs/dbraw/zinc/40/77/36/1136407736.db2.gz BZBMFAYHEFXLBV-GOSISDBHSA-N 1 1 332.375 3.598 20 5 EHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585580 1136448200 /nfs/dbraw/zinc/44/82/00/1136448200.db2.gz XDJNZWMDQFOBOV-WOJBJXKFSA-N 1 1 340.423 3.644 20 5 EHBDMO C[N@H+](Cc1cc2ccccc2o1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590375 1136453173 /nfs/dbraw/zinc/45/31/73/1136453173.db2.gz DCCSQKBBFMACOP-QGZVFWFLSA-N 1 1 326.352 3.506 20 5 EHBDMO CC(C)Oc1cccc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776592920 1136453620 /nfs/dbraw/zinc/45/36/20/1136453620.db2.gz CTCZAAZTWCOHGM-LJQANCHMSA-N 1 1 344.411 3.547 20 5 EHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4C[C@@H](c5ccccc5)[C@@H]4C3)nc2c1 ZINC000859928677 1137037329 /nfs/dbraw/zinc/03/73/29/1137037329.db2.gz NVTNRZAUNXJRRL-BHYGNILZSA-N 1 1 348.406 3.707 20 5 EHBDMO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000859997056 1137039968 /nfs/dbraw/zinc/03/99/68/1137039968.db2.gz NGODIDJKZXHLHE-UHFFFAOYSA-N 1 1 345.418 3.818 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823606946 1137106575 /nfs/dbraw/zinc/10/65/75/1137106575.db2.gz XTVZZIRTUBBQCD-HNAYVOBHSA-N 1 1 328.412 3.804 20 5 EHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl ZINC000824696980 1137147224 /nfs/dbraw/zinc/14/72/24/1137147224.db2.gz WUUHAZPOHMBJTC-YSVLISHTSA-N 1 1 338.835 3.764 20 5 EHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1 ZINC000824696058 1137148704 /nfs/dbraw/zinc/14/87/04/1137148704.db2.gz GWWMZPCYPOIPOE-USXIJHARSA-N 1 1 338.835 3.764 20 5 EHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)c2ccc(F)cc2)c1 ZINC000844308422 1137208679 /nfs/dbraw/zinc/20/86/79/1137208679.db2.gz YLCOQFFXPBTWOI-UHFFFAOYSA-N 1 1 346.358 3.545 20 5 EHBDMO C[C@H](CSc1ccccc1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362094 1137215283 /nfs/dbraw/zinc/21/52/83/1137215283.db2.gz XSEZFLYHLCEVTM-RDTXWAMCSA-N 1 1 346.452 3.741 20 5 EHBDMO Cc1nn(C[N@@H+](CC2CC2)CC2CCC2)c2cc([N+](=O)[O-])ccc12 ZINC000794715741 1137243114 /nfs/dbraw/zinc/24/31/14/1137243114.db2.gz XADYESUQJKOCNN-UHFFFAOYSA-N 1 1 328.416 3.723 20 5 EHBDMO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC)c1OC ZINC000865758815 1137308924 /nfs/dbraw/zinc/30/89/24/1137308924.db2.gz OSKGCVJQOYPLOF-CYBMUJFWSA-N 1 1 336.413 3.914 20 5 EHBDMO Cc1ccc(C[NH2+]Cc2cnc([C@H]3CCCO3)s2)cc1[N+](=O)[O-] ZINC000865787716 1137311934 /nfs/dbraw/zinc/31/19/34/1137311934.db2.gz RPTSKGUNIGGQSQ-OAHLLOKOSA-N 1 1 333.413 3.501 20 5 EHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171227666 1137353904 /nfs/dbraw/zinc/35/39/04/1137353904.db2.gz ANIDFVWVHQMOPH-CQSZACIVSA-N 1 1 333.432 3.600 20 5 EHBDMO C[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1ccns1 ZINC000715994607 1137479152 /nfs/dbraw/zinc/47/91/52/1137479152.db2.gz POVBRZCRSPYHLF-QMMMGPOBSA-N 1 1 342.218 3.665 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1N(C)C ZINC000872024044 1137565530 /nfs/dbraw/zinc/56/55/30/1137565530.db2.gz XPHUKGNAXVTAKF-LBPRGKRZSA-N 1 1 346.456 3.629 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1cc(C)[nH]n1 ZINC000872049627 1137567787 /nfs/dbraw/zinc/56/77/87/1137567787.db2.gz UHWNETMYKFWAGM-PWSUYJOCSA-N 1 1 334.445 3.630 20 5 EHBDMO C[C@H](NCC1CC[NH+](CC2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089334 1137570713 /nfs/dbraw/zinc/57/07/13/1137570713.db2.gz XDIIKMRXMWGHAT-ZDUSSCGKSA-N 1 1 335.423 3.507 20 5 EHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1nccnc1C ZINC000872130587 1137573092 /nfs/dbraw/zinc/57/30/92/1137573092.db2.gz JJYSPIPFTJLSJZ-CMPLNLGQSA-N 1 1 332.429 3.827 20 5 EHBDMO CC(C)(O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000877796723 1137690211 /nfs/dbraw/zinc/69/02/11/1137690211.db2.gz KTEXTLABFYQGKB-OAHLLOKOSA-N 1 1 344.411 3.838 20 5 EHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966238 1137697426 /nfs/dbraw/zinc/69/74/26/1137697426.db2.gz DXQYDBVYFMXNAO-CHWSQXEVSA-N 1 1 330.388 3.655 20 5 EHBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)C1 ZINC000878403668 1137714588 /nfs/dbraw/zinc/71/45/88/1137714588.db2.gz DSGFYWZZABGBCX-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1(C)C ZINC000878432927 1137715730 /nfs/dbraw/zinc/71/57/30/1137715730.db2.gz MNLGRBWALMVLAF-LBPRGKRZSA-N 1 1 330.388 3.513 20 5 EHBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC(C)(C)C1 ZINC000878541794 1137719544 /nfs/dbraw/zinc/71/95/44/1137719544.db2.gz UATMRUCJMXKSDR-GFCCVEGCSA-N 1 1 330.388 3.655 20 5 EHBDMO CC[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(OC)c1OC ZINC000879464423 1137748470 /nfs/dbraw/zinc/74/84/70/1137748470.db2.gz KNPPBLKDUCHYPV-HNNXBMFYSA-N 1 1 348.374 3.992 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879497580 1137749285 /nfs/dbraw/zinc/74/92/85/1137749285.db2.gz CSCUYTHNNQNJOS-KBXCAEBGSA-N 1 1 338.411 3.535 20 5 EHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879497580 1137749286 /nfs/dbraw/zinc/74/92/86/1137749286.db2.gz CSCUYTHNNQNJOS-KBXCAEBGSA-N 1 1 338.411 3.535 20 5 EHBDMO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000879681590 1137755266 /nfs/dbraw/zinc/75/52/66/1137755266.db2.gz YDHYRZFSZVQUKM-MQVJKMGUSA-N 1 1 342.399 3.505 20 5 EHBDMO Cc1occc1C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104676531 1137879129 /nfs/dbraw/zinc/87/91/29/1137879129.db2.gz BJMNGDJDCJOEHF-UHFFFAOYSA-N 1 1 341.367 3.826 20 5 EHBDMO C[N@H+](Cc1cccc2ccccc21)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136954677 1138044166 /nfs/dbraw/zinc/04/41/66/1138044166.db2.gz MGOMJPBEDNMVDL-HXUWFJFHSA-N 1 1 336.391 3.913 20 5 EHBDMO CC(C)(C)N1CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000089512897 1138200562 /nfs/dbraw/zinc/20/05/62/1138200562.db2.gz FSLOGTBHGSZDAU-GOSISDBHSA-N 1 1 345.487 3.768 20 5 EHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](C[C@H]3CCOC3)C3CC3)o2)cc1 ZINC000129948774 1138428866 /nfs/dbraw/zinc/42/88/66/1138428866.db2.gz MSNIXDCYKRBHOV-CQSZACIVSA-N 1 1 342.395 3.856 20 5 EHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)o1 ZINC000129968465 1138429853 /nfs/dbraw/zinc/42/98/53/1138429853.db2.gz ZSBFLRMHAIXUDB-CQSZACIVSA-N 1 1 342.395 3.856 20 5 EHBDMO COc1ccc(C[NH2+]C2(c3nc(C)cs3)CCC2)cc1[N+](=O)[O-] ZINC000264332007 1138479094 /nfs/dbraw/zinc/47/90/94/1138479094.db2.gz KWAYSQNUUWDRRM-UHFFFAOYSA-N 1 1 333.413 3.537 20 5 EHBDMO Cc1[nH+]ccn1CCCNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000337805328 1138672345 /nfs/dbraw/zinc/67/23/45/1138672345.db2.gz KFIWXPABBNARHC-UHFFFAOYSA-N 1 1 329.187 3.909 20 5 EHBDMO CCC1(CC)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000268053868 1140873970 /nfs/dbraw/zinc/87/39/70/1140873970.db2.gz WVZSHDSXBKSXNZ-UHFFFAOYSA-N 1 1 330.388 3.657 20 5 EHBDMO Cc1c(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309592 1140918916 /nfs/dbraw/zinc/91/89/16/1140918916.db2.gz XAKOPLIAXABHPX-DOTOQJQBSA-N 1 1 330.384 3.584 20 5 EHBDMO CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000268849019 1141008589 /nfs/dbraw/zinc/00/85/89/1141008589.db2.gz ORHQYZXQLNJPMM-CZUORRHYSA-N 1 1 343.431 3.715 20 5 EHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526348 1141545239 /nfs/dbraw/zinc/54/52/39/1141545239.db2.gz UTVBSTPPPOPEMM-GOSISDBHSA-N 1 1 339.395 3.679 20 5 EHBDMO