smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1ccc(Nc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC000591653549 1127312511 /nfs/dbraw/zinc/31/25/11/1127312511.db2.gz XTEITMHNUCGNSB-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000297486771 1127697830 /nfs/dbraw/zinc/69/78/30/1127697830.db2.gz ZSSVLOIBONLBTE-UWVGGRQHSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1[N+](=O)[O-] ZINC000271704231 1128046374 /nfs/dbraw/zinc/04/63/74/1128046374.db2.gz HZWAJXRHGQVUPV-WSQKDGNHSA-N 1 2 275.135 3.564 20 5 CHBDLO Cc1cc(F)ccc1C[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000488002634 1128332201 /nfs/dbraw/zinc/33/22/01/1128332201.db2.gz OTRZFXYAICOJBQ-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1cc(F)ccc1C[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000488002634 1128332203 /nfs/dbraw/zinc/33/22/03/1128332203.db2.gz OTRZFXYAICOJBQ-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000052073427 1119282034 /nfs/dbraw/zinc/28/20/34/1119282034.db2.gz IHPSVUWVRAGTTB-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000052073427 1119282039 /nfs/dbraw/zinc/28/20/39/1119282039.db2.gz IHPSVUWVRAGTTB-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO CC[N@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])cc1F ZINC000412026660 1119995610 /nfs/dbraw/zinc/99/56/10/1119995610.db2.gz MQGOFNFHCSWFDM-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO CC[N@@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])cc1F ZINC000412026660 1119995614 /nfs/dbraw/zinc/99/56/14/1119995614.db2.gz MQGOFNFHCSWFDM-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO CC[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505614420 1122439254 /nfs/dbraw/zinc/43/92/54/1122439254.db2.gz WKDHBEKGZFUFES-UHFFFAOYSA-N 1 2 288.322 3.756 20 5 CHBDLO CC[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505614420 1122439255 /nfs/dbraw/zinc/43/92/55/1122439255.db2.gz WKDHBEKGZFUFES-UHFFFAOYSA-N 1 2 288.322 3.756 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@H+](Cc2cccs2)C2CC2)cs1 ZINC000054174160 1122790050 /nfs/dbraw/zinc/79/00/50/1122790050.db2.gz OWPQVBCLTCNBLX-UHFFFAOYSA-N 1 2 294.401 3.882 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccs2)C2CC2)cs1 ZINC000054174160 1122790052 /nfs/dbraw/zinc/79/00/52/1122790052.db2.gz OWPQVBCLTCNBLX-UHFFFAOYSA-N 1 2 294.401 3.882 20 5 CHBDLO CC[C@H]([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])c1ccccc1 ZINC000339065080 1123905172 /nfs/dbraw/zinc/90/51/72/1123905172.db2.gz GIPAJQHJRBHQFW-HNNXBMFYSA-N 1 2 286.331 3.541 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000389464765 1124028347 /nfs/dbraw/zinc/02/83/47/1124028347.db2.gz HTPAOXGOVUBFIN-SKDRFNHKSA-N 1 2 272.295 3.679 20 5 CHBDLO CC[N@H+](Cc1ccoc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116276099 1129844701 /nfs/dbraw/zinc/84/47/01/1129844701.db2.gz AXFHROSWTOHDFG-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO CC[N@@H+](Cc1ccoc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116276099 1129844707 /nfs/dbraw/zinc/84/47/07/1129844707.db2.gz AXFHROSWTOHDFG-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO c1ccc2[nH+]c3ccc(Nc4cncnc4)cc3cc2c1 ZINC001174387411 1132830398 /nfs/dbraw/zinc/83/03/98/1132830398.db2.gz YGIREINVAORYGO-UHFFFAOYSA-N 1 2 272.311 3.922 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2cccc(Cn3cc[nH+]c3)c2)cc1 ZINC001174478449 1132882223 /nfs/dbraw/zinc/88/22/23/1132882223.db2.gz KHOHIKRJKKVSHC-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO Cc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1F ZINC001204472481 1133451560 /nfs/dbraw/zinc/45/15/60/1133451560.db2.gz WOCOBIBMEOZAMU-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1F ZINC001204472481 1133451561 /nfs/dbraw/zinc/45/15/61/1133451561.db2.gz WOCOBIBMEOZAMU-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001206164127 1133666204 /nfs/dbraw/zinc/66/62/04/1133666204.db2.gz DOJQRAFTQXWFNB-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO CCOc1cc(Nc2cc(F)cc([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001216483004 1134904500 /nfs/dbraw/zinc/90/45/00/1134904500.db2.gz XDOQHHRXBYCLNX-UHFFFAOYSA-N 1 2 291.282 3.580 20 5 CHBDLO Cc1cc[nH+]c(C)c1O[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001227264964 1135811769 /nfs/dbraw/zinc/81/17/69/1135811769.db2.gz QMKGVRZWXSBBMN-GFCCVEGCSA-N 1 2 272.304 3.747 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000080260564 260178546 /nfs/dbraw/zinc/17/85/46/260178546.db2.gz SOYIYJOCDBOVDG-CMPLNLGQSA-N 1 2 291.376 3.853 20 5 CHBDLO O=[N+]([O-])c1ccc(CC[N@H+](CC(F)F)CC2CCC2)cc1 ZINC000534172421 328038341 /nfs/dbraw/zinc/03/83/41/328038341.db2.gz ZAOBXVRHRPUGBQ-UHFFFAOYSA-N 1 2 298.333 3.505 20 5 CHBDLO O=[N+]([O-])c1ccc(CC[N@@H+](CC(F)F)CC2CCC2)cc1 ZINC000534172421 328038342 /nfs/dbraw/zinc/03/83/42/328038342.db2.gz ZAOBXVRHRPUGBQ-UHFFFAOYSA-N 1 2 298.333 3.505 20 5 CHBDLO O=[N+]([O-])c1cc(CNc2c[nH+]c3c(c2)CCCC3)cs1 ZINC000359948095 328900539 /nfs/dbraw/zinc/90/05/39/328900539.db2.gz XMFWJTNOPGJLTO-UHFFFAOYSA-N 1 2 289.360 3.542 20 5 CHBDLO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245431790 334192441 /nfs/dbraw/zinc/19/24/41/334192441.db2.gz OGZMAUFXCNEEPY-IAQYHMDHSA-N 1 2 288.372 3.849 20 5 CHBDLO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245431790 334192442 /nfs/dbraw/zinc/19/24/42/334192442.db2.gz OGZMAUFXCNEEPY-IAQYHMDHSA-N 1 2 288.372 3.849 20 5 CHBDLO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000105503982 522883355 /nfs/dbraw/zinc/88/33/55/522883355.db2.gz JCNAXGJFOZRCQE-GFCCVEGCSA-N 1 2 291.376 3.601 20 5 CHBDLO Cc1cc(N[C@H](c2[nH]cc[nH+]2)C(C)C)c(F)cc1[N+](=O)[O-] ZINC000292348151 525302942 /nfs/dbraw/zinc/30/29/42/525302942.db2.gz BUGPNIJLMRVUJM-ZDUSSCGKSA-N 1 2 292.314 3.575 20 5 CHBDLO Cc1c(CNc2ccc([NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000057611286 1127267652 /nfs/dbraw/zinc/26/76/52/1127267652.db2.gz CKPFONNZHQJJII-UHFFFAOYSA-N 1 2 285.347 3.581 20 5 CHBDLO CC(C)c1ccc(C[N@@H+]2CC[C@@](C)(F)C2)cc1[N+](=O)[O-] ZINC000539924404 1127955095 /nfs/dbraw/zinc/95/50/95/1127955095.db2.gz YJWDOJOWEXCMRR-OAHLLOKOSA-N 1 2 280.343 3.652 20 5 CHBDLO CC(C)c1ccc(C[N@H+]2CC[C@@](C)(F)C2)cc1[N+](=O)[O-] ZINC000539924404 1127955097 /nfs/dbraw/zinc/95/50/97/1127955097.db2.gz YJWDOJOWEXCMRR-OAHLLOKOSA-N 1 2 280.343 3.652 20 5 CHBDLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296840 1127979328 /nfs/dbraw/zinc/97/93/28/1127979328.db2.gz MAIYXKJXOSHENV-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296840 1127979329 /nfs/dbraw/zinc/97/93/29/1127979329.db2.gz MAIYXKJXOSHENV-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccc([N+](=O)[O-])cc1 ZINC000932178317 1128397714 /nfs/dbraw/zinc/39/77/14/1128397714.db2.gz YYCDUBFYWHOBFR-VSBFRKNKSA-N 1 2 275.135 3.564 20 5 CHBDLO O=[N+]([O-])c1ncccc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000916969868 1128467247 /nfs/dbraw/zinc/46/72/47/1128467247.db2.gz DEPUSSUUOJSJOS-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000047265461 1128668666 /nfs/dbraw/zinc/66/86/66/1128668666.db2.gz CDPJWYRPODMGFM-SNVBAGLBSA-N 1 2 294.351 3.988 20 5 CHBDLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000047265461 1128668669 /nfs/dbraw/zinc/66/86/69/1128668669.db2.gz CDPJWYRPODMGFM-SNVBAGLBSA-N 1 2 294.351 3.988 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccc(Cn3cc[nH+]c3)cc2)c1 ZINC001204455453 1118084866 /nfs/dbraw/zinc/08/48/66/1118084866.db2.gz CPZKPKSGTSDIOY-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175902451 1121494701 /nfs/dbraw/zinc/49/47/01/1121494701.db2.gz LWHVDMJMTXYGNZ-PKNBQFBNSA-N 1 2 283.331 3.943 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@H+](C1CC1)C1CCCCC1 ZINC000611254866 1121632395 /nfs/dbraw/zinc/63/23/95/1121632395.db2.gz QCEWAWDWCSZOCY-UHFFFAOYSA-N 1 2 290.363 3.598 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000611254866 1121632399 /nfs/dbraw/zinc/63/23/99/1121632399.db2.gz QCEWAWDWCSZOCY-UHFFFAOYSA-N 1 2 290.363 3.598 20 5 CHBDLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1cccc([N+](=O)[O-])c1 ZINC000876946404 1124991664 /nfs/dbraw/zinc/99/16/64/1124991664.db2.gz QQVNWXYERQFNEV-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO CC(C)[N@H+](Cc1ccco1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746109206 1129626420 /nfs/dbraw/zinc/62/64/20/1129626420.db2.gz MMIUBKUFALZBAI-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO CC(C)[N@@H+](Cc1ccco1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746109206 1129626421 /nfs/dbraw/zinc/62/64/21/1129626421.db2.gz MMIUBKUFALZBAI-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cncs1 ZINC000903305275 1130149849 /nfs/dbraw/zinc/14/98/49/1130149849.db2.gz JTXJKDBLBOQPQF-RKDXNWHRSA-N 1 2 295.339 3.602 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccc[nH+]c2N2CCCCC2)cc1 ZINC001174475334 1132879294 /nfs/dbraw/zinc/87/92/94/1132879294.db2.gz HYHDVHVDLYUKOI-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO CCOc1cc(Nc2cccc([N+](=O)[O-])c2F)cc(C)[nH+]1 ZINC001210382369 1134204633 /nfs/dbraw/zinc/20/46/33/1134204633.db2.gz VDOLDBWFCSQIFL-UHFFFAOYSA-N 1 2 291.282 3.580 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001210955408 1134338833 /nfs/dbraw/zinc/33/88/33/1134338833.db2.gz GNZAGSPRAHXNLG-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO O=[N+]([O-])c1cc(Nc2ccccc2-n2cc[nH+]c2)ccc1F ZINC001211192523 1134388752 /nfs/dbraw/zinc/38/87/52/1134388752.db2.gz AKRLOKZSJRZIDN-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1ccccc1-n1cc[nH+]c1 ZINC001211288173 1134403911 /nfs/dbraw/zinc/40/39/11/1134403911.db2.gz IXLYFVAOSRQGOK-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1cc(CO[C@H](C)c2ccccc2[N+](=O)[O-])cc(C)[nH+]1 ZINC001223425992 1135344849 /nfs/dbraw/zinc/34/48/49/1135344849.db2.gz WURZAMDURPFFKP-CYBMUJFWSA-N 1 2 286.331 3.884 20 5 CHBDLO O=[N+]([O-])c1cccc(CNc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000078612394 260168299 /nfs/dbraw/zinc/16/82/99/260168299.db2.gz HLZNSSVRPBLBSF-UHFFFAOYSA-N 1 2 297.236 3.621 20 5 CHBDLO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)(F)F ZINC000453296045 331112426 /nfs/dbraw/zinc/11/24/26/331112426.db2.gz QPJPOUWBWJPOMU-RNCFNFMXSA-N 1 2 284.306 3.606 20 5 CHBDLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000134899423 334107675 /nfs/dbraw/zinc/10/76/75/334107675.db2.gz YITSVPHNJRDBRQ-GHMZBOCLSA-N 1 2 291.376 3.772 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1Sc1[nH+]cc2ccccn21 ZINC000552908411 334350254 /nfs/dbraw/zinc/35/02/54/334350254.db2.gz XVURBVQEHZCOFT-UHFFFAOYSA-N 1 2 289.291 3.533 20 5 CHBDLO Cc1cc([NH+]2CCCC2)ccc1Nc1ccc([N+](=O)[O-])nc1 ZINC000567598154 334738629 /nfs/dbraw/zinc/73/86/29/334738629.db2.gz ZJRNGYILZJYAGI-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO C[C@@H](c1ccco1)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000086233180 526138731 /nfs/dbraw/zinc/13/87/31/526138731.db2.gz RBEXFYLUTUFFBW-JTQLQIEISA-N 1 2 292.360 3.975 20 5 CHBDLO C[C@@H](c1ccco1)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000086233180 526138744 /nfs/dbraw/zinc/13/87/44/526138744.db2.gz RBEXFYLUTUFFBW-JTQLQIEISA-N 1 2 292.360 3.975 20 5 CHBDLO CC[N@H+](Cc1occc1C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595544143 1127466492 /nfs/dbraw/zinc/46/64/92/1127466492.db2.gz LYPFMHPOXNZSIE-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO CC[N@@H+](Cc1occc1C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595544143 1127466495 /nfs/dbraw/zinc/46/64/95/1127466495.db2.gz LYPFMHPOXNZSIE-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO Cc1cc(NCCc2[nH+]cc(C)cc2C)c([N+](=O)[O-])s1 ZINC000596301035 1127487603 /nfs/dbraw/zinc/48/76/03/1127487603.db2.gz XBVQHDRNNIXPEC-UHFFFAOYSA-N 1 2 291.376 3.631 20 5 CHBDLO Cc1cc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc(C2CC2)[nH+]1 ZINC000295028699 1127615199 /nfs/dbraw/zinc/61/51/99/1127615199.db2.gz VRNMHQYHCDPWRH-NSHDSACASA-N 1 2 298.346 3.744 20 5 CHBDLO CCC(F)(F)C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000598996739 1127650845 /nfs/dbraw/zinc/65/08/45/1127650845.db2.gz MHTSGJGBQDMCAY-YRNVUSSQSA-N 1 2 284.306 3.633 20 5 CHBDLO CCN(CC)c1ccc(Nc2ccccc2[N+](=O)[O-])c[nH+]1 ZINC000603861241 1127678173 /nfs/dbraw/zinc/67/81/73/1127678173.db2.gz YTEUZPGLOBAXTG-UHFFFAOYSA-N 1 2 286.335 3.580 20 5 CHBDLO CCc1ccc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933542 1127682629 /nfs/dbraw/zinc/68/26/29/1127682629.db2.gz IIIFUQMTTIHYGD-UHFFFAOYSA-N 1 2 290.388 3.851 20 5 CHBDLO CCc1ccc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933542 1127682631 /nfs/dbraw/zinc/68/26/31/1127682631.db2.gz IIIFUQMTTIHYGD-UHFFFAOYSA-N 1 2 290.388 3.851 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000595343131 1127981619 /nfs/dbraw/zinc/98/16/19/1127981619.db2.gz XYIMNBOLKIQDCQ-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000595343131 1127981623 /nfs/dbraw/zinc/98/16/23/1127981623.db2.gz XYIMNBOLKIQDCQ-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1ccoc1C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154315969 1128490998 /nfs/dbraw/zinc/49/09/98/1128490998.db2.gz FXZRIAYUHOGJMY-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO Cc1ccoc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154315969 1128491001 /nfs/dbraw/zinc/49/10/01/1128491001.db2.gz FXZRIAYUHOGJMY-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2cccc(Cn3cc[nH+]c3)c2)c1 ZINC001204456583 1118086754 /nfs/dbraw/zinc/08/67/54/1118086754.db2.gz POITZFMTVWKBKC-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO CC[C@H]([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])c1cccs1 ZINC000343475936 1119430597 /nfs/dbraw/zinc/43/05/97/1119430597.db2.gz MQFGLDGVPZXMNW-LBPRGKRZSA-N 1 2 292.360 3.603 20 5 CHBDLO C[N@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542927456 1120254957 /nfs/dbraw/zinc/25/49/57/1120254957.db2.gz JBORMICDNUCMOY-UHFFFAOYSA-N 1 2 296.676 3.632 20 5 CHBDLO C[N@@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542927456 1120254961 /nfs/dbraw/zinc/25/49/61/1120254961.db2.gz 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ZINC000872017458 1124656768 /nfs/dbraw/zinc/65/67/68/1124656768.db2.gz CCGVYDICYRLJKK-WDEREUQCSA-N 1 2 289.310 3.541 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cncs1 ZINC000903305272 1130150122 /nfs/dbraw/zinc/15/01/22/1130150122.db2.gz JTXJKDBLBOQPQF-BDAKNGLRSA-N 1 2 295.339 3.602 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2cc(Cl)c3[nH+]ccn3c2)c1 ZINC001204440124 1133447126 /nfs/dbraw/zinc/44/71/26/1133447126.db2.gz SWQMGBCPURXJON-UHFFFAOYSA-N 1 2 288.694 3.640 20 5 CHBDLO CCCc1cc[nH+]c(Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC001213666042 1134476309 /nfs/dbraw/zinc/47/63/09/1134476309.db2.gz YNIKMOTWWFODNR-UHFFFAOYSA-N 1 2 271.320 3.994 20 5 CHBDLO Cc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)c([N+](=O)[O-])c1 ZINC001214172136 1134516485 /nfs/dbraw/zinc/51/64/85/1134516485.db2.gz VIPZROKQPFBNKQ-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000080272596 260179515 /nfs/dbraw/zinc/17/95/15/260179515.db2.gz OPWAKFKPXLASTQ-QWRGUYRKSA-N 1 2 291.376 3.772 20 5 CHBDLO CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1[nH]cc[nH+]1 ZINC000139779294 263031157 /nfs/dbraw/zinc/03/11/57/263031157.db2.gz OYPBEDUMQVVXDA-JTQLQIEISA-N 1 2 280.715 3.535 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(F)F ZINC000453249367 263208360 /nfs/dbraw/zinc/20/83/60/263208360.db2.gz QHIOHEFNPILKLM-ONGXEEELSA-N 1 2 272.295 3.598 20 5 CHBDLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000450833358 331001743 /nfs/dbraw/zinc/00/17/43/331001743.db2.gz SQCQUEPUBLUXAD-SECBINFHSA-N 1 2 294.742 3.638 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(F)F ZINC000453249362 331107329 /nfs/dbraw/zinc/10/73/29/331107329.db2.gz QHIOHEFNPILKLM-GXSJLCMTSA-N 1 2 272.295 3.598 20 5 CHBDLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000505471507 332741766 /nfs/dbraw/zinc/74/17/66/332741766.db2.gz KPLKUEUEXNFURL-JTQLQIEISA-N 1 2 292.285 3.724 20 5 CHBDLO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)c2[nH+]ccn21 ZINC000345355399 335317564 /nfs/dbraw/zinc/31/75/64/335317564.db2.gz LTFSHWGFWOTGAV-PELKAZGASA-N 1 2 292.726 3.563 20 5 CHBDLO O=[N+]([O-])c1ccccc1CNc1[nH+]ccc2ccc(F)cc21 ZINC000354556559 534886972 /nfs/dbraw/zinc/88/69/72/534886972.db2.gz ACBXDUILPLNQKD-UHFFFAOYSA-N 1 2 297.289 3.894 20 5 CHBDLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cscn2)cc1[N+](=O)[O-] ZINC000271430686 1127080956 /nfs/dbraw/zinc/08/09/56/1127080956.db2.gz BYMDPBSCBBBVIQ-WDEREUQCSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccsc1 ZINC000586771864 1127139545 /nfs/dbraw/zinc/13/95/45/1127139545.db2.gz CGUODEXBTWLOLT-MRVPVSSYSA-N 1 2 298.314 3.785 20 5 CHBDLO CCC[C@H]([NH2+][C@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832913 1127163580 /nfs/dbraw/zinc/16/35/80/1127163580.db2.gz KDNURFWQJZHECT-ABAIWWIYSA-N 1 2 289.335 3.775 20 5 CHBDLO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccon2)cc1[N+](=O)[O-] ZINC000351580919 1127195377 /nfs/dbraw/zinc/19/53/77/1127195377.db2.gz MKDBMQXMJTZWJM-NSHDSACASA-N 1 2 289.335 3.557 20 5 CHBDLO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(C(F)F)CCCC1 ZINC000588934161 1127207908 /nfs/dbraw/zinc/20/79/08/1127207908.db2.gz CVBJFAFZEIRMBH-ALCCZGGFSA-N 1 2 296.317 3.776 20 5 CHBDLO CC[N@H+](CCC(F)(F)F)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595300338 1127457996 /nfs/dbraw/zinc/45/79/96/1127457996.db2.gz ABAXGYFNBIPZDA-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO CC[N@@H+](CCC(F)(F)F)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595300338 1127457998 /nfs/dbraw/zinc/45/79/98/1127457998.db2.gz ABAXGYFNBIPZDA-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccns1 ZINC000602883601 1127620106 /nfs/dbraw/zinc/62/01/06/1127620106.db2.gz PFBFRQWLMLWSCS-LLVKDONJSA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccns1 ZINC000602883601 1127620107 /nfs/dbraw/zinc/62/01/07/1127620107.db2.gz PFBFRQWLMLWSCS-LLVKDONJSA-N 1 2 291.376 3.553 20 5 CHBDLO CCC(F)(F)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000599068238 1127655170 /nfs/dbraw/zinc/65/51/70/1127655170.db2.gz HBRSBHFPLWQBJZ-ZDUSSCGKSA-N 1 2 284.306 3.607 20 5 CHBDLO CC(F)(F)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000579097635 1128738538 /nfs/dbraw/zinc/73/85/38/1128738538.db2.gz FCJUIXRHTRTSMM-CYBMUJFWSA-N 1 2 284.306 3.607 20 5 CHBDLO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccs1 ZINC000077324749 1118662820 /nfs/dbraw/zinc/66/28/20/1118662820.db2.gz GHOCMIOLFLKQQO-UHFFFAOYSA-N 1 2 282.390 3.740 20 5 CHBDLO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccs1 ZINC000077324749 1118662821 /nfs/dbraw/zinc/66/28/21/1118662821.db2.gz GHOCMIOLFLKQQO-UHFFFAOYSA-N 1 2 282.390 3.740 20 5 CHBDLO Cc1cc(C)c(Nc2ccc(C)c([N+](=O)[O-])c2)c[nH+]1 ZINC001213661385 1119265343 /nfs/dbraw/zinc/26/53/43/1119265343.db2.gz DSCWUOBHTCVUCS-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO CCn1c2ccccc2[nH+]c1NCc1cccc([N+](=O)[O-])c1 ZINC000158888193 1119588433 /nfs/dbraw/zinc/58/84/33/1119588433.db2.gz KHEXZVMYPJRZOK-UHFFFAOYSA-N 1 2 296.330 3.577 20 5 CHBDLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000180436364 1119992341 /nfs/dbraw/zinc/99/23/41/1119992341.db2.gz BPBFRGREGJWWLA-LLVKDONJSA-N 1 2 297.314 3.587 20 5 CHBDLO Cc1ccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c(C)[nH+]1 ZINC001175900325 1121493712 /nfs/dbraw/zinc/49/37/12/1121493712.db2.gz OZADNYJGEYKZGT-MDZDMXLPSA-N 1 2 269.304 3.689 20 5 CHBDLO Cc1ccccc1C[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505598510 1122432298 /nfs/dbraw/zinc/43/22/98/1122432298.db2.gz WUDGPHICOVSVJQ-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1ccccc1C[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505598510 1122432296 /nfs/dbraw/zinc/43/22/96/1122432296.db2.gz WUDGPHICOVSVJQ-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1cc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)ccc1F ZINC000444744801 1124059135 /nfs/dbraw/zinc/05/91/35/1124059135.db2.gz OLUNRAXPYXHTMC-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1cc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)ccc1F ZINC000444744801 1124059137 /nfs/dbraw/zinc/05/91/37/1124059137.db2.gz OLUNRAXPYXHTMC-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO C[C@H]([NH2+]Cc1nc(Cl)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000877557615 1125044607 /nfs/dbraw/zinc/04/46/07/1125044607.db2.gz NSNOHMWXCOVEHZ-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Nc1ccc(Nc2c(Cl)ccc([N+](=O)[O-])c2Cl)c[nH+]1 ZINC001159282362 1132823039 /nfs/dbraw/zinc/82/30/39/1132823039.db2.gz UZOCCFSJFVQYAY-UHFFFAOYSA-N 1 2 299.117 3.622 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2cccc([N+](=O)[O-])c2F)cc1 ZINC001210387462 1134205108 /nfs/dbraw/zinc/20/51/08/1134205108.db2.gz MKIHOONHSJDSTH-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2cccc([N+](=O)[O-])c2F)cc1 ZINC001210387462 1134205114 /nfs/dbraw/zinc/20/51/14/1134205114.db2.gz MKIHOONHSJDSTH-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO Cc1ccc(Nc2ccc(C)c([N+](=O)[O-])c2)c(C)[nH+]1 ZINC001213660076 1134474058 /nfs/dbraw/zinc/47/40/58/1134474058.db2.gz PWCIZFPTQIGHSA-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1ccc(Nc2ccc[nH+]c2N2CCCC2)cc1[N+](=O)[O-] ZINC001213661766 1134475785 /nfs/dbraw/zinc/47/57/85/1134475785.db2.gz VQDRTUXJRDXSGV-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cc(F)cc([N+](=O)[O-])c1 ZINC001216481966 1134904161 /nfs/dbraw/zinc/90/41/61/1134904161.db2.gz MRGQGSHIGONZAI-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO CCc1ccc([N+](=O)[O-])cc1NCc1ccc(C)[nH+]c1C ZINC000357284383 266272042 /nfs/dbraw/zinc/27/20/42/266272042.db2.gz NPKKYIGLTFONMU-UHFFFAOYSA-N 1 2 285.347 3.781 20 5 CHBDLO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000037562787 326855520 /nfs/dbraw/zinc/85/55/20/326855520.db2.gz IDQXXHOQZKNISL-QMMMGPOBSA-N 1 2 298.314 3.785 20 5 CHBDLO Cc1ccc(COc2c(Cl)cccc2[N+](=O)[O-])c(C)[nH+]1 ZINC000185380413 329271443 /nfs/dbraw/zinc/27/14/43/329271443.db2.gz BNAMYUPZZYGQHW-UHFFFAOYSA-N 1 2 292.722 3.839 20 5 CHBDLO Cc1ccc(COc2cc(C)c([N+](=O)[O-])cc2F)c(C)[nH+]1 ZINC000185668829 329328561 /nfs/dbraw/zinc/32/85/61/329328561.db2.gz IMUKONHARAFOSJ-UHFFFAOYSA-N 1 2 290.294 3.633 20 5 CHBDLO O=[N+]([O-])c1cccc(SCc2cn3ccccc3[nH+]2)c1 ZINC000509083389 332858405 /nfs/dbraw/zinc/85/84/05/332858405.db2.gz OBTVYOFWWJPZMS-UHFFFAOYSA-N 1 2 285.328 3.535 20 5 CHBDLO COc1cc(C)[nH+]c(CSc2cccc([N+](=O)[O-])c2)c1 ZINC000509726432 332880568 /nfs/dbraw/zinc/88/05/68/332880568.db2.gz HNOQEIZMLYIYBH-UHFFFAOYSA-N 1 2 290.344 3.599 20 5 CHBDLO C[C@@]1(F)CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000451116355 331016130 /nfs/dbraw/zinc/01/61/30/331016130.db2.gz RNXZVFJZTJWQFO-CYBMUJFWSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@@]1(F)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000451116355 331016131 /nfs/dbraw/zinc/01/61/31/331016131.db2.gz RNXZVFJZTJWQFO-CYBMUJFWSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@@]1(F)CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000451116848 331016289 /nfs/dbraw/zinc/01/62/89/331016289.db2.gz SQYGAEWBVUNOMC-CYBMUJFWSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@@]1(F)CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000451116848 331016290 /nfs/dbraw/zinc/01/62/90/331016290.db2.gz SQYGAEWBVUNOMC-CYBMUJFWSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)(F)F ZINC000453296048 331112410 /nfs/dbraw/zinc/11/24/10/331112410.db2.gz QPJPOUWBWJPOMU-TVQRCGJNSA-N 1 2 284.306 3.606 20 5 CHBDLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000180436346 335583064 /nfs/dbraw/zinc/58/30/64/335583064.db2.gz BPBFRGREGJWWLA-NSHDSACASA-N 1 2 297.314 3.587 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000581411432 336071864 /nfs/dbraw/zinc/07/18/64/336071864.db2.gz JLXNVGPBDGLKKS-NXEZZACHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)s1 ZINC000352691488 533875661 /nfs/dbraw/zinc/87/56/61/533875661.db2.gz AAWXVGRMRMFLDW-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)s1 ZINC000352691488 533875665 /nfs/dbraw/zinc/87/56/65/533875665.db2.gz AAWXVGRMRMFLDW-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1F ZINC000094774420 1128024869 /nfs/dbraw/zinc/02/48/69/1128024869.db2.gz QZLKBXVNFGSSLE-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1F ZINC000094774420 1128024871 /nfs/dbraw/zinc/02/48/71/1128024871.db2.gz QZLKBXVNFGSSLE-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@@H+]2CCCc3sccc3C2)cs1 ZINC000609323386 1128699657 /nfs/dbraw/zinc/69/96/57/1128699657.db2.gz FZVIAYYWZYAODX-UHFFFAOYSA-N 1 2 294.401 3.666 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@H+]2CCCc3sccc3C2)cs1 ZINC000609323386 1128699659 /nfs/dbraw/zinc/69/96/59/1128699659.db2.gz FZVIAYYWZYAODX-UHFFFAOYSA-N 1 2 294.401 3.666 20 5 CHBDLO c1ccc2[nH+]c3ccc(Nc4ccnnc4)cc3cc2c1 ZINC001209961163 1118120015 /nfs/dbraw/zinc/12/00/15/1118120015.db2.gz PWSPNXRHLKRFTQ-UHFFFAOYSA-N 1 2 272.311 3.922 20 5 CHBDLO Cc1ccc([C@@H](C)[NH2+]C/C(Cl)=C\Cl)cc1[N+](=O)[O-] ZINC000588384066 1118485016 /nfs/dbraw/zinc/48/50/16/1118485016.db2.gz ZQEOZAIXLOZRJZ-VKRGWIQLSA-N 1 2 289.162 3.873 20 5 CHBDLO C[N@H+](Cc1ccc(F)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051258482 1118710799 /nfs/dbraw/zinc/71/07/99/1118710799.db2.gz MCBHLGOWWQXXDX-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051258482 1118710803 /nfs/dbraw/zinc/71/08/03/1118710803.db2.gz MCBHLGOWWQXXDX-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO CC[C@@H]([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])c1cccs1 ZINC000343475920 1119430277 /nfs/dbraw/zinc/43/02/77/1119430277.db2.gz MQFGLDGVPZXMNW-GFCCVEGCSA-N 1 2 292.360 3.603 20 5 CHBDLO Cc1cccc(CCCNc2cccc(C)c2[N+](=O)[O-])[nH+]1 ZINC000338726139 1120215564 /nfs/dbraw/zinc/21/55/64/1120215564.db2.gz VSBXPAOCDCKUMI-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO C[N@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313828352 1120412436 /nfs/dbraw/zinc/41/24/36/1120412436.db2.gz MYFPEMQIPMGNAX-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313828352 1120412439 /nfs/dbraw/zinc/41/24/39/1120412439.db2.gz MYFPEMQIPMGNAX-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO CC[N@H+](Cc1cccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505592470 1122428931 /nfs/dbraw/zinc/42/89/31/1122428931.db2.gz XUDYMANCYXAYEM-UHFFFAOYSA-N 1 2 294.351 3.818 20 5 CHBDLO CC[N@@H+](Cc1cccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505592470 1122428932 /nfs/dbraw/zinc/42/89/32/1122428932.db2.gz XUDYMANCYXAYEM-UHFFFAOYSA-N 1 2 294.351 3.818 20 5 CHBDLO Cc1ccc2c(Nc3cc(O)cc([N+](=O)[O-])c3)cccc2[nH+]1 ZINC001201224412 1123081295 /nfs/dbraw/zinc/08/12/95/1123081295.db2.gz NEWPDMNJGPMHRN-UHFFFAOYSA-N 1 2 295.298 3.901 20 5 CHBDLO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964281 1123496942 /nfs/dbraw/zinc/49/69/42/1123496942.db2.gz XVHKPTBIOQZORD-NWDGAFQWSA-N 1 2 292.379 3.699 20 5 CHBDLO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964281 1123496945 /nfs/dbraw/zinc/49/69/45/1123496945.db2.gz XVHKPTBIOQZORD-NWDGAFQWSA-N 1 2 292.379 3.699 20 5 CHBDLO CC(C)(C)c1cn(Cc2ccc(Cl)cc2[N+](=O)[O-])c[nH+]1 ZINC000865375875 1123976696 /nfs/dbraw/zinc/97/66/96/1123976696.db2.gz ORKWZOHVOTXTPD-UHFFFAOYSA-N 1 2 293.754 3.791 20 5 CHBDLO Cc1cc([NH+](C)C)ccc1NCc1cccc([N+](=O)[O-])c1 ZINC000057667788 262349419 /nfs/dbraw/zinc/34/94/19/262349419.db2.gz JNFWDUVPAZBKTN-UHFFFAOYSA-N 1 2 285.347 3.581 20 5 CHBDLO Cc1cc[nH+]c(NCCc2ccc([N+](=O)[O-])cc2)c1Cl ZINC000561156688 327369958 /nfs/dbraw/zinc/36/99/58/327369958.db2.gz BPRUTKFYRLMUMB-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000423218652 330179072 /nfs/dbraw/zinc/17/90/72/330179072.db2.gz SEWINNJUCQXRLG-LLVKDONJSA-N 1 2 283.331 3.736 20 5 CHBDLO Cc1cc2[nH+]cn(Cc3csc([N+](=O)[O-])c3)c2cc1C ZINC000446050594 330843209 /nfs/dbraw/zinc/84/32/09/330843209.db2.gz CSJSXLSOTATZAT-UHFFFAOYSA-N 1 2 287.344 3.671 20 5 CHBDLO Cc1ccc[nH+]c1CCCNc1ccc([N+](=O)[O-])cc1C ZINC000450723914 330996036 /nfs/dbraw/zinc/99/60/36/330996036.db2.gz KTJKLSPIZHSKTR-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(F)F ZINC000453245502 331106640 /nfs/dbraw/zinc/10/66/40/331106640.db2.gz KXUXFUUHKACGQZ-MWLCHTKSSA-N 1 2 272.295 3.598 20 5 CHBDLO C[N@H+](Cc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1F ZINC000336849840 335121061 /nfs/dbraw/zinc/12/10/61/335121061.db2.gz UIVFRKIITUTKBP-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1F ZINC000336849840 335121062 /nfs/dbraw/zinc/12/10/62/335121062.db2.gz UIVFRKIITUTKBP-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO Cc1cc(Nc2ccc3c(c2)[nH+]cn3C)ccc1[N+](=O)[O-] ZINC000566025709 334617301 /nfs/dbraw/zinc/61/73/01/334617301.db2.gz IISWRFQJJXIBPR-UHFFFAOYSA-N 1 2 282.303 3.534 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000266431415 527031823 /nfs/dbraw/zinc/03/18/23/527031823.db2.gz DESBRKIVOYDJSJ-VHSXEESVSA-N 1 2 291.376 3.772 20 5 CHBDLO CCC[C@@H]([NH2+][C@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832914 1127164100 /nfs/dbraw/zinc/16/41/00/1127164100.db2.gz KDNURFWQJZHECT-IAQYHMDHSA-N 1 2 289.335 3.775 20 5 CHBDLO CC(C)c1ccc(C[N@@H+]2CC[C@](C)(F)C2)cc1[N+](=O)[O-] ZINC000539924403 1127954806 /nfs/dbraw/zinc/95/48/06/1127954806.db2.gz YJWDOJOWEXCMRR-HNNXBMFYSA-N 1 2 280.343 3.652 20 5 CHBDLO CC(C)c1ccc(C[N@H+]2CC[C@](C)(F)C2)cc1[N+](=O)[O-] ZINC000539924403 1127954810 /nfs/dbraw/zinc/95/48/10/1127954810.db2.gz YJWDOJOWEXCMRR-HNNXBMFYSA-N 1 2 280.343 3.652 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)s1 ZINC000076342169 1128045459 /nfs/dbraw/zinc/04/54/59/1128045459.db2.gz QWSNXCHOJSYKFS-UHFFFAOYSA-N 1 2 282.390 3.658 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)s1 ZINC000076342169 1128045463 /nfs/dbraw/zinc/04/54/63/1128045463.db2.gz QWSNXCHOJSYKFS-UHFFFAOYSA-N 1 2 282.390 3.658 20 5 CHBDLO O=[N+]([O-])c1ccc(CCSc2[nH+]cc3ccccn32)cc1 ZINC000042152678 1128566089 /nfs/dbraw/zinc/56/60/89/1128566089.db2.gz CWAVFUOFMDDLDR-UHFFFAOYSA-N 1 2 299.355 3.577 20 5 CHBDLO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc(F)c1 ZINC000047265217 1128668437 /nfs/dbraw/zinc/66/84/37/1128668437.db2.gz YUVYPUUCAPZHIK-UHFFFAOYSA-N 1 2 294.351 3.818 20 5 CHBDLO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc(F)c1 ZINC000047265217 1128668439 /nfs/dbraw/zinc/66/84/39/1128668439.db2.gz YUVYPUUCAPZHIK-UHFFFAOYSA-N 1 2 294.351 3.818 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000610504855 1118586226 /nfs/dbraw/zinc/58/62/26/1118586226.db2.gz BWESEOHNFLDSPG-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000610504855 1118586228 /nfs/dbraw/zinc/58/62/28/1118586228.db2.gz BWESEOHNFLDSPG-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1ccc(C[NH2+]C2(C(F)F)CCCCC2)cc1[N+](=O)[O-] ZINC000512899034 1121634394 /nfs/dbraw/zinc/63/43/94/1121634394.db2.gz NOFQUDAODVIVOL-UHFFFAOYSA-N 1 2 298.333 3.961 20 5 CHBDLO CCC[C@H]1CCCC[C@H]1[NH2+]Cc1cc(O)ccc1[N+](=O)[O-] ZINC001193649698 1122706977 /nfs/dbraw/zinc/70/69/77/1122706977.db2.gz VNQLHGHYXPQZLV-SWLSCSKDSA-N 1 2 292.379 3.749 20 5 CHBDLO CC(C)(C)c1cn(Cc2cc(Cl)ccc2[N+](=O)[O-])c[nH+]1 ZINC000865374894 1123976493 /nfs/dbraw/zinc/97/64/93/1123976493.db2.gz AAZNQSGFUAUZSH-UHFFFAOYSA-N 1 2 293.754 3.791 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001204456041 1133449614 /nfs/dbraw/zinc/44/96/14/1133449614.db2.gz JWBDWYKLMBTLBD-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1cccc(Cn2cc[nH+]c2)c1 ZINC001206164398 1133666422 /nfs/dbraw/zinc/66/64/22/1133666422.db2.gz JHLKDSMIOXHYGZ-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2ccccc2[N+](=O)[O-])cc1 ZINC001206189272 1133669498 /nfs/dbraw/zinc/66/94/98/1133669498.db2.gz YFTKBUYMJYEXGW-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2ccccc2[N+](=O)[O-])cc1 ZINC001206189272 1133669501 /nfs/dbraw/zinc/66/95/01/1133669501.db2.gz YFTKBUYMJYEXGW-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc(C)c([N+](=O)[O-])c1 ZINC001213665854 1134476578 /nfs/dbraw/zinc/47/65/78/1134476578.db2.gz PBVNLKJMXXFCAA-UHFFFAOYSA-N 1 2 271.320 3.913 20 5 CHBDLO Cc1ccc(Nc2ccc(C)[nH+]c2C)c([N+](=O)[O-])c1 ZINC001214165431 1134515723 /nfs/dbraw/zinc/51/57/23/1134515723.db2.gz UIYMNFCYEHFSBD-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1cc[nH+]c(C)c1O[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001227263668 1135813226 /nfs/dbraw/zinc/81/32/26/1135813226.db2.gz GOYMPDKWOUGDOC-LBPRGKRZSA-N 1 2 272.304 3.747 20 5 CHBDLO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccco1 ZINC000035738455 172391794 /nfs/dbraw/zinc/39/17/94/172391794.db2.gz IEBIPGOYIKTLEL-SECBINFHSA-N 1 2 280.711 3.692 20 5 CHBDLO CC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1[nH]cc[nH+]1 ZINC000139779436 263031113 /nfs/dbraw/zinc/03/11/13/263031113.db2.gz OYPBEDUMQVVXDA-SNVBAGLBSA-N 1 2 280.715 3.535 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(F)F ZINC000453245503 331106722 /nfs/dbraw/zinc/10/67/22/331106722.db2.gz KXUXFUUHKACGQZ-ONGXEEELSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cs1 ZINC000230639806 333319252 /nfs/dbraw/zinc/31/92/52/333319252.db2.gz OBSXSFRBTBPCSK-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO O=[N+]([O-])c1ccc(CSCc2c[nH+]c3ccccn23)cc1 ZINC000180003693 335540308 /nfs/dbraw/zinc/54/03/08/335540308.db2.gz FAGHJVNLAHLHRT-UHFFFAOYSA-N 1 2 299.355 3.676 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)c1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000579623727 335825374 /nfs/dbraw/zinc/82/53/74/335825374.db2.gz OTHRNRSAQUZPEQ-MFKMUULPSA-N 1 2 291.376 3.853 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000041010458 526892344 /nfs/dbraw/zinc/89/23/44/526892344.db2.gz AUDUKSQIOPMUNE-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cscn2)cc1[N+](=O)[O-] ZINC000271430683 1127080479 /nfs/dbraw/zinc/08/04/79/1127080479.db2.gz BYMDPBSCBBBVIQ-GHMZBOCLSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@@H]1C[C@@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579977524 1118271414 /nfs/dbraw/zinc/27/14/14/1118271414.db2.gz ILAADMFPOMPHKX-RKDXNWHRSA-N 1 2 288.269 3.596 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175735895 1121441500 /nfs/dbraw/zinc/44/15/00/1121441500.db2.gz NHVBIQPPVWQZQA-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175735895 1121441504 /nfs/dbraw/zinc/44/15/04/1121441504.db2.gz NHVBIQPPVWQZQA-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC(C)([NH2+]C/C(Cl)=C/Cl)c1ccccc1[N+](=O)[O-] ZINC000795217241 1129192318 /nfs/dbraw/zinc/19/23/18/1129192318.db2.gz BASVMMUUTLYKDJ-CLFYSBASSA-N 1 2 289.162 3.739 20 5 CHBDLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000282671313 1129278294 /nfs/dbraw/zinc/27/82/94/1129278294.db2.gz JCXASOVEAXSIEA-RYUDHWBXSA-N 1 2 289.335 3.611 20 5 CHBDLO CC[N@H+](Cc1ccoc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746667049 1130143765 /nfs/dbraw/zinc/14/37/65/1130143765.db2.gz USFZFBFZQVPGMT-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO CC[N@@H+](Cc1ccoc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746667049 1130143768 /nfs/dbraw/zinc/14/37/68/1130143768.db2.gz USFZFBFZQVPGMT-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO Cc1ccc(C)c(C[N@@H+]2Cc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001116149854 1131131066 /nfs/dbraw/zinc/13/10/66/1131131066.db2.gz BPMCZTMQICTHAB-UHFFFAOYSA-N 1 2 282.343 3.727 20 5 CHBDLO Cc1ccc(C)c(C[N@H+]2Cc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001116149854 1131131069 /nfs/dbraw/zinc/13/10/69/1131131069.db2.gz BPMCZTMQICTHAB-UHFFFAOYSA-N 1 2 282.343 3.727 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC001174477958 1132883254 /nfs/dbraw/zinc/88/32/54/1132883254.db2.gz FOELHBMXVXQQKD-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO Cc1cc(Cl)c(NC(=[NH2+])C(C)(C)C)c([N+](=O)[O-])c1 ZINC001162666793 1133102729 /nfs/dbraw/zinc/10/27/29/1133102729.db2.gz QNAQKIFTNHCTMB-UHFFFAOYSA-N 1 2 269.732 3.992 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1ccc[nH+]c1N1CCCCC1 ZINC001206144865 1133663484 /nfs/dbraw/zinc/66/34/84/1133663484.db2.gz TZWVEMKEUKQULK-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO CSc1cc(Nc2cc([N+](=O)[O-])ccc2C)cc[nH+]1 ZINC001211288020 1134403905 /nfs/dbraw/zinc/40/39/05/1134403905.db2.gz ARGJZCWCCAWWSZ-UHFFFAOYSA-N 1 2 275.333 3.764 20 5 CHBDLO CCc1[nH+]c(C)ccc1OCc1c(F)cccc1[N+](=O)[O-] ZINC000352563002 529730395 /nfs/dbraw/zinc/73/03/95/529730395.db2.gz OTRPGRVQTGUJOK-UHFFFAOYSA-N 1 2 290.294 3.579 20 5 CHBDLO C[C@H]1c2ccccc2C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353904590 226166414 /nfs/dbraw/zinc/16/64/14/226166414.db2.gz ATBTTWAWRVNQCK-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO C[C@H]1c2ccccc2C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353904590 226166418 /nfs/dbraw/zinc/16/64/18/226166418.db2.gz ATBTTWAWRVNQCK-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433764 228100629 /nfs/dbraw/zinc/10/06/29/228100629.db2.gz UOFOFWAMFJPCCY-LBPRGKRZSA-N 1 2 292.360 3.895 20 5 CHBDLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433764 228100632 /nfs/dbraw/zinc/10/06/32/228100632.db2.gz UOFOFWAMFJPCCY-LBPRGKRZSA-N 1 2 292.360 3.895 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000080260569 260178874 /nfs/dbraw/zinc/17/88/74/260178874.db2.gz SOYIYJOCDBOVDG-PWSUYJOCSA-N 1 2 291.376 3.853 20 5 CHBDLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000080272590 260179717 /nfs/dbraw/zinc/17/97/17/260179717.db2.gz OPWAKFKPXLASTQ-WDEREUQCSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1cc([NH+](C)C)ccc1NCc1ccc([N+](=O)[O-])cc1 ZINC000057667791 262349249 /nfs/dbraw/zinc/34/92/49/262349249.db2.gz QDEUHEGCKVEWSV-UHFFFAOYSA-N 1 2 285.347 3.581 20 5 CHBDLO Cc1ccc(CNc2cc([N+](=O)[O-])ccc2C)c(C)[nH+]1 ZINC000187703517 329362695 /nfs/dbraw/zinc/36/26/95/329362695.db2.gz PXTZQWGRGNJIHC-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000423213902 330184508 /nfs/dbraw/zinc/18/45/08/330184508.db2.gz KNEOIIQEXSRWFK-NSHDSACASA-N 1 2 283.331 3.736 20 5 CHBDLO CC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)F ZINC000453229329 331104279 /nfs/dbraw/zinc/10/42/79/331104279.db2.gz CPJGYYMAMOWTNV-STQMWFEESA-N 1 2 284.306 3.606 20 5 CHBDLO Cc1c([C@H](C)[NH2+][C@H](C)C(C)(F)F)cccc1[N+](=O)[O-] ZINC000453291437 331111765 /nfs/dbraw/zinc/11/17/65/331111765.db2.gz NEDHBCSTFHMUFE-VHSXEESVSA-N 1 2 272.295 3.598 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(F)c1 ZINC000491900914 332374414 /nfs/dbraw/zinc/37/44/14/332374414.db2.gz IWQKXVMXHMITRT-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2c2ccccc2)c(F)c1 ZINC000491900914 332374415 /nfs/dbraw/zinc/37/44/15/332374415.db2.gz IWQKXVMXHMITRT-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000483330150 1126782249 /nfs/dbraw/zinc/78/22/49/1126782249.db2.gz IDUAQYFIYIVEDC-ZDUSSCGKSA-N 1 2 282.343 3.980 20 5 CHBDLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000483330150 1126782251 /nfs/dbraw/zinc/78/22/51/1126782251.db2.gz IDUAQYFIYIVEDC-ZDUSSCGKSA-N 1 2 282.343 3.980 20 5 CHBDLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000267012401 1126991801 /nfs/dbraw/zinc/99/18/01/1126991801.db2.gz HTTVKAOSXDMINV-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000267012401 1126991803 /nfs/dbraw/zinc/99/18/03/1126991803.db2.gz HTTVKAOSXDMINV-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(C(F)F)CCCC1 ZINC000588934163 1127207453 /nfs/dbraw/zinc/20/74/53/1127207453.db2.gz CVBJFAFZEIRMBH-FNORWQNLSA-N 1 2 296.317 3.776 20 5 CHBDLO Cc1cc(NCc2c[nH+]c(C)cc2C)c([N+](=O)[O-])s1 ZINC000596262413 1127488461 /nfs/dbraw/zinc/48/84/61/1127488461.db2.gz UKAIHBNQRAEGIY-UHFFFAOYSA-N 1 2 277.349 3.589 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536733 1127678877 /nfs/dbraw/zinc/67/88/77/1127678877.db2.gz QJEAZZQLZWGEQW-LBPRGKRZSA-N 1 2 298.342 3.686 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536733 1127678878 /nfs/dbraw/zinc/67/88/78/1127678878.db2.gz QJEAZZQLZWGEQW-LBPRGKRZSA-N 1 2 298.342 3.686 20 5 CHBDLO Cc1cccc(CCCNc2c(C)cccc2[N+](=O)[O-])[nH+]1 ZINC000343236354 1119360963 /nfs/dbraw/zinc/36/09/63/1119360963.db2.gz SPTUAENOIFIXML-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO Cc1cc(CNc2ccc([N+](=O)[O-])c(C)c2)cc(C)[nH+]1 ZINC000420656805 1122028804 /nfs/dbraw/zinc/02/88/04/1122028804.db2.gz VMRGAQQEXCNNRF-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1ccsc1C[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505564131 1122421000 /nfs/dbraw/zinc/42/10/00/1122421000.db2.gz LHICIDDCCPORTG-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1ccsc1C[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505564131 1122421002 /nfs/dbraw/zinc/42/10/02/1122421002.db2.gz LHICIDDCCPORTG-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cs1 ZINC000126583945 1122706017 /nfs/dbraw/zinc/70/60/17/1122706017.db2.gz KPMCPNDKNONTQH-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cs1 ZINC000126583055 1122707313 /nfs/dbraw/zinc/70/73/13/1122707313.db2.gz VBVONYGKYVHAQY-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO CC(C)C[C@@]1(C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001194533935 1122782381 /nfs/dbraw/zinc/78/23/81/1122782381.db2.gz MNFMUUMEYVNAJE-MRXNPFEDSA-N 1 2 292.379 3.701 20 5 CHBDLO CC(C)C[C@@]1(C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001194533935 1122782387 /nfs/dbraw/zinc/78/23/87/1122782387.db2.gz MNFMUUMEYVNAJE-MRXNPFEDSA-N 1 2 292.379 3.701 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC001201230849 1123079532 /nfs/dbraw/zinc/07/95/32/1123079532.db2.gz ABRNDCSBPSVQMN-UHFFFAOYSA-N 1 2 287.319 3.500 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC001201230849 1123079536 /nfs/dbraw/zinc/07/95/36/1123079536.db2.gz ABRNDCSBPSVQMN-UHFFFAOYSA-N 1 2 287.319 3.500 20 5 CHBDLO Nc1ccc(Nc2cc3cccnc3c3ncccc23)c[nH+]1 ZINC001201293221 1123083884 /nfs/dbraw/zinc/08/38/84/1123083884.db2.gz YBYZPWTZRHSRAO-UHFFFAOYSA-N 1 2 287.326 3.504 20 5 CHBDLO C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cscn1 ZINC000850359950 1123256786 /nfs/dbraw/zinc/25/67/86/1123256786.db2.gz XIUIVYHCRVOJST-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO C[C@H](c1ccco1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000194978855 1129140441 /nfs/dbraw/zinc/14/04/41/1129140441.db2.gz JSJMLOCGVQHKQA-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000194978855 1129140444 /nfs/dbraw/zinc/14/04/44/1129140444.db2.gz JSJMLOCGVQHKQA-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO Cc1ccoc1C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000795169365 1124611591 /nfs/dbraw/zinc/61/15/91/1124611591.db2.gz OHSOAJUKZHJQPN-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccoc1C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000795169365 1124611597 /nfs/dbraw/zinc/61/15/97/1124611597.db2.gz OHSOAJUKZHJQPN-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccn1 ZINC000872016038 1124656602 /nfs/dbraw/zinc/65/66/02/1124656602.db2.gz COJABLXTQZCAAG-MNOVXSKESA-N 1 2 289.310 3.541 20 5 CHBDLO CC(C)(C)C(=[NH2+])Nc1ncc([N+](=O)[O-])c2ccccc12 ZINC001155181014 1129444418 /nfs/dbraw/zinc/44/44/18/1129444418.db2.gz CNZHHXOUSGEEBM-UHFFFAOYSA-N 1 2 272.308 3.578 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1c(F)cccc1[N+](=O)[O-] ZINC000903305273 1130149779 /nfs/dbraw/zinc/14/97/79/1130149779.db2.gz JTXJKDBLBOQPQF-DTWKUNHWSA-N 1 2 295.339 3.602 20 5 CHBDLO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CC2(C1)CCCC2 ZINC000839104473 1132181710 /nfs/dbraw/zinc/18/17/10/1132181710.db2.gz LAPKPMWWDKAZLF-UHFFFAOYSA-N 1 2 280.755 3.624 20 5 CHBDLO CC(C)(C)c1cn(Cc2cc([N+](=O)[O-])ccc2Cl)c[nH+]1 ZINC001166618265 1133276998 /nfs/dbraw/zinc/27/69/98/1133276998.db2.gz CPVBWPDPGGBMQR-UHFFFAOYSA-N 1 2 293.754 3.791 20 5 CHBDLO Cn1ccc(Nc2ccc3[nH+]c4ccccc4cc3c2)n1 ZINC001210353106 1134197599 /nfs/dbraw/zinc/19/75/99/1134197599.db2.gz HLHIEXFLNYSNCI-UHFFFAOYSA-N 1 2 274.327 3.865 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC001211198445 1134389125 /nfs/dbraw/zinc/38/91/25/1134389125.db2.gz KOYPHQBNMGBCQO-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC001211198445 1134389129 /nfs/dbraw/zinc/38/91/29/1134389129.db2.gz KOYPHQBNMGBCQO-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO O=[N+]([O-])c1cc(F)cc(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001216482086 1134904469 /nfs/dbraw/zinc/90/44/69/1134904469.db2.gz UPQKAKDZZKDZOX-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO CCc1[nH+]c(C)ccc1OCc1ccc([N+](=O)[O-])cc1F ZINC000352562234 529730422 /nfs/dbraw/zinc/73/04/22/529730422.db2.gz IBPSTKLZDKMXGZ-UHFFFAOYSA-N 1 2 290.294 3.579 20 5 CHBDLO Cc1cc(NCC2CCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000301082913 227442559 /nfs/dbraw/zinc/44/25/59/227442559.db2.gz FSVKDENLEBRMRL-UHFFFAOYSA-N 1 2 298.346 3.572 20 5 CHBDLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433760 228100493 /nfs/dbraw/zinc/10/04/93/228100493.db2.gz UOFOFWAMFJPCCY-GFCCVEGCSA-N 1 2 292.360 3.895 20 5 CHBDLO Cc1ccc([C@H]2CCC[N@H+]2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433760 228100495 /nfs/dbraw/zinc/10/04/95/228100495.db2.gz UOFOFWAMFJPCCY-GFCCVEGCSA-N 1 2 292.360 3.895 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000080260574 260178939 /nfs/dbraw/zinc/17/89/39/260178939.db2.gz SOYIYJOCDBOVDG-ZYHUDNBSSA-N 1 2 291.376 3.853 20 5 CHBDLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000080272603 260179920 /nfs/dbraw/zinc/17/99/20/260179920.db2.gz OPWAKFKPXLASTQ-GHMZBOCLSA-N 1 2 291.376 3.772 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(F)F ZINC000453249365 263208331 /nfs/dbraw/zinc/20/83/31/263208331.db2.gz QHIOHEFNPILKLM-MWLCHTKSSA-N 1 2 272.295 3.598 20 5 CHBDLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000559854291 327265307 /nfs/dbraw/zinc/26/53/07/327265307.db2.gz SRDVGVYPLRTQPP-CABZTGNLSA-N 1 2 292.360 3.663 20 5 CHBDLO Cc1ccc(NCc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])c1 ZINC000420657959 329780909 /nfs/dbraw/zinc/78/09/09/329780909.db2.gz XRRKIRSXGVIHCC-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO C[C@]1(F)CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000451116356 331016307 /nfs/dbraw/zinc/01/63/07/331016307.db2.gz RNXZVFJZTJWQFO-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@]1(F)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000451116356 331016308 /nfs/dbraw/zinc/01/63/08/331016308.db2.gz RNXZVFJZTJWQFO-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO Cc1c([C@@H](C)[NH2+][C@@H](C)C(C)(F)F)cccc1[N+](=O)[O-] ZINC000453291439 331111744 /nfs/dbraw/zinc/11/17/44/331111744.db2.gz NEDHBCSTFHMUFE-ZJUUUORDSA-N 1 2 272.295 3.598 20 5 CHBDLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000225316538 333234937 /nfs/dbraw/zinc/23/49/37/333234937.db2.gz MSNKBBQPGLCKRW-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000581411433 336071858 /nfs/dbraw/zinc/07/18/58/336071858.db2.gz JLXNVGPBDGLKKS-UWVGGRQHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1[nH+]c2ccccn2c1CSc1cccc([N+](=O)[O-])c1 ZINC000509089250 518193108 /nfs/dbraw/zinc/19/31/08/518193108.db2.gz KHXQAEZAHUQOKD-UHFFFAOYSA-N 1 2 299.355 3.843 20 5 CHBDLO Cc1cccc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000340406328 524377026 /nfs/dbraw/zinc/37/70/26/524377026.db2.gz BCMHLQDPEPIFJZ-UHFFFAOYSA-N 1 2 276.361 3.597 20 5 CHBDLO Cc1cccc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000340406328 524377039 /nfs/dbraw/zinc/37/70/39/524377039.db2.gz BCMHLQDPEPIFJZ-UHFFFAOYSA-N 1 2 276.361 3.597 20 5 CHBDLO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1F ZINC000043626344 1127001881 /nfs/dbraw/zinc/00/18/81/1127001881.db2.gz OWFBPMOGFAKGAM-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1F ZINC000043626344 1127001885 /nfs/dbraw/zinc/00/18/85/1127001885.db2.gz OWFBPMOGFAKGAM-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000591701846 1127314443 /nfs/dbraw/zinc/31/44/43/1127314443.db2.gz QJNWZXAYIAQNNG-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296841 1127457470 /nfs/dbraw/zinc/45/74/70/1127457470.db2.gz MAIYXKJXOSHENV-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296841 1127457472 /nfs/dbraw/zinc/45/74/72/1127457472.db2.gz MAIYXKJXOSHENV-SNVBAGLBSA-N 1 2 278.283 3.520 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000293936716 1127535107 /nfs/dbraw/zinc/53/51/07/1127535107.db2.gz NXRNOPGZLPLZKM-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000293936716 1127535110 /nfs/dbraw/zinc/53/51/10/1127535110.db2.gz NXRNOPGZLPLZKM-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000595343132 1127981818 /nfs/dbraw/zinc/98/18/18/1127981818.db2.gz XYIMNBOLKIQDCQ-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000595343132 1127981820 /nfs/dbraw/zinc/98/18/20/1127981820.db2.gz XYIMNBOLKIQDCQ-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])o1 ZINC000174809046 1128331757 /nfs/dbraw/zinc/33/17/57/1128331757.db2.gz XYXLYGLVMVEXDG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])o1 ZINC000174809046 1128331761 /nfs/dbraw/zinc/33/17/61/1128331761.db2.gz XYXLYGLVMVEXDG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917392676 1128497262 /nfs/dbraw/zinc/49/72/62/1128497262.db2.gz LSLMOGJPIYDBNN-NSHDSACASA-N 1 2 288.372 3.776 20 5 CHBDLO C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917392676 1128497264 /nfs/dbraw/zinc/49/72/64/1128497264.db2.gz LSLMOGJPIYDBNN-NSHDSACASA-N 1 2 288.372 3.776 20 5 CHBDLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000047265459 1128668649 /nfs/dbraw/zinc/66/86/49/1128668649.db2.gz CDPJWYRPODMGFM-JTQLQIEISA-N 1 2 294.351 3.988 20 5 CHBDLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000047265459 1128668651 /nfs/dbraw/zinc/66/86/51/1128668651.db2.gz CDPJWYRPODMGFM-JTQLQIEISA-N 1 2 294.351 3.988 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000050015555 1119091245 /nfs/dbraw/zinc/09/12/45/1119091245.db2.gz UMIPFUBJAAKJHL-SECBINFHSA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1cc(CNc2ccc([N+](=O)[O-])cc2C)cc(C)[nH+]1 ZINC000420651896 1122028882 /nfs/dbraw/zinc/02/88/82/1122028882.db2.gz KZUXUEWEJMRNQL-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccn1 ZINC000872016037 1124656537 /nfs/dbraw/zinc/65/65/37/1124656537.db2.gz COJABLXTQZCAAG-GHMZBOCLSA-N 1 2 289.310 3.541 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccnc1 ZINC000872017456 1124657067 /nfs/dbraw/zinc/65/70/67/1124657067.db2.gz CCGVYDICYRLJKK-MNOVXSKESA-N 1 2 289.310 3.541 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000449635565 1124832286 /nfs/dbraw/zinc/83/22/86/1124832286.db2.gz UHVJLRRQXVXURU-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000449635565 1124832293 /nfs/dbraw/zinc/83/22/93/1124832293.db2.gz UHVJLRRQXVXURU-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000037772007 1129266849 /nfs/dbraw/zinc/26/68/49/1129266849.db2.gz VATHNODVWUUFBB-SNVBAGLBSA-N 1 2 292.285 3.724 20 5 CHBDLO CC(C)(C)C(=[NH2+])Nc1nccc2c1cccc2[N+](=O)[O-] ZINC001162657102 1133101689 /nfs/dbraw/zinc/10/16/89/1133101689.db2.gz FGQNHWLYNHMANI-UHFFFAOYSA-N 1 2 272.308 3.578 20 5 CHBDLO Cc1cn2c(cccc2Nc2ccc(C)c([N+](=O)[O-])c2)[nH+]1 ZINC001213659795 1134474575 /nfs/dbraw/zinc/47/45/75/1134474575.db2.gz AFDRLKUWLWXFCF-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO CCc1ccc(C)[nH+]c1Nc1cc(F)cc([N+](=O)[O-])c1 ZINC001216481103 1134903204 /nfs/dbraw/zinc/90/32/04/1134903204.db2.gz QXIIIPYGQXCZRM-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO C[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035206677 172051128 /nfs/dbraw/zinc/05/11/28/172051128.db2.gz HJOANZINSBTRRR-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035206677 172051130 /nfs/dbraw/zinc/05/11/30/172051130.db2.gz HJOANZINSBTRRR-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])s1 ZINC000103482355 261284525 /nfs/dbraw/zinc/28/45/25/261284525.db2.gz LVQHOFUFWJZCGD-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])s1 ZINC000103482355 261284526 /nfs/dbraw/zinc/28/45/26/261284526.db2.gz LVQHOFUFWJZCGD-UHFFFAOYSA-N 1 2 294.351 3.736 20 5 CHBDLO O=[N+]([O-])c1cccc(CNc2ccc3c(c2)CCC[NH2+]3)c1 ZINC000414850331 263066955 /nfs/dbraw/zinc/06/69/55/263066955.db2.gz MPZNJYZSAVVMSW-UHFFFAOYSA-N 1 2 283.331 3.565 20 5 CHBDLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000559854290 327265005 /nfs/dbraw/zinc/26/50/05/327265005.db2.gz SRDVGVYPLRTQPP-BXKDBHETSA-N 1 2 292.360 3.663 20 5 CHBDLO Cc1c(C[NH2+]C2(C(F)F)CCCCC2)cccc1[N+](=O)[O-] ZINC000510142800 332894583 /nfs/dbraw/zinc/89/45/83/332894583.db2.gz JGNCJIMTQRGJCS-UHFFFAOYSA-N 1 2 298.333 3.961 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)C(C)(F)F ZINC000581411435 336071872 /nfs/dbraw/zinc/07/18/72/336071872.db2.gz JLXNVGPBDGLKKS-ZJUUUORDSA-N 1 2 272.295 3.598 20 5 CHBDLO C[C@H](c1ccco1)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000086233183 526147450 /nfs/dbraw/zinc/14/74/50/526147450.db2.gz RBEXFYLUTUFFBW-SNVBAGLBSA-N 1 2 292.360 3.975 20 5 CHBDLO C[C@H](c1ccco1)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000086233183 526147457 /nfs/dbraw/zinc/14/74/57/526147457.db2.gz RBEXFYLUTUFFBW-SNVBAGLBSA-N 1 2 292.360 3.975 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000353700049 529124671 /nfs/dbraw/zinc/12/46/71/529124671.db2.gz VGKAVZIEGYIEAG-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000353700049 529124673 /nfs/dbraw/zinc/12/46/73/529124673.db2.gz VGKAVZIEGYIEAG-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1cccc([N+](=O)[O-])c1 ZINC000180399774 1126843802 /nfs/dbraw/zinc/84/38/02/1126843802.db2.gz PJHWQRJTNBOZAG-KZSPTFSBSA-N 1 2 275.135 3.564 20 5 CHBDLO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000042978028 1126867108 /nfs/dbraw/zinc/86/71/08/1126867108.db2.gz LZRHTJKTXPPIGC-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000042978028 1126867112 /nfs/dbraw/zinc/86/71/12/1126867112.db2.gz LZRHTJKTXPPIGC-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO CCC[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832916 1127163541 /nfs/dbraw/zinc/16/35/41/1127163541.db2.gz KDNURFWQJZHECT-XHDPSFHLSA-N 1 2 289.335 3.775 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536732 1127678835 /nfs/dbraw/zinc/67/88/35/1127678835.db2.gz QJEAZZQLZWGEQW-GFCCVEGCSA-N 1 2 298.342 3.686 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536732 1127678837 /nfs/dbraw/zinc/67/88/37/1127678837.db2.gz QJEAZZQLZWGEQW-GFCCVEGCSA-N 1 2 298.342 3.686 20 5 CHBDLO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000052073428 1119281814 /nfs/dbraw/zinc/28/18/14/1119281814.db2.gz IHPSVUWVRAGTTB-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000052073428 1119281818 /nfs/dbraw/zinc/28/18/18/1119281818.db2.gz IHPSVUWVRAGTTB-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO Cc1ccc(NCc2cc([N+](=O)[O-])ccc2Cl)c(C)[nH+]1 ZINC000094664138 1120230679 /nfs/dbraw/zinc/23/06/79/1120230679.db2.gz QNJKNHIEIAQPMU-UHFFFAOYSA-N 1 2 291.738 3.872 20 5 CHBDLO Cc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000051965770 1121481045 /nfs/dbraw/zinc/48/10/45/1121481045.db2.gz BDXVWRLBHCLDAX-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO Cc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000051965770 1121481060 /nfs/dbraw/zinc/48/10/60/1121481060.db2.gz BDXVWRLBHCLDAX-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO Cc1cccc2c1CC[N@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000729477077 1122992927 /nfs/dbraw/zinc/99/29/27/1122992927.db2.gz LVJNFOFFNGVQPT-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1cccc2c1CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000729477077 1122992929 /nfs/dbraw/zinc/99/29/29/1122992929.db2.gz LVJNFOFFNGVQPT-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO C[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cscn1 ZINC000850359951 1123256830 /nfs/dbraw/zinc/25/68/30/1123256830.db2.gz XIUIVYHCRVOJST-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000389464763 1124027593 /nfs/dbraw/zinc/02/75/93/1124027593.db2.gz HTPAOXGOVUBFIN-JOYOIKCWSA-N 1 2 272.295 3.679 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000339075745 1124096272 /nfs/dbraw/zinc/09/62/72/1124096272.db2.gz SXBQSLSVWBAAAA-QGZVFWFLSA-N 1 2 298.342 3.541 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872016040 1124656624 /nfs/dbraw/zinc/65/66/24/1124656624.db2.gz COJABLXTQZCAAG-WDEREUQCSA-N 1 2 289.310 3.541 20 5 CHBDLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccns1 ZINC000872090203 1124680327 /nfs/dbraw/zinc/68/03/27/1124680327.db2.gz NUFXJGAORJTOSN-IUCAKERBSA-N 1 2 295.339 3.602 20 5 CHBDLO CC(C)C[C@H]1CCC[N@H+](Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC001168146126 1125262548 /nfs/dbraw/zinc/26/25/48/1125262548.db2.gz QEVFKXHMUGLMFX-CYBMUJFWSA-N 1 2 292.379 3.559 20 5 CHBDLO CC(C)C[C@H]1CCC[N@@H+](Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC001168146126 1125262549 /nfs/dbraw/zinc/26/25/49/1125262549.db2.gz QEVFKXHMUGLMFX-CYBMUJFWSA-N 1 2 292.379 3.559 20 5 CHBDLO c1n[nH]cc1Nc1ccc2[nH+]c3ccccc3cc2c1 ZINC001174297489 1132777978 /nfs/dbraw/zinc/77/79/78/1132777978.db2.gz HQUMKXVRRYQZPD-UHFFFAOYSA-N 1 2 260.300 3.855 20 5 CHBDLO Cc1cc[nH+]c2cc(Nc3ccc([N+](=O)[O-])nc3)ccc12 ZINC001203580550 1133341568 /nfs/dbraw/zinc/34/15/68/1133341568.db2.gz MHFIJQFIOAQHMK-UHFFFAOYSA-N 1 2 280.287 3.590 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1cc(Cl)c2[nH+]ccn2c1 ZINC001206150113 1133664671 /nfs/dbraw/zinc/66/46/71/1133664671.db2.gz BYLUCEUHMCNARQ-UHFFFAOYSA-N 1 2 288.694 3.640 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001210955433 1134339033 /nfs/dbraw/zinc/33/90/33/1134339033.db2.gz HNMHTARGJGNIDO-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1c(F)ccc([N+](=O)[O-])c1F ZINC001215292129 1134614909 /nfs/dbraw/zinc/61/49/09/1134614909.db2.gz NZXODPDLINTLGI-UHFFFAOYSA-N 1 2 293.273 3.882 20 5 CHBDLO Cc1c[nH+]c(C)c(NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000404756945 1134949191 /nfs/dbraw/zinc/94/91/91/1134949191.db2.gz LUIUZMXEMYFVGV-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000035164251 172025705 /nfs/dbraw/zinc/02/57/05/172025705.db2.gz LTFINTSFGPRRRW-GFCCVEGCSA-N 1 2 285.347 3.834 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353904586 226166372 /nfs/dbraw/zinc/16/63/72/226166372.db2.gz ATBTTWAWRVNQCK-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353904586 226166376 /nfs/dbraw/zinc/16/63/76/226166376.db2.gz ATBTTWAWRVNQCK-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO COc1cc(C[N@@H+]2Cc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000352540718 227048423 /nfs/dbraw/zinc/04/84/23/227048423.db2.gz ONKHZRJPAPTIGJ-GFCCVEGCSA-N 1 2 298.342 3.680 20 5 CHBDLO COc1cc(C[N@H+]2Cc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000352540718 227048428 /nfs/dbraw/zinc/04/84/28/227048428.db2.gz ONKHZRJPAPTIGJ-GFCCVEGCSA-N 1 2 298.342 3.680 20 5 CHBDLO O=[N+]([O-])c1ccccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000090803315 260262617 /nfs/dbraw/zinc/26/26/17/260262617.db2.gz BNFUBFGWYLINIL-UHFFFAOYSA-N 1 2 297.236 3.621 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000292718895 263134239 /nfs/dbraw/zinc/13/42/39/263134239.db2.gz FCEKFAULSGPSKD-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000292718895 263134240 /nfs/dbraw/zinc/13/42/40/263134240.db2.gz FCEKFAULSGPSKD-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO Cc1cc[nH+]c(NCc2cccc([N+](=O)[O-])c2C)c1Cl ZINC000557682106 327020586 /nfs/dbraw/zinc/02/05/86/327020586.db2.gz KDUZRGXDTBTNIC-UHFFFAOYSA-N 1 2 291.738 3.872 20 5 CHBDLO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]c1ccc2c(c1)CCN2 ZINC000423219217 330178975 /nfs/dbraw/zinc/17/89/75/330178975.db2.gz SXQCUBBMOAINPG-GFCCVEGCSA-N 1 2 297.358 3.606 20 5 CHBDLO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CC[NH2+]2 ZINC000423219217 330178977 /nfs/dbraw/zinc/17/89/77/330178977.db2.gz SXQCUBBMOAINPG-GFCCVEGCSA-N 1 2 297.358 3.606 20 5 CHBDLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000423218653 330179213 /nfs/dbraw/zinc/17/92/13/330179213.db2.gz SEWINNJUCQXRLG-NSHDSACASA-N 1 2 283.331 3.736 20 5 CHBDLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000450830953 331001680 /nfs/dbraw/zinc/00/16/80/331001680.db2.gz OVZKMYFBSMDFLQ-SECBINFHSA-N 1 2 294.742 3.638 20 5 CHBDLO C[C@]1(F)CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000451116850 331016295 /nfs/dbraw/zinc/01/62/95/331016295.db2.gz SQYGAEWBVUNOMC-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@]1(F)CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000451116850 331016296 /nfs/dbraw/zinc/01/62/96/331016296.db2.gz SQYGAEWBVUNOMC-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000080308808 334170487 /nfs/dbraw/zinc/17/04/87/334170487.db2.gz IPMHXQNPXJSGRT-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC=C(F)C1 ZINC000352783664 534346265 /nfs/dbraw/zinc/34/62/65/534346265.db2.gz KEEZCGSNKVMMRA-LLVKDONJSA-N 1 2 264.300 3.523 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC=C(F)C1 ZINC000352783664 534346279 /nfs/dbraw/zinc/34/62/79/534346279.db2.gz KEEZCGSNKVMMRA-LLVKDONJSA-N 1 2 264.300 3.523 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC=C(F)C1 ZINC000352783665 534347590 /nfs/dbraw/zinc/34/75/90/534347590.db2.gz KEEZCGSNKVMMRA-NSHDSACASA-N 1 2 264.300 3.523 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC=C(F)C1 ZINC000352783665 534347600 /nfs/dbraw/zinc/34/76/00/534347600.db2.gz KEEZCGSNKVMMRA-NSHDSACASA-N 1 2 264.300 3.523 20 5 CHBDLO Cc1cc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)nc(C2CC2)[nH+]1 ZINC000116260128 1125509209 /nfs/dbraw/zinc/50/92/09/1125509209.db2.gz PYEYMOOAVOLVLG-NSHDSACASA-N 1 2 298.346 3.744 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000595701842 1127472878 /nfs/dbraw/zinc/47/28/78/1127472878.db2.gz GQHIXCYOWZRECV-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H]1c1ccc(F)cc1 ZINC000595701842 1127472881 /nfs/dbraw/zinc/47/28/81/1127472881.db2.gz GQHIXCYOWZRECV-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO CCC(F)(F)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000599068237 1127655450 /nfs/dbraw/zinc/65/54/50/1127655450.db2.gz HBRSBHFPLWQBJZ-CYBMUJFWSA-N 1 2 284.306 3.607 20 5 CHBDLO C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543853396 1127949202 /nfs/dbraw/zinc/94/92/02/1127949202.db2.gz SLHPKBWAUNCZIK-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543853396 1127949204 /nfs/dbraw/zinc/94/92/04/1127949204.db2.gz SLHPKBWAUNCZIK-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000610504856 1118586285 /nfs/dbraw/zinc/58/62/85/1118586285.db2.gz BWESEOHNFLDSPG-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000610504856 1118586287 /nfs/dbraw/zinc/58/62/87/1118586287.db2.gz BWESEOHNFLDSPG-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788860 1122615596 /nfs/dbraw/zinc/61/55/96/1122615596.db2.gz ARBAKKYXSVBECD-SWLSCSKDSA-N 1 2 292.379 3.701 20 5 CHBDLO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788860 1122615600 /nfs/dbraw/zinc/61/56/00/1122615600.db2.gz ARBAKKYXSVBECD-SWLSCSKDSA-N 1 2 292.379 3.701 20 5 CHBDLO Cc1cc[nH+]c(C(C)C)c1Nc1cc(O)cc([N+](=O)[O-])c1 ZINC001199828927 1123042428 /nfs/dbraw/zinc/04/24/28/1123042428.db2.gz ZPQCMETVYZDWQC-UHFFFAOYSA-N 1 2 287.319 3.871 20 5 CHBDLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccns1 ZINC000872090204 1124680644 /nfs/dbraw/zinc/68/06/44/1124680644.db2.gz NUFXJGAORJTOSN-RKDXNWHRSA-N 1 2 295.339 3.602 20 5 CHBDLO C[N@H+](Cc1ccsc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116270772 1129844168 /nfs/dbraw/zinc/84/41/68/1129844168.db2.gz UOYZMBVUBAERLS-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1ccsc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116270772 1129844173 /nfs/dbraw/zinc/84/41/73/1129844173.db2.gz UOYZMBVUBAERLS-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO CC[N@H+](CCC(F)(F)F)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748305406 1130229333 /nfs/dbraw/zinc/22/93/33/1130229333.db2.gz JGUBMDHWQGZMBT-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO CC[N@@H+](CCC(F)(F)F)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748305406 1130229338 /nfs/dbraw/zinc/22/93/38/1130229338.db2.gz JGUBMDHWQGZMBT-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000748820952 1130249920 /nfs/dbraw/zinc/24/99/20/1130249920.db2.gz ZVBYEVDAELDHEM-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000748820952 1130249923 /nfs/dbraw/zinc/24/99/23/1130249923.db2.gz ZVBYEVDAELDHEM-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001206158072 1133665281 /nfs/dbraw/zinc/66/52/81/1133665281.db2.gz QQDWCYAYIGTKCQ-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001211192845 1134388781 /nfs/dbraw/zinc/38/87/81/1134388781.db2.gz QIPUBCDHPLNDBS-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO Cc1cc(C)c(Nc2cc([N+](=O)[O-])ccc2C)c[nH+]1 ZINC001211285846 1134402809 /nfs/dbraw/zinc/40/28/09/1134402809.db2.gz LCCLHDVBVJGTEC-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1ccc2c(c1)[nH+]cn2C ZINC001211289016 1134403782 /nfs/dbraw/zinc/40/37/82/1134403782.db2.gz GCEHHUXCFFGPHC-UHFFFAOYSA-N 1 2 282.303 3.534 20 5 CHBDLO CCC[C@@H]([NH2+]CC(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000574828114 335051189 /nfs/dbraw/zinc/05/11/89/335051189.db2.gz JHDBFHSFBCETII-GFCCVEGCSA-N 1 2 272.295 3.681 20 5 CHBDLO Cc1ccc2[nH+]c(CSc3cccc([N+](=O)[O-])c3)cn2c1 ZINC000509089686 332858766 /nfs/dbraw/zinc/85/87/66/332858766.db2.gz LEWXRHQRXHPOTH-UHFFFAOYSA-N 1 2 299.355 3.843 20 5 CHBDLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000220951567 333171021 /nfs/dbraw/zinc/17/10/21/333171021.db2.gz RTVCQCDJYQSOGP-NWDGAFQWSA-N 1 2 289.335 3.611 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000582014263 336192211 /nfs/dbraw/zinc/19/22/11/336192211.db2.gz MFPJIHRBPYIHRB-MNOVXSKESA-N 1 2 291.376 3.772 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000292840957 520478325 /nfs/dbraw/zinc/47/83/25/520478325.db2.gz SDJQNTOSIDFDCB-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000292840957 520478335 /nfs/dbraw/zinc/47/83/35/520478335.db2.gz SDJQNTOSIDFDCB-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO Cc1ccc([C@@H](C)Nc2cc[nH+]c(C3CC3)n2)cc1[N+](=O)[O-] ZINC000267766127 525752226 /nfs/dbraw/zinc/75/22/26/525752226.db2.gz ZJDWLUUJIQLTGE-LLVKDONJSA-N 1 2 298.346 3.744 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000353700048 529125017 /nfs/dbraw/zinc/12/50/17/529125017.db2.gz VGKAVZIEGYIEAG-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000353700048 529125019 /nfs/dbraw/zinc/12/50/19/529125019.db2.gz VGKAVZIEGYIEAG-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000348314750 1125534183 /nfs/dbraw/zinc/53/41/83/1125534183.db2.gz ZSSVLOIBONLBTE-NXEZZACHSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)cc1[N+](=O)[O-] ZINC000271430684 1127080336 /nfs/dbraw/zinc/08/03/36/1127080336.db2.gz BYMDPBSCBBBVIQ-MNOVXSKESA-N 1 2 291.376 3.772 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348541386 1127121546 /nfs/dbraw/zinc/12/15/46/1127121546.db2.gz WTENIOCTGZRILN-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000348541386 1127121548 /nfs/dbraw/zinc/12/15/48/1127121548.db2.gz WTENIOCTGZRILN-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1F ZINC000072555781 1117762454 /nfs/dbraw/zinc/76/24/54/1117762454.db2.gz WQODELWKJFUNGA-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1F ZINC000072555781 1117762457 /nfs/dbraw/zinc/76/24/57/1117762457.db2.gz WQODELWKJFUNGA-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO Cc1cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc[nH+]1 ZINC000188093753 1119664475 /nfs/dbraw/zinc/66/44/75/1119664475.db2.gz MLBGVENENMWMHA-UHFFFAOYSA-N 1 2 299.330 3.674 20 5 CHBDLO Cn1c[nH+]c2cc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)ccc21 ZINC001175903288 1121495639 /nfs/dbraw/zinc/49/56/39/1121495639.db2.gz VNABBJYMDBDIBR-CMDGGOBGSA-N 1 2 294.314 3.564 20 5 CHBDLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000194978840 1129140273 /nfs/dbraw/zinc/14/02/73/1129140273.db2.gz JSJMLOCGVQHKQA-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000194978840 1129140276 /nfs/dbraw/zinc/14/02/76/1129140276.db2.gz JSJMLOCGVQHKQA-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO CC(C)C[C@@H]1CCC[N@H+](Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC001168146128 1125262071 /nfs/dbraw/zinc/26/20/71/1125262071.db2.gz QEVFKXHMUGLMFX-ZDUSSCGKSA-N 1 2 292.379 3.559 20 5 CHBDLO CC(C)C[C@@H]1CCC[N@@H+](Cc2cc(O)ccc2[N+](=O)[O-])C1 ZINC001168146128 1125262075 /nfs/dbraw/zinc/26/20/75/1125262075.db2.gz QEVFKXHMUGLMFX-ZDUSSCGKSA-N 1 2 292.379 3.559 20 5 CHBDLO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1cscn1 ZINC000826972529 1130322348 /nfs/dbraw/zinc/32/23/48/1130322348.db2.gz FMILMELPZYVFQY-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1ccc2[nH+]c(NCc3ccc(C)c([N+](=O)[O-])c3)[nH]c2c1 ZINC001203478817 1133332296 /nfs/dbraw/zinc/33/22/96/1133332296.db2.gz JPSXRTDJTDODOL-UHFFFAOYSA-N 1 2 296.330 3.700 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1ccccc1-n1cc[nH+]c1 ZINC001206158229 1133665557 /nfs/dbraw/zinc/66/55/57/1133665557.db2.gz SMGSJDKUMUOMNH-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO Cc1c[nH+]c(Nc2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC001211287863 1134403480 /nfs/dbraw/zinc/40/34/80/1134403480.db2.gz XMIMHTAFLZVJLZ-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO O=[N+]([O-])c1cc(F)cc(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001216481768 1134904358 /nfs/dbraw/zinc/90/43/58/1134904358.db2.gz CIRPWCMJDYZLJA-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000035699692 172367823 /nfs/dbraw/zinc/36/78/23/172367823.db2.gz FIAXTRCOIOXKRW-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000035699692 172367826 /nfs/dbraw/zinc/36/78/26/172367826.db2.gz FIAXTRCOIOXKRW-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc2c(c1)CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000361738490 266877078 /nfs/dbraw/zinc/87/70/78/266877078.db2.gz XLRYXTOYRMEBBK-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1ccc2c(c1)CC[N@H+](Cc1csc([N+](=O)[O-])c1)C2 ZINC000361738490 266877081 /nfs/dbraw/zinc/87/70/81/266877081.db2.gz XLRYXTOYRMEBBK-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1ccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c(C)[nH+]1 ZINC000570940759 327680640 /nfs/dbraw/zinc/68/06/40/327680640.db2.gz IIMPCOGXPYLTFL-HNNXBMFYSA-N 1 2 283.331 3.706 20 5 CHBDLO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]c1ccc2c(c1)CCN2 ZINC000423219219 330179166 /nfs/dbraw/zinc/17/91/66/330179166.db2.gz SXQCUBBMOAINPG-LBPRGKRZSA-N 1 2 297.358 3.606 20 5 CHBDLO C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CC[NH2+]2 ZINC000423219219 330179167 /nfs/dbraw/zinc/17/91/67/330179167.db2.gz SXQCUBBMOAINPG-LBPRGKRZSA-N 1 2 297.358 3.606 20 5 CHBDLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000423213901 330184495 /nfs/dbraw/zinc/18/44/95/330184495.db2.gz KNEOIIQEXSRWFK-LLVKDONJSA-N 1 2 283.331 3.736 20 5 CHBDLO Cc1cc(C)c(CNc2cc(C)c([N+](=O)[O-])cc2F)c[nH+]1 ZINC000396994068 330235635 /nfs/dbraw/zinc/23/56/35/330235635.db2.gz WEHUMSHWBWRIPU-UHFFFAOYSA-N 1 2 289.310 3.666 20 5 CHBDLO C[N@H+](Cc1cccc(F)c1F)Cc1ccccc1[N+](=O)[O-] ZINC000046599236 330354780 /nfs/dbraw/zinc/35/47/80/330354780.db2.gz AOURGIFLWOXSRT-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1cccc(F)c1F)Cc1ccccc1[N+](=O)[O-] ZINC000046599236 330354781 /nfs/dbraw/zinc/35/47/81/330354781.db2.gz AOURGIFLWOXSRT-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO Cc1cc[nH+]c(NCCc2cccc([N+](=O)[O-])c2)c1Cl ZINC000553477028 334387185 /nfs/dbraw/zinc/38/71/85/334387185.db2.gz ZBUYUMBHCMYOQV-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO C[C@@H]1C[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])c2[nH+]ccn21 ZINC000345366280 335318663 /nfs/dbraw/zinc/31/86/63/335318663.db2.gz ZNHOWTNSULTDRS-LDYMZIIASA-N 1 2 292.726 3.563 20 5 CHBDLO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000290370334 521445911 /nfs/dbraw/zinc/44/59/11/521445911.db2.gz HIUOZEQOSODFDT-LLVKDONJSA-N 1 2 291.376 3.634 20 5 CHBDLO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000290370334 521445919 /nfs/dbraw/zinc/44/59/19/521445919.db2.gz HIUOZEQOSODFDT-LLVKDONJSA-N 1 2 291.376 3.634 20 5 CHBDLO CC(C)c1ccc(C[NH2+][C@H](C)c2ccon2)cc1[N+](=O)[O-] ZINC000351580912 528102054 /nfs/dbraw/zinc/10/20/54/528102054.db2.gz MKDBMQXMJTZWJM-LLVKDONJSA-N 1 2 289.335 3.557 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000266431417 1126982242 /nfs/dbraw/zinc/98/22/42/1126982242.db2.gz DESBRKIVOYDJSJ-ZJUUUORDSA-N 1 2 291.376 3.772 20 5 CHBDLO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000293880601 1127529157 /nfs/dbraw/zinc/52/91/57/1127529157.db2.gz JRWPGCDGXKPEES-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000293880601 1127529160 /nfs/dbraw/zinc/52/91/60/1127529160.db2.gz JRWPGCDGXKPEES-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1cccc([N+](=O)[O-])c1 ZINC000296394824 1127670665 /nfs/dbraw/zinc/67/06/65/1127670665.db2.gz VHADBFNIRQZLMD-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO C[N@H+](Cc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000061781525 1127716814 /nfs/dbraw/zinc/71/68/14/1127716814.db2.gz WZYUVYNBSMUVKZ-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1ccccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000061781525 1127716817 /nfs/dbraw/zinc/71/68/17/1127716817.db2.gz WZYUVYNBSMUVKZ-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO CSc1cc(Nc2ccc(F)c([N+](=O)[O-])c2)cc[nH+]1 ZINC001211191272 1118476259 /nfs/dbraw/zinc/47/62/59/1118476259.db2.gz RHRXKOXILKEHOI-UHFFFAOYSA-N 1 2 279.296 3.594 20 5 CHBDLO Cc1ccc(NCCCc2cccc(C)[nH+]2)c([N+](=O)[O-])c1 ZINC000343219528 1119354915 /nfs/dbraw/zinc/35/49/15/1119354915.db2.gz CZQXKGRCMZHVKC-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO Cc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC000094664049 1120053952 /nfs/dbraw/zinc/05/39/52/1120053952.db2.gz HOLSOXGWRQWMLS-NSHDSACASA-N 1 2 271.320 3.780 20 5 CHBDLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000225316568 1120270147 /nfs/dbraw/zinc/27/01/47/1120270147.db2.gz MSNKBBQPGLCKRW-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1cc(Oc2cccc(-n3cc[nH+]c3)c2)ccc1[N+](=O)[O-] ZINC000301966845 1120506778 /nfs/dbraw/zinc/50/67/78/1120506778.db2.gz VXPJJVQFWVXGNL-UHFFFAOYSA-N 1 2 295.298 3.881 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000047264829 1120644741 /nfs/dbraw/zinc/64/47/41/1120644741.db2.gz VRCKRJJINDPHOF-UHFFFAOYSA-N 1 2 276.361 3.597 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000047264829 1120644743 /nfs/dbraw/zinc/64/47/43/1120644743.db2.gz VRCKRJJINDPHOF-UHFFFAOYSA-N 1 2 276.361 3.597 20 5 CHBDLO C[C@@H](c1cccs1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864136 1122573699 /nfs/dbraw/zinc/57/36/99/1122573699.db2.gz JXZUQRCCKCDCSO-JTQLQIEISA-N 1 2 294.351 3.988 20 5 CHBDLO C[C@@H](c1cccs1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864136 1122573702 /nfs/dbraw/zinc/57/37/02/1122573702.db2.gz JXZUQRCCKCDCSO-JTQLQIEISA-N 1 2 294.351 3.988 20 5 CHBDLO CC[C@H](C)[C@H](C)[N@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964282 1123496862 /nfs/dbraw/zinc/49/68/62/1123496862.db2.gz XVHKPTBIOQZORD-RYUDHWBXSA-N 1 2 292.379 3.699 20 5 CHBDLO CC[C@H](C)[C@H](C)[N@@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964282 1123496864 /nfs/dbraw/zinc/49/68/64/1123496864.db2.gz XVHKPTBIOQZORD-RYUDHWBXSA-N 1 2 292.379 3.699 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000449630232 1124825532 /nfs/dbraw/zinc/82/55/32/1124825532.db2.gz HGHFCNIEAMDSFA-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000449630232 1124825542 /nfs/dbraw/zinc/82/55/42/1124825542.db2.gz HGHFCNIEAMDSFA-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1 ZINC000449630226 1124825935 /nfs/dbraw/zinc/82/59/35/1124825935.db2.gz HGHFCNIEAMDSFA-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1 ZINC000449630226 1124825954 /nfs/dbraw/zinc/82/59/54/1124825954.db2.gz HGHFCNIEAMDSFA-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO CCc1ccc(C)[nH+]c1Nc1ccc([N+](=O)[O-])cc1 ZINC001174475517 1132880108 /nfs/dbraw/zinc/88/01/08/1132880108.db2.gz HPOUEDSYJAYCPX-UHFFFAOYSA-N 1 2 257.293 3.604 20 5 CHBDLO Cc1ccc2c(Nc3ccc([N+](=O)[O-])nc3)cccc2[nH+]1 ZINC001203575888 1133341211 /nfs/dbraw/zinc/34/12/11/1133341211.db2.gz JEYUKVPQPCRMPI-UHFFFAOYSA-N 1 2 280.287 3.590 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(N2CCCC2)[nH+]c1 ZINC001211288306 1134403820 /nfs/dbraw/zinc/40/38/20/1134403820.db2.gz OXSQUVVHXSROHH-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000352619144 227117686 /nfs/dbraw/zinc/11/76/86/227117686.db2.gz ZMVPELIQUZWLCQ-LLVKDONJSA-N 1 2 286.306 3.811 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000352619144 227117689 /nfs/dbraw/zinc/11/76/89/227117689.db2.gz ZMVPELIQUZWLCQ-LLVKDONJSA-N 1 2 286.306 3.811 20 5 CHBDLO Cc1cc(C)c(CNc2ccc([N+](=O)[O-])c(C)c2)c[nH+]1 ZINC000397084805 330237884 /nfs/dbraw/zinc/23/78/84/330237884.db2.gz IPXFOEUVNFXQGX-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1c2oc3cc(O)ccc3c2[nH+]c2cc3c(cc12)OCO3 ZINC000436659158 330682410 /nfs/dbraw/zinc/68/24/10/330682410.db2.gz OFTNHFFOASERGB-UHFFFAOYSA-N 1 2 293.278 3.877 20 5 CHBDLO CCn1cc[nH+]c1[C@H](C)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000450830955 331001617 /nfs/dbraw/zinc/00/16/17/331001617.db2.gz OVZKMYFBSMDFLQ-VIFPVBQESA-N 1 2 294.742 3.638 20 5 CHBDLO Cc1c([C@@H](C)[NH2+][C@H](C)C(C)(F)F)cccc1[N+](=O)[O-] ZINC000453291433 331111769 /nfs/dbraw/zinc/11/17/69/331111769.db2.gz NEDHBCSTFHMUFE-NXEZZACHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000220951749 333171225 /nfs/dbraw/zinc/17/12/25/333171225.db2.gz RTVCQCDJYQSOGP-NEPJUHHUSA-N 1 2 289.335 3.611 20 5 CHBDLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000220951633 333171245 /nfs/dbraw/zinc/17/12/45/333171245.db2.gz RTVCQCDJYQSOGP-RYUDHWBXSA-N 1 2 289.335 3.611 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2c2ccco2)cs1 ZINC000331581335 534879608 /nfs/dbraw/zinc/87/96/08/534879608.db2.gz JTYJLOOTNAOHFQ-GFCCVEGCSA-N 1 2 292.360 3.977 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2c2ccco2)cs1 ZINC000331581335 534879611 /nfs/dbraw/zinc/87/96/11/534879611.db2.gz JTYJLOOTNAOHFQ-GFCCVEGCSA-N 1 2 292.360 3.977 20 5 CHBDLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000109784886 1125469515 /nfs/dbraw/zinc/46/95/15/1125469515.db2.gz WFIUQNUXGFXOLJ-JTQLQIEISA-N 1 2 292.360 3.555 20 5 CHBDLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000109784886 1125469516 /nfs/dbraw/zinc/46/95/16/1125469516.db2.gz WFIUQNUXGFXOLJ-JTQLQIEISA-N 1 2 292.360 3.555 20 5 CHBDLO CC[C@@](C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1nccs1 ZINC000152602227 1126757703 /nfs/dbraw/zinc/75/77/03/1126757703.db2.gz ZNTFJIHTXCEMFM-GFCCVEGCSA-N 1 2 297.405 3.528 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000266431413 1126982499 /nfs/dbraw/zinc/98/24/99/1126982499.db2.gz DESBRKIVOYDJSJ-UWVGGRQHSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1ccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c(C)[nH+]1 ZINC000570940760 1127150356 /nfs/dbraw/zinc/15/03/56/1127150356.db2.gz IIMPCOGXPYLTFL-OAHLLOKOSA-N 1 2 283.331 3.706 20 5 CHBDLO C[C@H]1c2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353901734 1127277429 /nfs/dbraw/zinc/27/74/29/1127277429.db2.gz SCOQUXGKFLUVDH-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353901734 1127277430 /nfs/dbraw/zinc/27/74/30/1127277430.db2.gz SCOQUXGKFLUVDH-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO CC(C)C[N@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CCCC1 ZINC001167218544 1118102495 /nfs/dbraw/zinc/10/24/95/1118102495.db2.gz PLWINEJWRYQRKG-UHFFFAOYSA-N 1 2 292.379 3.701 20 5 CHBDLO CC(C)C[N@@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CCCC1 ZINC001167218544 1118102497 /nfs/dbraw/zinc/10/24/97/1118102497.db2.gz PLWINEJWRYQRKG-UHFFFAOYSA-N 1 2 292.379 3.701 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])sc1C ZINC000342308823 1118972518 /nfs/dbraw/zinc/97/25/18/1118972518.db2.gz UJSBPWPIJYBQJT-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505614312 1122439720 /nfs/dbraw/zinc/43/97/20/1122439720.db2.gz XDWZNVSDEGIICX-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505614312 1122439724 /nfs/dbraw/zinc/43/97/24/1122439724.db2.gz XDWZNVSDEGIICX-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cs1 ZINC000126584183 1122707222 /nfs/dbraw/zinc/70/72/22/1122707222.db2.gz KPMCPNDKNONTQH-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000282671310 1129278790 /nfs/dbraw/zinc/27/87/90/1129278790.db2.gz JCXASOVEAXSIEA-NWDGAFQWSA-N 1 2 289.335 3.611 20 5 CHBDLO C[N@H+](Cc1ccsc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746652326 1130133885 /nfs/dbraw/zinc/13/38/85/1130133885.db2.gz HCRMRRNOOUBKAT-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1ccsc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746652326 1130133888 /nfs/dbraw/zinc/13/38/88/1130133888.db2.gz HCRMRRNOOUBKAT-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO Cn1cc(Nc2ccc3[nH+]c4ccccc4cc3c2)cn1 ZINC001174331379 1132795426 /nfs/dbraw/zinc/79/54/26/1132795426.db2.gz JAILAMNQZBSPCA-UHFFFAOYSA-N 1 2 274.327 3.865 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccccc1[N+](=O)[O-] ZINC001206157785 1133665369 /nfs/dbraw/zinc/66/53/69/1133665369.db2.gz BNGJBTZQHBUKGL-UHFFFAOYSA-N 1 2 257.293 3.604 20 5 CHBDLO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccco1 ZINC000035738454 172391910 /nfs/dbraw/zinc/39/19/10/172391910.db2.gz IEBIPGOYIKTLEL-VIFPVBQESA-N 1 2 280.711 3.692 20 5 CHBDLO CC(C)[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1[nH]cc[nH+]1 ZINC000357543238 266318891 /nfs/dbraw/zinc/31/88/91/266318891.db2.gz BQEAPMGKHILHJY-GFCCVEGCSA-N 1 2 294.742 3.781 20 5 CHBDLO Cc1c(C[N@H+](CC(F)F)CC2CCC2)cccc1[N+](=O)[O-] ZINC000536419887 327236787 /nfs/dbraw/zinc/23/67/87/327236787.db2.gz HQKXOFPSALYLPL-UHFFFAOYSA-N 1 2 298.333 3.770 20 5 CHBDLO Cc1c(C[N@@H+](CC(F)F)CC2CCC2)cccc1[N+](=O)[O-] ZINC000536419887 327236788 /nfs/dbraw/zinc/23/67/88/327236788.db2.gz HQKXOFPSALYLPL-UHFFFAOYSA-N 1 2 298.333 3.770 20 5 CHBDLO O=[N+]([O-])c1cccc(C[NH2+]C2(C(F)F)CCCCC2)c1 ZINC000510075085 332890632 /nfs/dbraw/zinc/89/06/32/332890632.db2.gz SZYYBIOVJHKKLE-UHFFFAOYSA-N 1 2 284.306 3.652 20 5 CHBDLO Cc1cc(C)c(CNc2ccc([N+](=O)[O-])cc2C)c[nH+]1 ZINC000397082136 330237750 /nfs/dbraw/zinc/23/77/50/330237750.db2.gz HTRVYGDAKCIYLO-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1cccc(CCNc2c(Cl)cccc2[N+](=O)[O-])[nH+]1 ZINC000432163854 330594274 /nfs/dbraw/zinc/59/42/74/330594274.db2.gz SBTOHAUIDAHRLI-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO CC[C@H]([NH2+][C@@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242963 331106384 /nfs/dbraw/zinc/10/63/84/331106384.db2.gz IRHHIWFCRJWPGM-RYUDHWBXSA-N 1 2 272.295 3.679 20 5 CHBDLO Cc1c([C@H](C)[NH2+][C@@H](C)C(C)(F)F)cccc1[N+](=O)[O-] ZINC000453291435 331111704 /nfs/dbraw/zinc/11/17/04/331111704.db2.gz NEDHBCSTFHMUFE-UWVGGRQHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2cccc(F)c2C1 ZINC000459709954 331295377 /nfs/dbraw/zinc/29/53/77/331295377.db2.gz KWWREVPGVASKIU-UHFFFAOYSA-N 1 2 286.306 3.558 20 5 CHBDLO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2cccc(F)c2C1 ZINC000459709954 331295378 /nfs/dbraw/zinc/29/53/78/331295378.db2.gz KWWREVPGVASKIU-UHFFFAOYSA-N 1 2 286.306 3.558 20 5 CHBDLO O=[N+]([O-])c1ccc(CSCc2cn3ccccc3[nH+]2)cc1 ZINC000176906901 333050191 /nfs/dbraw/zinc/05/01/91/333050191.db2.gz HFCGJOQPVSNRCS-UHFFFAOYSA-N 1 2 299.355 3.676 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)c1ncc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000220951480 333171133 /nfs/dbraw/zinc/17/11/33/333171133.db2.gz MIQMQWBLRCCMHW-RISCZKNCSA-N 1 2 289.335 3.693 20 5 CHBDLO O=[N+]([O-])c1ccc(CCNc2ccc3ccccc3[nH+]2)cc1 ZINC000315820076 333383894 /nfs/dbraw/zinc/38/38/94/333383894.db2.gz XDKQRIGLVZKLSJ-UHFFFAOYSA-N 1 2 293.326 3.798 20 5 CHBDLO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000081574286 334197487 /nfs/dbraw/zinc/19/74/87/334197487.db2.gz OGZMAUFXCNEEPY-ABAIWWIYSA-N 1 2 288.372 3.849 20 5 CHBDLO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000081574286 334197488 /nfs/dbraw/zinc/19/74/88/334197488.db2.gz OGZMAUFXCNEEPY-ABAIWWIYSA-N 1 2 288.372 3.849 20 5 CHBDLO Cc1cc([NH+](C)C)ccc1NCc1csc([N+](=O)[O-])c1 ZINC000057846554 525023817 /nfs/dbraw/zinc/02/38/17/525023817.db2.gz HQMZRUKVYQTQIB-UHFFFAOYSA-N 1 2 291.376 3.643 20 5 CHBDLO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000267012399 1126991834 /nfs/dbraw/zinc/99/18/34/1126991834.db2.gz HTTVKAOSXDMINV-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000267012399 1126991836 /nfs/dbraw/zinc/99/18/36/1126991836.db2.gz HTTVKAOSXDMINV-JTQLQIEISA-N 1 2 278.283 3.520 20 5 CHBDLO CCc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000268417091 1127017747 /nfs/dbraw/zinc/01/77/47/1127017747.db2.gz JYMLEBQRNACTGQ-UHFFFAOYSA-N 1 2 294.738 3.693 20 5 CHBDLO O=[N+]([O-])c1cc(CNc2c[nH+]cc3c2CCCC3)cs1 ZINC000594953853 1127440019 /nfs/dbraw/zinc/44/00/19/1127440019.db2.gz JEUNHYHQRKHBQF-UHFFFAOYSA-N 1 2 289.360 3.542 20 5 CHBDLO CC(C)[N@H+](Cc1ccco1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296321 1127457023 /nfs/dbraw/zinc/45/70/23/1127457023.db2.gz AIDRLJHITPYOFQ-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO CC(C)[N@@H+](Cc1ccco1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296321 1127457024 /nfs/dbraw/zinc/45/70/24/1127457024.db2.gz AIDRLJHITPYOFQ-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO Cc1cc(NCc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])s1 ZINC000596276888 1127487731 /nfs/dbraw/zinc/48/77/31/1127487731.db2.gz ACAKDRZLPMBUDI-UHFFFAOYSA-N 1 2 277.349 3.589 20 5 CHBDLO Cc1c[nH+]c(C)c(NCc2ccc([N+](=O)[O-])cc2C)c1 ZINC000593223148 1127516976 /nfs/dbraw/zinc/51/69/76/1127516976.db2.gz WYCPURZVMWKKJC-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1cc([NH+]2CCCC2)ccc1Nc1cccnc1[N+](=O)[O-] ZINC000603838965 1127673679 /nfs/dbraw/zinc/67/36/79/1127673679.db2.gz YQHOELLUCMTYNH-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO C[N@H+](Cc1cccc(F)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540518 1128671416 /nfs/dbraw/zinc/67/14/16/1128671416.db2.gz UPGLKXKYAJHUDO-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1cccc(F)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540518 1128671418 /nfs/dbraw/zinc/67/14/18/1128671418.db2.gz UPGLKXKYAJHUDO-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000090888699 1119546808 /nfs/dbraw/zinc/54/68/08/1119546808.db2.gz KUAWAJKOHKENPE-SECBINFHSA-N 1 2 291.376 3.519 20 5 CHBDLO C[C@H](c1ccccc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465211 1120252987 /nfs/dbraw/zinc/25/29/87/1120252987.db2.gz VVLFGMMILRAUNU-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@H](c1ccccc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465211 1120252992 /nfs/dbraw/zinc/25/29/92/1120252992.db2.gz VVLFGMMILRAUNU-GFCCVEGCSA-N 1 2 288.322 3.927 20 5 CHBDLO O=[N+]([O-])c1ccc(F)c(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001175736203 1121441916 /nfs/dbraw/zinc/44/19/16/1121441916.db2.gz VALMQFHLQAOLFM-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO O=[N+]([O-])c1ccc(F)c(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001175736594 1121442969 /nfs/dbraw/zinc/44/29/69/1121442969.db2.gz BXCDXZNEIONIHR-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC001176362500 1121614336 /nfs/dbraw/zinc/61/43/36/1121614336.db2.gz DQYAPMKTSCDYLP-UHFFFAOYSA-N 1 2 287.319 3.613 20 5 CHBDLO C[C@@H](c1cccs1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054173021 1122791941 /nfs/dbraw/zinc/79/19/41/1122791941.db2.gz JSADUCVIHREJER-VIFPVBQESA-N 1 2 282.390 3.911 20 5 CHBDLO C[C@@H](c1cccs1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054173021 1122791943 /nfs/dbraw/zinc/79/19/43/1122791943.db2.gz JSADUCVIHREJER-VIFPVBQESA-N 1 2 282.390 3.911 20 5 CHBDLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccnc1 ZINC000872017455 1124657301 /nfs/dbraw/zinc/65/73/01/1124657301.db2.gz CCGVYDICYRLJKK-GHMZBOCLSA-N 1 2 289.310 3.541 20 5 CHBDLO C[NH+]1CC(Oc2ccc3cc4ccccc4cc3c2)C1 ZINC001231098131 1132256421 /nfs/dbraw/zinc/25/64/21/1132256421.db2.gz QUPUCVDOIWJLAN-UHFFFAOYSA-N 1 2 263.340 3.686 20 5 CHBDLO Cc1ccc(NCCc2[nH+]cc(C)cc2C)c([N+](=O)[O-])c1 ZINC001163618229 1133162915 /nfs/dbraw/zinc/16/29/15/1133162915.db2.gz NXDHNMXWGUWCPW-UHFFFAOYSA-N 1 2 285.347 3.570 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC001216487136 1134905887 /nfs/dbraw/zinc/90/58/87/1134905887.db2.gz NVYDTOVWAGAFRO-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC001216487136 1134905892 /nfs/dbraw/zinc/90/58/92/1134905892.db2.gz NVYDTOVWAGAFRO-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO O=[N+]([O-])c1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000078592001 260168333 /nfs/dbraw/zinc/16/83/33/260168333.db2.gz IYDFRZYCEKIABE-UHFFFAOYSA-N 1 2 297.236 3.621 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000080260563 260178933 /nfs/dbraw/zinc/17/89/33/260178933.db2.gz SOYIYJOCDBOVDG-JQWIXIFHSA-N 1 2 291.376 3.853 20 5 CHBDLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000559854293 327265272 /nfs/dbraw/zinc/26/52/72/327265272.db2.gz SRDVGVYPLRTQPP-SKDRFNHKSA-N 1 2 292.360 3.663 20 5 CHBDLO Cc1cc2[nH+]cn(Cc3c(F)cccc3[N+](=O)[O-])c2cc1C ZINC000103462808 328769210 /nfs/dbraw/zinc/76/92/10/328769210.db2.gz GCGDHLSNFXKQMN-UHFFFAOYSA-N 1 2 299.305 3.749 20 5 CHBDLO CC(C)c1ccc(CNc2cc[nH+]cc2F)cc1[N+](=O)[O-] ZINC000186426553 329342174 /nfs/dbraw/zinc/34/21/74/329342174.db2.gz SECXPECFVDRYCX-UHFFFAOYSA-N 1 2 289.310 3.864 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1ncc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000220951428 333171136 /nfs/dbraw/zinc/17/11/36/333171136.db2.gz MIQMQWBLRCCMHW-BXUZGUMPSA-N 1 2 289.335 3.693 20 5 CHBDLO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)c2[nH+]ccn21 ZINC000345355401 335317453 /nfs/dbraw/zinc/31/74/53/335317453.db2.gz LTFSHWGFWOTGAV-QPUJVOFHSA-N 1 2 292.726 3.563 20 5 CHBDLO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000070942432 525434191 /nfs/dbraw/zinc/43/41/91/525434191.db2.gz KOUISOJCSSKDHK-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1c[nH+]ccc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000187652485 526241833 /nfs/dbraw/zinc/24/18/33/526241833.db2.gz VKRCHKILJPILTM-UHFFFAOYSA-N 1 2 299.330 3.674 20 5 CHBDLO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccsc1 ZINC000586771865 1127139020 /nfs/dbraw/zinc/13/90/20/1127139020.db2.gz CGUODEXBTWLOLT-QMMMGPOBSA-N 1 2 298.314 3.785 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)c1 ZINC000595704424 1127472764 /nfs/dbraw/zinc/47/27/64/1127472764.db2.gz QXGXKLDXIXNMJS-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)c1 ZINC000595704424 1127472767 /nfs/dbraw/zinc/47/27/67/1127472767.db2.gz QXGXKLDXIXNMJS-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000595705478 1127472783 /nfs/dbraw/zinc/47/27/83/1127472783.db2.gz ULBSQOKRAPUXQH-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000595705478 1127472785 /nfs/dbraw/zinc/47/27/85/1127472785.db2.gz ULBSQOKRAPUXQH-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000595701841 1127472985 /nfs/dbraw/zinc/47/29/85/1127472985.db2.gz GQHIXCYOWZRECV-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H]1c1ccc(F)cc1 ZINC000595701841 1127472986 /nfs/dbraw/zinc/47/29/86/1127472986.db2.gz GQHIXCYOWZRECV-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000297486777 1127697903 /nfs/dbraw/zinc/69/79/03/1127697903.db2.gz ZSSVLOIBONLBTE-VHSXEESVSA-N 1 2 291.376 3.772 20 5 CHBDLO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1occc1C ZINC000412031974 1127891527 /nfs/dbraw/zinc/89/15/27/1127891527.db2.gz YMKKNSMCCZENLW-UHFFFAOYSA-N 1 2 280.349 3.580 20 5 CHBDLO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1occc1C ZINC000412031974 1127891532 /nfs/dbraw/zinc/89/15/32/1127891532.db2.gz YMKKNSMCCZENLW-UHFFFAOYSA-N 1 2 280.349 3.580 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])sc1C ZINC000342308825 1118972834 /nfs/dbraw/zinc/97/28/34/1118972834.db2.gz UJSBPWPIJYBQJT-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO CCN(C)c1ccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c[nH+]1 ZINC001175902527 1121494732 /nfs/dbraw/zinc/49/47/32/1121494732.db2.gz NVQDQSFVSMLITK-ZHACJKMWSA-N 1 2 298.346 3.529 20 5 CHBDLO Cc1ccc(CNc2c[nH+]c(C)c(C)c2)cc1[N+](=O)[O-] ZINC001179448006 1121876613 /nfs/dbraw/zinc/87/66/13/1121876613.db2.gz UXCNMQFJYIHLMX-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(O)ccc1[N+](=O)[O-] ZINC001193649699 1122706397 /nfs/dbraw/zinc/70/63/97/1122706397.db2.gz VNQLHGHYXPQZLV-WFASDCNBSA-N 1 2 292.379 3.749 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)c1cscn1 ZINC000873134836 1124741286 /nfs/dbraw/zinc/74/12/86/1124741286.db2.gz DPSHIRLNPCJBNT-LLVKDONJSA-N 1 2 291.376 3.519 20 5 CHBDLO CC(C)([NH2+]C/C(Cl)=C\Cl)c1ccccc1[N+](=O)[O-] ZINC000795217242 1129191889 /nfs/dbraw/zinc/19/18/89/1129191889.db2.gz BASVMMUUTLYKDJ-VQHVLOKHSA-N 1 2 289.162 3.739 20 5 CHBDLO Nc1ncc(Nc2ccc3[nH+]c4ccccc4cc3c2)cn1 ZINC001212965449 1129470914 /nfs/dbraw/zinc/47/09/14/1129470914.db2.gz SUFPCSCBPLDNCI-UHFFFAOYSA-N 1 2 287.326 3.504 20 5 CHBDLO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC(F)(F)C1 ZINC001173226072 1132412916 /nfs/dbraw/zinc/41/29/16/1132412916.db2.gz KZBBMAYYZWHZBI-GFCCVEGCSA-N 1 2 298.333 3.647 20 5 CHBDLO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC(F)(F)C1 ZINC001173226072 1132412919 /nfs/dbraw/zinc/41/29/19/1132412919.db2.gz KZBBMAYYZWHZBI-GFCCVEGCSA-N 1 2 298.333 3.647 20 5 CHBDLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc(N)c([N+](=O)[O-])c1 ZINC001209933896 1134103170 /nfs/dbraw/zinc/10/31/70/1134103170.db2.gz DUOUIYIJOAWHCM-UHFFFAOYSA-N 1 2 286.335 3.747 20 5 CHBDLO Cc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1[N+](=O)[O-] ZINC001213666859 1134476165 /nfs/dbraw/zinc/47/61/65/1134476165.db2.gz DVWOGUGCDPHDDG-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1cc(CO[C@@H](C)c2ccccc2[N+](=O)[O-])cc(C)[nH+]1 ZINC001223425993 1135344469 /nfs/dbraw/zinc/34/44/69/1135344469.db2.gz WURZAMDURPFFKP-ZDUSSCGKSA-N 1 2 286.331 3.884 20 5 CHBDLO CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1[nH]cc[nH+]1 ZINC000139795381 263037652 /nfs/dbraw/zinc/03/76/52/263037652.db2.gz VUFPCJWZBCIKER-SECBINFHSA-N 1 2 280.715 3.535 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000182031023 329238876 /nfs/dbraw/zinc/23/88/76/329238876.db2.gz TUVXNMVECDGNIU-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000182031023 329238877 /nfs/dbraw/zinc/23/88/77/329238877.db2.gz TUVXNMVECDGNIU-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(CNc2c(C)ccc([N+](=O)[O-])c2C)c(C)[nH+]1 ZINC000184484460 329260628 /nfs/dbraw/zinc/26/06/28/329260628.db2.gz SNYNEHMNGWOJFP-UHFFFAOYSA-N 1 2 285.347 3.836 20 5 CHBDLO Cc1ccc(N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c[nH+]1 ZINC000540750531 333745189 /nfs/dbraw/zinc/74/51/89/333745189.db2.gz JDIIAWNVBDUMOC-INIZCTEOSA-N 1 2 297.358 3.731 20 5 CHBDLO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1nccs1 ZINC000080306475 334170464 /nfs/dbraw/zinc/17/04/64/334170464.db2.gz SPDJDBOGAKYQHQ-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1cscn1 ZINC000582014262 336192339 /nfs/dbraw/zinc/19/23/39/336192339.db2.gz MFPJIHRBPYIHRB-GHMZBOCLSA-N 1 2 291.376 3.772 20 5 CHBDLO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCCC3(CCC3)C2)c(F)c1 ZINC000352406372 1127228975 /nfs/dbraw/zinc/22/89/75/1127228975.db2.gz MMIOFNQPIFCEPE-UHFFFAOYSA-N 1 2 296.317 3.639 20 5 CHBDLO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCCC3(CCC3)C2)c(F)c1 ZINC000352406372 1127228978 /nfs/dbraw/zinc/22/89/78/1127228978.db2.gz MMIOFNQPIFCEPE-UHFFFAOYSA-N 1 2 296.317 3.639 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccns1 ZINC000602883602 1127620072 /nfs/dbraw/zinc/62/00/72/1127620072.db2.gz PFBFRQWLMLWSCS-NSHDSACASA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccns1 ZINC000602883602 1127620073 /nfs/dbraw/zinc/62/00/73/1127620073.db2.gz PFBFRQWLMLWSCS-NSHDSACASA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1cc(N[C@@H](C)c2ccccc2[N+](=O)[O-])nc(C2CC2)[nH+]1 ZINC000271755853 1128054287 /nfs/dbraw/zinc/05/42/87/1128054287.db2.gz ZQIHRJKGDNKQSC-NSHDSACASA-N 1 2 298.346 3.744 20 5 CHBDLO C[N@H+](Cc1cc(F)cc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179314850 1119710343 /nfs/dbraw/zinc/71/03/43/1119710343.db2.gz TWRCDTVEVQBEDZ-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1cc(F)cc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179314850 1119710349 /nfs/dbraw/zinc/71/03/49/1119710349.db2.gz TWRCDTVEVQBEDZ-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO Cc1ccc(Oc2cccc(-n3cc[nH+]c3)c2)c([N+](=O)[O-])c1 ZINC000301822097 1120381033 /nfs/dbraw/zinc/38/10/33/1120381033.db2.gz MOTADMAWQWWYFO-UHFFFAOYSA-N 1 2 295.298 3.881 20 5 CHBDLO O=[N+]([O-])c1ccsc1Oc1cccc(-n2cc[nH+]c2)c1 ZINC000301921139 1120473959 /nfs/dbraw/zinc/47/39/59/1120473959.db2.gz DIVVCGMELIOTBW-UHFFFAOYSA-N 1 2 287.300 3.634 20 5 CHBDLO CCOc1cc(Nc2cc([N+](=O)[O-])ccc2F)cc(C)[nH+]1 ZINC001175733349 1121440032 /nfs/dbraw/zinc/44/00/32/1121440032.db2.gz ANYMAZCPZNSVPJ-UHFFFAOYSA-N 1 2 291.282 3.580 20 5 CHBDLO Cc1cn2cccc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)c2[nH+]1 ZINC001175899435 1121493694 /nfs/dbraw/zinc/49/36/94/1121493694.db2.gz VAVZLTVNYKZJFN-CSKARUKUSA-N 1 2 294.314 3.634 20 5 CHBDLO C[C@H](c1cccs1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864137 1122573976 /nfs/dbraw/zinc/57/39/76/1122573976.db2.gz JXZUQRCCKCDCSO-SNVBAGLBSA-N 1 2 294.351 3.988 20 5 CHBDLO C[C@H](c1cccs1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864137 1122573981 /nfs/dbraw/zinc/57/39/81/1122573981.db2.gz JXZUQRCCKCDCSO-SNVBAGLBSA-N 1 2 294.351 3.988 20 5 CHBDLO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788856 1122615731 /nfs/dbraw/zinc/61/57/31/1122615731.db2.gz ARBAKKYXSVBECD-DOMZBBRYSA-N 1 2 292.379 3.701 20 5 CHBDLO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788856 1122615735 /nfs/dbraw/zinc/61/57/35/1122615735.db2.gz ARBAKKYXSVBECD-DOMZBBRYSA-N 1 2 292.379 3.701 20 5 CHBDLO O=[N+]([O-])c1cc(O)cc(Nc2cccc3cc[nH+]cc32)c1 ZINC001201222030 1123079710 /nfs/dbraw/zinc/07/97/10/1123079710.db2.gz IJQVVXWCHZJRMQ-UHFFFAOYSA-N 1 2 281.271 3.592 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000579623728 1123230974 /nfs/dbraw/zinc/23/09/74/1123230974.db2.gz OTHRNRSAQUZPEQ-ZWNOBZJWSA-N 1 2 291.376 3.853 20 5 CHBDLO Cc1occc1C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663381 1130139642 /nfs/dbraw/zinc/13/96/42/1130139642.db2.gz QMXHWSYRPFKQIA-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1occc1C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663381 1130139645 /nfs/dbraw/zinc/13/96/45/1130139645.db2.gz QMXHWSYRPFKQIA-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1cscn1 ZINC000826972530 1130322024 /nfs/dbraw/zinc/32/20/24/1130322024.db2.gz FMILMELPZYVFQY-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2cccc([N+](=O)[O-])c2)cc1 ZINC001204477584 1133452466 /nfs/dbraw/zinc/45/24/66/1133452466.db2.gz VLKXRRFKDRAAKT-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2cccc([N+](=O)[O-])c2)cc1 ZINC001204477584 1133452469 /nfs/dbraw/zinc/45/24/69/1133452469.db2.gz VLKXRRFKDRAAKT-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CCc1ccc(C)[nH+]c1Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001211188298 1134387317 /nfs/dbraw/zinc/38/73/17/1134387317.db2.gz IQNRCICHBOIZMO-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO Cc1cc(CO[C@H](C)c2cccc([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001223426125 1135345251 /nfs/dbraw/zinc/34/52/51/1135345251.db2.gz ZFFDDMKNGBFTIP-CYBMUJFWSA-N 1 2 286.331 3.884 20 5 CHBDLO CCOC(=[NH2+])CCCCO[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001224964959 1135497050 /nfs/dbraw/zinc/49/70/50/1135497050.db2.gz FLKHHKRNXTVCER-GFCCVEGCSA-N 1 2 294.351 3.856 20 5 CHBDLO CC[C@](C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1nccs1 ZINC000152602114 327562802 /nfs/dbraw/zinc/56/28/02/327562802.db2.gz ZNTFJIHTXCEMFM-LBPRGKRZSA-N 1 2 297.405 3.528 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)C(F)F ZINC000453242962 331106408 /nfs/dbraw/zinc/10/64/08/331106408.db2.gz IRHHIWFCRJWPGM-NWDGAFQWSA-N 1 2 272.295 3.679 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000292840960 520478928 /nfs/dbraw/zinc/47/89/28/520478928.db2.gz SDJQNTOSIDFDCB-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000292840960 520478933 /nfs/dbraw/zinc/47/89/33/520478933.db2.gz SDJQNTOSIDFDCB-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO C[N@H+](CCC(F)(F)F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000079618601 522697190 /nfs/dbraw/zinc/69/71/90/522697190.db2.gz NTWVYQVABYTWTP-UHFFFAOYSA-N 1 2 296.676 3.632 20 5 CHBDLO C[N@@H+](CCC(F)(F)F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000079618601 522697199 /nfs/dbraw/zinc/69/71/99/522697199.db2.gz NTWVYQVABYTWTP-UHFFFAOYSA-N 1 2 296.676 3.632 20 5 CHBDLO Cc1ccc(Nc2ccccc2-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC001214172145 1125569974 /nfs/dbraw/zinc/56/99/74/1125569974.db2.gz VUAKISMRTASIOH-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO O=[N+]([O-])c1ccc(Oc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC000091484249 1119241346 /nfs/dbraw/zinc/24/13/46/1119241346.db2.gz QZNUEZVJZCOVMG-UHFFFAOYSA-N 1 2 281.271 3.573 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(Oc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000301583768 1120103043 /nfs/dbraw/zinc/10/30/43/1120103043.db2.gz UYMYPKCXYNPUSJ-UHFFFAOYSA-N 1 2 295.298 3.881 20 5 CHBDLO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1Cc2ccccc2C1 ZINC000107306626 1120695777 /nfs/dbraw/zinc/69/57/77/1120695777.db2.gz VNWKVEVXAZIOCP-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO O=[N+]([O-])/C=C/c1ccc(Nc2[nH+]cccc2C2CC2)cc1 ZINC001175902037 1121493339 /nfs/dbraw/zinc/49/33/39/1121493339.db2.gz DRQOMWYBSIFLFP-PKNBQFBNSA-N 1 2 281.315 3.950 20 5 CHBDLO CC(C)C[C@]1(C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001194533934 1122781913 /nfs/dbraw/zinc/78/19/13/1122781913.db2.gz MNFMUUMEYVNAJE-INIZCTEOSA-N 1 2 292.379 3.701 20 5 CHBDLO CC(C)C[C@]1(C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001194533934 1122781915 /nfs/dbraw/zinc/78/19/15/1122781915.db2.gz MNFMUUMEYVNAJE-INIZCTEOSA-N 1 2 292.379 3.701 20 5 CHBDLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000896512328 1123590332 /nfs/dbraw/zinc/59/03/32/1123590332.db2.gz NSNOHMWXCOVEHZ-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000449633770 1124832477 /nfs/dbraw/zinc/83/24/77/1124832477.db2.gz QDPDCXMUGDQNMK-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000449633770 1124832484 /nfs/dbraw/zinc/83/24/84/1124832484.db2.gz QDPDCXMUGDQNMK-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cncs1 ZINC000903305274 1130149889 /nfs/dbraw/zinc/14/98/89/1130149889.db2.gz JTXJKDBLBOQPQF-IUCAKERBSA-N 1 2 295.339 3.602 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001210954895 1134339148 /nfs/dbraw/zinc/33/91/48/1134339148.db2.gz RMBPARDHRHESAP-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001210954895 1134339154 /nfs/dbraw/zinc/33/91/54/1134339154.db2.gz RMBPARDHRHESAP-UHFFFAOYSA-N 1 2 289.310 3.934 20 5 CHBDLO O=[N+]([O-])c1ccc([C@@H](Oc2cc[nH+]cc2)C(F)(F)F)cc1 ZINC001225294355 1135537247 /nfs/dbraw/zinc/53/72/47/1135537247.db2.gz HSFSMBAXTRZESU-GFCCVEGCSA-N 1 2 298.220 3.672 20 5 CHBDLO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037771886 260116338 /nfs/dbraw/zinc/11/63/38/260116338.db2.gz JCCPVUGWLMOAGL-QMMMGPOBSA-N 1 2 298.314 3.785 20 5 CHBDLO O=[N+]([O-])c1cc(CNc2cccc[nH+]2)cc(C(F)(F)F)c1 ZINC000362675449 267033965 /nfs/dbraw/zinc/03/39/65/267033965.db2.gz SCMWEFVIZGVHTP-UHFFFAOYSA-N 1 2 297.236 3.621 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccccc2)CC1 ZINC000507860590 332828146 /nfs/dbraw/zinc/82/81/46/332828146.db2.gz QAUAZIQRZGFROY-UHFFFAOYSA-N 1 2 286.306 3.513 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(NCc2cc(C)[nH+]c(C)c2)c1 ZINC000420653582 329780989 /nfs/dbraw/zinc/78/09/89/329780989.db2.gz ORYAZYRSXXAOAY-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1c[nH+]ccc1CCNc1c(Cl)cccc1[N+](=O)[O-] ZINC000432331808 330597524 /nfs/dbraw/zinc/59/75/24/330597524.db2.gz QQSUVEBFYVAYDH-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)(F)F ZINC000453296050 331112464 /nfs/dbraw/zinc/11/24/64/331112464.db2.gz QPJPOUWBWJPOMU-ZANVPECISA-N 1 2 284.306 3.606 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)C(C)(F)F ZINC000581411434 336071940 /nfs/dbraw/zinc/07/19/40/336071940.db2.gz JLXNVGPBDGLKKS-VHSXEESVSA-N 1 2 272.295 3.598 20 5 CHBDLO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353665972 534072926 /nfs/dbraw/zinc/07/29/26/534072926.db2.gz MTAYVEQHRDJKDG-LLVKDONJSA-N 1 2 288.372 3.603 20 5 CHBDLO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353665972 534072933 /nfs/dbraw/zinc/07/29/33/534072933.db2.gz MTAYVEQHRDJKDG-LLVKDONJSA-N 1 2 288.372 3.603 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2c2ccco2)cs1 ZINC000331581339 534880043 /nfs/dbraw/zinc/88/00/43/534880043.db2.gz JTYJLOOTNAOHFQ-LBPRGKRZSA-N 1 2 292.360 3.977 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]2c2ccco2)cs1 ZINC000331581339 534880044 /nfs/dbraw/zinc/88/00/44/534880044.db2.gz JTYJLOOTNAOHFQ-LBPRGKRZSA-N 1 2 292.360 3.977 20 5 CHBDLO Cc1cc(N[C@H](C)c2cccc([N+](=O)[O-])c2)nc(C2CC2)[nH+]1 ZINC000116260132 1125508976 /nfs/dbraw/zinc/50/89/76/1125508976.db2.gz PYEYMOOAVOLVLG-LLVKDONJSA-N 1 2 298.346 3.744 20 5 CHBDLO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000483312094 1126780623 /nfs/dbraw/zinc/78/06/23/1126780623.db2.gz RODRDCQMCNKJIG-ZDUSSCGKSA-N 1 2 282.343 3.980 20 5 CHBDLO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000483312094 1126780626 /nfs/dbraw/zinc/78/06/26/1126780626.db2.gz RODRDCQMCNKJIG-ZDUSSCGKSA-N 1 2 282.343 3.980 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348541387 1127121036 /nfs/dbraw/zinc/12/10/36/1127121036.db2.gz WTENIOCTGZRILN-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348541387 1127121039 /nfs/dbraw/zinc/12/10/39/1127121039.db2.gz WTENIOCTGZRILN-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353901733 1127277240 /nfs/dbraw/zinc/27/72/40/1127277240.db2.gz SCOQUXGKFLUVDH-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353901733 1127277243 /nfs/dbraw/zinc/27/72/43/1127277243.db2.gz SCOQUXGKFLUVDH-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1cccc[nH+]1 ZINC000468631325 1128014247 /nfs/dbraw/zinc/01/42/47/1128014247.db2.gz KQQFAIBCTKGJDR-FMIVXFBMSA-N 1 2 269.304 3.505 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cccc([N+](=O)[O-])c1F ZINC001210379622 1118266087 /nfs/dbraw/zinc/26/60/87/1118266087.db2.gz GAPBCLHFMJPTLA-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO C[C@@H]1C[C@H](C)[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579977522 1118271031 /nfs/dbraw/zinc/27/10/31/1118271031.db2.gz ILAADMFPOMPHKX-DTORHVGOSA-N 1 2 288.269 3.596 20 5 CHBDLO C[C@@H]1C[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579977522 1118271035 /nfs/dbraw/zinc/27/10/35/1118271035.db2.gz ILAADMFPOMPHKX-DTORHVGOSA-N 1 2 288.269 3.596 20 5 CHBDLO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964283 1119086520 /nfs/dbraw/zinc/08/65/20/1119086520.db2.gz XVHKPTBIOQZORD-VXGBXAGGSA-N 1 2 292.379 3.699 20 5 CHBDLO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964283 1119086524 /nfs/dbraw/zinc/08/65/24/1119086524.db2.gz XVHKPTBIOQZORD-VXGBXAGGSA-N 1 2 292.379 3.699 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090202 1124680228 /nfs/dbraw/zinc/68/02/28/1124680228.db2.gz NUFXJGAORJTOSN-DTWKUNHWSA-N 1 2 295.339 3.602 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1 ZINC001174478304 1132882808 /nfs/dbraw/zinc/88/28/08/1132882808.db2.gz SRSBPTWTIOIJPG-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO Cc1ccc(Nc2ccc[nH+]c2N2CCCC2)c([N+](=O)[O-])c1 ZINC001214165125 1134515299 /nfs/dbraw/zinc/51/52/99/1134515299.db2.gz LUZGIUQLKHLOGT-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO CCOC(=[NH2+])CCCCO[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001224964961 1135497506 /nfs/dbraw/zinc/49/75/06/1135497506.db2.gz FLKHHKRNXTVCER-LBPRGKRZSA-N 1 2 294.351 3.856 20 5 CHBDLO O=[N+]([O-])c1ccc(CNc2[nH+]ccc3ccc(F)cc32)cc1 ZINC000354558592 227033541 /nfs/dbraw/zinc/03/35/41/227033541.db2.gz HTRXOMXXNSYZBO-UHFFFAOYSA-N 1 2 297.289 3.894 20 5 CHBDLO CC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)F ZINC000453229326 331104316 /nfs/dbraw/zinc/10/43/16/331104316.db2.gz CPJGYYMAMOWTNV-QWHCGFSZSA-N 1 2 284.306 3.606 20 5 CHBDLO Cc1nc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cs1 ZINC000230639813 333319374 /nfs/dbraw/zinc/31/93/74/333319374.db2.gz OBSXSFRBTBPCSK-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000070942433 525515709 /nfs/dbraw/zinc/51/57/09/525515709.db2.gz KOUISOJCSSKDHK-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cn1 ZINC000912731553 1127111413 /nfs/dbraw/zinc/11/14/13/1127111413.db2.gz FMVJXFPICNBERL-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO C[C@H]([NH2+]Cc1csc(Cl)n1)c1ccc([N+](=O)[O-])cc1 ZINC000296859631 1127684285 /nfs/dbraw/zinc/68/42/85/1127684285.db2.gz YUPDJBOYANUWAV-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO C[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003232 1128046864 /nfs/dbraw/zinc/04/68/64/1128046864.db2.gz LDWBBVKKGBYARY-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003232 1128046868 /nfs/dbraw/zinc/04/68/68/1128046868.db2.gz LDWBBVKKGBYARY-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC=C(F)C1 ZINC000470203430 1128066066 /nfs/dbraw/zinc/06/60/66/1128066066.db2.gz PZXRHEZBRUMHHZ-XYOKQWHBSA-N 1 2 276.311 3.557 20 5 CHBDLO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC=C(F)C1 ZINC000470203430 1128066068 /nfs/dbraw/zinc/06/60/68/1128066068.db2.gz PZXRHEZBRUMHHZ-XYOKQWHBSA-N 1 2 276.311 3.557 20 5 CHBDLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc([N+](=O)[O-])cc1 ZINC000932179287 1128399107 /nfs/dbraw/zinc/39/91/07/1128399107.db2.gz YUPDJBOYANUWAV-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000072578506 1117769305 /nfs/dbraw/zinc/76/93/05/1117769305.db2.gz SGMHIJRSQKUFIU-SNVBAGLBSA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ncc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000072578506 1117769310 /nfs/dbraw/zinc/76/93/10/1117769310.db2.gz SGMHIJRSQKUFIU-SNVBAGLBSA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000090888698 1118673574 /nfs/dbraw/zinc/67/35/74/1118673574.db2.gz KUAWAJKOHKENPE-VIFPVBQESA-N 1 2 291.376 3.519 20 5 CHBDLO O=[N+]([O-])c1cccc(F)c1Oc1cccc(-n2cc[nH+]c2)c1 ZINC000342413446 1119009470 /nfs/dbraw/zinc/00/94/70/1119009470.db2.gz LMGFKOQHRWGCCT-UHFFFAOYSA-N 1 2 299.261 3.712 20 5 CHBDLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000050015556 1119091623 /nfs/dbraw/zinc/09/16/23/1119091623.db2.gz UMIPFUBJAAKJHL-VIFPVBQESA-N 1 2 291.376 3.519 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000339075744 1119092169 /nfs/dbraw/zinc/09/21/69/1119092169.db2.gz SXBQSLSVWBAAAA-KRWDZBQOSA-N 1 2 298.342 3.541 20 5 CHBDLO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1Cc2ccccc2C1 ZINC000107306630 1120695795 /nfs/dbraw/zinc/69/57/95/1120695795.db2.gz VNWKVEVXAZIOCP-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO CCCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000509315012 1121524873 /nfs/dbraw/zinc/52/48/73/1121524873.db2.gz QQYWCFOFSYDPOB-UHFFFAOYSA-N 1 2 284.306 3.638 20 5 CHBDLO CCCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000509315012 1121524880 /nfs/dbraw/zinc/52/48/80/1121524880.db2.gz QQYWCFOFSYDPOB-UHFFFAOYSA-N 1 2 284.306 3.638 20 5 CHBDLO Cc1cc(NCc2cccc([N+](=O)[O-])c2C)ccc1[NH+](C)C ZINC000864003611 1123908318 /nfs/dbraw/zinc/90/83/18/1123908318.db2.gz MRDFWURANGPKMJ-UHFFFAOYSA-N 1 2 299.374 3.890 20 5 CHBDLO CC(C)(C)c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000865813972 1124016831 /nfs/dbraw/zinc/01/68/31/1124016831.db2.gz CSDBDHDCNHXBEO-UHFFFAOYSA-N 1 2 294.376 3.837 20 5 CHBDLO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000037772006 1129266975 /nfs/dbraw/zinc/26/69/75/1129266975.db2.gz VATHNODVWUUFBB-JTQLQIEISA-N 1 2 292.285 3.724 20 5 CHBDLO COc1cc(Nc2ccc([N+](=O)[O-])cc2Cl)cc(C)[nH+]1 ZINC001248597861 1132032623 /nfs/dbraw/zinc/03/26/23/1132032623.db2.gz BDHSDPXROXZZIG-UHFFFAOYSA-N 1 2 293.710 3.704 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc(F)cc1[N+](=O)[O-] ZINC001210955395 1134338947 /nfs/dbraw/zinc/33/89/47/1134338947.db2.gz FWRQMNDCYFGPNO-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001211288570 1134403937 /nfs/dbraw/zinc/40/39/37/1134403937.db2.gz YFNSQEOFTDLUCO-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1cc[nH+]c(C)c1O[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001227263667 1135812438 /nfs/dbraw/zinc/81/24/38/1135812438.db2.gz GOYMPDKWOUGDOC-GFCCVEGCSA-N 1 2 272.304 3.747 20 5 CHBDLO Cc1cc2[nH+]cn(Cc3ccc([N+](=O)[O-])cc3F)c2cc1C ZINC000319156845 262178755 /nfs/dbraw/zinc/17/87/55/262178755.db2.gz FBAJEDAICORKNO-UHFFFAOYSA-N 1 2 299.305 3.749 20 5 CHBDLO Cc1cccc(CCNc2ccc([N+](=O)[O-])cc2Cl)[nH+]1 ZINC000359819558 266642823 /nfs/dbraw/zinc/64/28/23/266642823.db2.gz QGRHFLZXBXGLHM-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1[N+](=O)[O-] ZINC000389462263 328848228 /nfs/dbraw/zinc/84/82/28/328848228.db2.gz DZGWLJFWZIKZRE-UWVGGRQHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1occc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182083384 329239531 /nfs/dbraw/zinc/23/95/31/329239531.db2.gz QLSJSDOHLGIJKG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1occc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182083384 329239532 /nfs/dbraw/zinc/23/95/32/329239532.db2.gz QLSJSDOHLGIJKG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(COc2ccc(Cl)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC000185276531 329269987 /nfs/dbraw/zinc/26/99/87/329269987.db2.gz VRLUMQKZQXPRCR-UHFFFAOYSA-N 1 2 292.722 3.839 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242961 331106399 /nfs/dbraw/zinc/10/63/99/331106399.db2.gz IRHHIWFCRJWPGM-NEPJUHHUSA-N 1 2 272.295 3.679 20 5 CHBDLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cscn2)cc1[N+](=O)[O-] ZINC000271430685 1127080308 /nfs/dbraw/zinc/08/03/08/1127080308.db2.gz BYMDPBSCBBBVIQ-QWRGUYRKSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000361109868 1127538460 /nfs/dbraw/zinc/53/84/60/1127538460.db2.gz FYIXNBKERKRECH-UHFFFAOYSA-N 1 2 282.343 3.727 20 5 CHBDLO Cc1ccc2c(c1)C[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000361109868 1127538461 /nfs/dbraw/zinc/53/84/61/1127538461.db2.gz FYIXNBKERKRECH-UHFFFAOYSA-N 1 2 282.343 3.727 20 5 CHBDLO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000044438311 1128631112 /nfs/dbraw/zinc/63/11/12/1128631112.db2.gz MCPGDYDUQPCFER-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000044438311 1128631114 /nfs/dbraw/zinc/63/11/14/1128631114.db2.gz MCPGDYDUQPCFER-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO c1ccc2[nH+]c3ccc(Nc4ccncn4)cc3cc2c1 ZINC001211028085 1118440967 /nfs/dbraw/zinc/44/09/67/1118440967.db2.gz KOZASHPBHSNHQQ-UHFFFAOYSA-N 1 2 272.311 3.922 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610504840 1118585566 /nfs/dbraw/zinc/58/55/66/1118585566.db2.gz APOMSBYAKUYAKT-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610504840 1118585569 /nfs/dbraw/zinc/58/55/69/1118585569.db2.gz APOMSBYAKUYAKT-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1occc1C[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000172019731 1121137082 /nfs/dbraw/zinc/13/70/82/1121137082.db2.gz GTLBYCMYVIZUCH-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1occc1C[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000172019731 1121137087 /nfs/dbraw/zinc/13/70/87/1121137087.db2.gz GTLBYCMYVIZUCH-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cc([N+](=O)[O-])ccc1F ZINC001175734831 1121441686 /nfs/dbraw/zinc/44/16/86/1121441686.db2.gz DYPGNWCBWSUHPK-UHFFFAOYSA-N 1 2 275.283 3.743 20 5 CHBDLO Cc1ccc(C[N@@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000124280310 1121718895 /nfs/dbraw/zinc/71/88/95/1121718895.db2.gz MGFRRUGXQUKYPV-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1ccc(C[N@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000124280310 1121718900 /nfs/dbraw/zinc/71/89/00/1121718900.db2.gz MGFRRUGXQUKYPV-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1nc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000730818164 1121829092 /nfs/dbraw/zinc/82/90/92/1121829092.db2.gz IZRLEROIYMCPRZ-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO CCN(CC)c1ccc(Nc2ccc([N+](=O)[O-])cc2)c[nH+]1 ZINC000195667894 1129148569 /nfs/dbraw/zinc/14/85/69/1129148569.db2.gz GCBQFZBSAZLNPN-UHFFFAOYSA-N 1 2 286.335 3.580 20 5 CHBDLO CC[C@@H]([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])c1ccccc1 ZINC000339065081 1123905429 /nfs/dbraw/zinc/90/54/29/1123905429.db2.gz GIPAJQHJRBHQFW-OAHLLOKOSA-N 1 2 286.331 3.541 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(Nc2ccc3c(c2)[nH+]cn3C)c1 ZINC000447056421 1124131251 /nfs/dbraw/zinc/13/12/51/1124131251.db2.gz AULWRZWTOLWKKT-UHFFFAOYSA-N 1 2 282.303 3.534 20 5 CHBDLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccn1 ZINC000872016039 1124656800 /nfs/dbraw/zinc/65/68/00/1124656800.db2.gz COJABLXTQZCAAG-QWRGUYRKSA-N 1 2 289.310 3.541 20 5 CHBDLO C[C@@H]([NH2+]C/C(Cl)=C\Cl)c1ccccc1[N+](=O)[O-] ZINC000880092775 1125249940 /nfs/dbraw/zinc/24/99/40/1125249940.db2.gz HZWAJXRHGQVUPV-GTUWVTDSSA-N 1 2 275.135 3.564 20 5 CHBDLO CC[N@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1F ZINC000610476350 1125349218 /nfs/dbraw/zinc/34/92/18/1125349218.db2.gz TZMGLRVWFNOMOI-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO CC[N@@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1F ZINC000610476350 1125349220 /nfs/dbraw/zinc/34/92/20/1125349220.db2.gz TZMGLRVWFNOMOI-UHFFFAOYSA-N 1 2 294.248 3.508 20 5 CHBDLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000719430430 1129332540 /nfs/dbraw/zinc/33/25/40/1129332540.db2.gz OCSHGJBYTMWYSV-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1[nH]c2ccc(O[C@@H](C)c3ccccc3[N+](=O)[O-])cc2[nH+]1 ZINC001228330272 1131859062 /nfs/dbraw/zinc/85/90/62/1131859062.db2.gz WPYMYEOKWMHKRP-JTQLQIEISA-N 1 2 297.314 3.920 20 5 CHBDLO Cc1ccc2c(NC(=[NH2+])C(C)(C)C)nccc2c1[N+](=O)[O-] ZINC001162657879 1133101879 /nfs/dbraw/zinc/10/18/79/1133101879.db2.gz SKVMBVXQSRPVNN-UHFFFAOYSA-N 1 2 286.335 3.887 20 5 CHBDLO Cc1cn2cccc(Nc3ccc(C)c([N+](=O)[O-])c3)c2[nH+]1 ZINC001213661425 1134475691 /nfs/dbraw/zinc/47/56/91/1134475691.db2.gz GKKDXBIHKJAULL-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO O=[N+]([O-])c1ccc([C@H](Oc2cc[nH+]cc2)C(F)(F)F)cc1 ZINC001225294356 1135536729 /nfs/dbraw/zinc/53/67/29/1135536729.db2.gz HSFSMBAXTRZESU-LBPRGKRZSA-N 1 2 298.220 3.672 20 5 CHBDLO CC(F)(F)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000574417896 335018490 /nfs/dbraw/zinc/01/84/90/335018490.db2.gz KDRGETIAYUJFKO-UHFFFAOYSA-N 1 2 296.273 3.600 20 5 CHBDLO O=[N+]([O-])c1ccc(NCc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000341932683 130161376 /nfs/dbraw/zinc/16/13/76/130161376.db2.gz ILRTUUYWKNNDFZ-UHFFFAOYSA-N 1 2 294.314 3.597 20 5 CHBDLO COc1cc(C[N@@H+]2Cc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000352540719 227047565 /nfs/dbraw/zinc/04/75/65/227047565.db2.gz ONKHZRJPAPTIGJ-LBPRGKRZSA-N 1 2 298.342 3.680 20 5 CHBDLO COc1cc(C[N@H+]2Cc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000352540719 227047568 /nfs/dbraw/zinc/04/75/68/227047568.db2.gz ONKHZRJPAPTIGJ-LBPRGKRZSA-N 1 2 298.342 3.680 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(F)F ZINC000453249363 331107384 /nfs/dbraw/zinc/10/73/84/331107384.db2.gz QHIOHEFNPILKLM-KOLCDFICSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1c(C[N@@H+]2Cc3cccc(F)c3C2)cccc1[N+](=O)[O-] ZINC000459726981 331296192 /nfs/dbraw/zinc/29/61/92/331296192.db2.gz GUUAVFXGNYPUGF-UHFFFAOYSA-N 1 2 286.306 3.558 20 5 CHBDLO Cc1c(C[N@H+]2Cc3cccc(F)c3C2)cccc1[N+](=O)[O-] ZINC000459726981 331296193 /nfs/dbraw/zinc/29/61/93/331296193.db2.gz GUUAVFXGNYPUGF-UHFFFAOYSA-N 1 2 286.306 3.558 20 5 CHBDLO C[N@H+](Cc1cc(Cl)cs1)Cc1ccccc1[N+](=O)[O-] ZINC000194331500 333269138 /nfs/dbraw/zinc/26/91/38/333269138.db2.gz XEGLJVXUOOGFKD-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1cc(Cl)cs1)Cc1ccccc1[N+](=O)[O-] ZINC000194331500 333269139 /nfs/dbraw/zinc/26/91/39/333269139.db2.gz XEGLJVXUOOGFKD-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000080309755 334170376 /nfs/dbraw/zinc/17/03/76/334170376.db2.gz IUZPGZFQFZMQMX-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO C[C@H]1C[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])c2[nH+]ccn21 ZINC000345366276 335318731 /nfs/dbraw/zinc/31/87/31/335318731.db2.gz ZNHOWTNSULTDRS-GZMMTYOYSA-N 1 2 292.726 3.563 20 5 CHBDLO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000042978030 1126866956 /nfs/dbraw/zinc/86/69/56/1126866956.db2.gz QKACPJQIPLCBOZ-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000042978030 1126866958 /nfs/dbraw/zinc/86/69/58/1126866958.db2.gz QKACPJQIPLCBOZ-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO CCC[C@H]([NH2+][C@@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832915 1127164134 /nfs/dbraw/zinc/16/41/34/1127164134.db2.gz KDNURFWQJZHECT-NHYWBVRUSA-N 1 2 289.335 3.775 20 5 CHBDLO Cc1cc(N[C@H](C)c2ccccc2[N+](=O)[O-])nc(C2CC2)[nH+]1 ZINC000271755847 1128053515 /nfs/dbraw/zinc/05/35/15/1128053515.db2.gz ZQIHRJKGDNKQSC-LLVKDONJSA-N 1 2 298.346 3.744 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001204457200 1118086336 /nfs/dbraw/zinc/08/63/36/1118086336.db2.gz VBIYOZSDGIKDNH-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1Oc1cccc(-n2cc[nH+]c2)c1 ZINC000077982079 1119196837 /nfs/dbraw/zinc/19/68/37/1119196837.db2.gz VRDHWESXNNCZGQ-UHFFFAOYSA-N 1 2 299.261 3.712 20 5 CHBDLO Cc1cccc(CCCNc2ccc([N+](=O)[O-])cc2C)[nH+]1 ZINC000343223460 1119357035 /nfs/dbraw/zinc/35/70/35/1119357035.db2.gz HKFNAJIQULHZMN-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO CSc1cc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)cc[nH+]1 ZINC001175901998 1121493095 /nfs/dbraw/zinc/49/30/95/1121493095.db2.gz CAFDKIRHGIZUBS-VQHVLOKHSA-N 1 2 287.344 3.795 20 5 CHBDLO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc3c1CCC3)C2 ZINC001180072801 1121945291 /nfs/dbraw/zinc/94/52/91/1121945291.db2.gz WQRVIKMKNJUEDO-UHFFFAOYSA-N 1 2 294.354 3.599 20 5 CHBDLO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc3c1CCC3)C2 ZINC001180072801 1121945297 /nfs/dbraw/zinc/94/52/97/1121945297.db2.gz WQRVIKMKNJUEDO-UHFFFAOYSA-N 1 2 294.354 3.599 20 5 CHBDLO Cc1[nH]c2ccc(O[C@H](C)c3cccc([N+](=O)[O-])c3)cc2[nH+]1 ZINC001228328631 1131859114 /nfs/dbraw/zinc/85/91/14/1131859114.db2.gz HODRETZLUJMTPK-SNVBAGLBSA-N 1 2 297.314 3.920 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccccc2-n2cc[nH+]c2)c1F ZINC001210381027 1134204208 /nfs/dbraw/zinc/20/42/08/1134204208.db2.gz ZQCHIXUQVWJEIJ-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO O=[N+]([O-])c1cc(Nc2cccc(-n3cc[nH+]c3)c2)ccc1F ZINC001211192708 1134388709 /nfs/dbraw/zinc/38/87/09/1134388709.db2.gz JITGUEAPWPFWKF-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO Cc1cn2cccc(Nc3cc([N+](=O)[O-])ccc3C)c2[nH+]1 ZINC001211285306 1134402908 /nfs/dbraw/zinc/40/29/08/1134402908.db2.gz CRFITAOXHLZTMO-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO CCc1ccc(C)[nH+]c1Nc1cc([N+](=O)[O-])ccc1C ZINC001211283481 1134402989 /nfs/dbraw/zinc/40/29/89/1134402989.db2.gz AWIDQXPYEFRDLT-UHFFFAOYSA-N 1 2 271.320 3.913 20 5 CHBDLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353392927 228095012 /nfs/dbraw/zinc/09/50/12/228095012.db2.gz HSGRVUUEUQRDEJ-LLVKDONJSA-N 1 2 288.372 3.776 20 5 CHBDLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353392927 228095015 /nfs/dbraw/zinc/09/50/15/228095015.db2.gz HSGRVUUEUQRDEJ-LLVKDONJSA-N 1 2 288.372 3.776 20 5 CHBDLO CCC[C@H]([NH2+]Cc1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000108941658 262074465 /nfs/dbraw/zinc/07/44/65/262074465.db2.gz NQQBTWQHDVAPFY-AWEZNQCLSA-N 1 2 291.376 3.682 20 5 CHBDLO O=[N+]([O-])c1ccc2cc[nH+]c(NC(C3CC3)C3CC3)c2c1 ZINC000413050477 262754054 /nfs/dbraw/zinc/75/40/54/262754054.db2.gz ZWFXMZKJRGMCMD-UHFFFAOYSA-N 1 2 283.331 3.744 20 5 CHBDLO Cc1cc(CNc2cc(C)c([N+](=O)[O-])cc2F)cc(C)[nH+]1 ZINC000420646188 329777856 /nfs/dbraw/zinc/77/78/56/329777856.db2.gz APABRGRYDVXKCQ-UHFFFAOYSA-N 1 2 289.310 3.666 20 5 CHBDLO Cc1cc(C)c(CNc2cccc(C)c2[N+](=O)[O-])c[nH+]1 ZINC000397107845 330239052 /nfs/dbraw/zinc/23/90/52/330239052.db2.gz QMINGSFNUIVTLF-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1cscn1 ZINC000582014265 336192281 /nfs/dbraw/zinc/19/22/81/336192281.db2.gz MFPJIHRBPYIHRB-WDEREUQCSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@@H]([NH2+]Cc1csc(Cl)n1)c1cccc([N+](=O)[O-])c1 ZINC000296394822 1127670842 /nfs/dbraw/zinc/67/08/42/1127670842.db2.gz VHADBFNIRQZLMD-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1ccc(Cn2cc[nH+]c2)cc1 ZINC000301064444 1128298730 /nfs/dbraw/zinc/29/87/30/1128298730.db2.gz OXRBAXMYHCNOMY-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO CCn1c2ccccc2[nH+]c1NCc1ccc([N+](=O)[O-])cc1 ZINC000158913476 1119624662 /nfs/dbraw/zinc/62/46/62/1119624662.db2.gz MSJAGDLBPVUCSM-UHFFFAOYSA-N 1 2 296.330 3.577 20 5 CHBDLO Cc1ccccc1C(N)=[NH+]O[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000727400333 1121717301 /nfs/dbraw/zinc/71/73/01/1121717301.db2.gz UEWCNDUBSYOWCG-LBPRGKRZSA-N 1 2 299.330 3.511 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000389464755 1121843619 /nfs/dbraw/zinc/84/36/19/1121843619.db2.gz HTPAOXGOVUBFIN-BXKDBHETSA-N 1 2 272.295 3.679 20 5 CHBDLO CCC(CC)C[N@H+](CC)Cc1cc(O)ccc1[N+](=O)[O-] ZINC001190325050 1122533526 /nfs/dbraw/zinc/53/35/26/1122533526.db2.gz KZIAEFBAQVSRRL-UHFFFAOYSA-N 1 2 280.368 3.559 20 5 CHBDLO CCC(CC)C[N@@H+](CC)Cc1cc(O)ccc1[N+](=O)[O-] ZINC001190325050 1122533530 /nfs/dbraw/zinc/53/35/30/1122533530.db2.gz KZIAEFBAQVSRRL-UHFFFAOYSA-N 1 2 280.368 3.559 20 5 CHBDLO C[C@H](c1cccs1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054173022 1122801771 /nfs/dbraw/zinc/80/17/71/1122801771.db2.gz JSADUCVIHREJER-SECBINFHSA-N 1 2 282.390 3.911 20 5 CHBDLO C[C@H](c1cccs1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054173022 1122801775 /nfs/dbraw/zinc/80/17/75/1122801775.db2.gz JSADUCVIHREJER-SECBINFHSA-N 1 2 282.390 3.911 20 5 CHBDLO Cc1cc[nH+]c2cc(Nc3cc(O)cc([N+](=O)[O-])c3)ccc12 ZINC001201224018 1123080436 /nfs/dbraw/zinc/08/04/36/1123080436.db2.gz HPXVOQMXSXPCLX-UHFFFAOYSA-N 1 2 295.298 3.901 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000449633771 1124832082 /nfs/dbraw/zinc/83/20/82/1124832082.db2.gz QDPDCXMUGDQNMK-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000449633771 1124832090 /nfs/dbraw/zinc/83/20/90/1124832090.db2.gz QDPDCXMUGDQNMK-MRXNPFEDSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2cccc(-n3cc[nH+]c3)c2)cc1 ZINC001174478181 1132882996 /nfs/dbraw/zinc/88/29/96/1132882996.db2.gz RCLNXYGMWGFFLH-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO c1cc(Nc2ccc3[nH+]c4ccccc4cc3c2)n[nH]1 ZINC001159741672 1132902811 /nfs/dbraw/zinc/90/28/11/1132902811.db2.gz NTUWWQBGDPWKHL-UHFFFAOYSA-N 1 2 260.300 3.855 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cc([N+](=O)[O-])ccc1OC ZINC001210443965 1134215091 /nfs/dbraw/zinc/21/50/91/1134215091.db2.gz BMJIRVDMDDTSDI-UHFFFAOYSA-N 1 2 287.319 3.613 20 5 CHBDLO Cc1cn2cccc(Nc3ccc(C)cc3[N+](=O)[O-])c2[nH+]1 ZINC001214167177 1134515214 /nfs/dbraw/zinc/51/52/14/1134515214.db2.gz ANJLNTJTGSGNTE-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO CSc1cc(Nc2cc(F)cc([N+](=O)[O-])c2)cc[nH+]1 ZINC001216482091 1134904275 /nfs/dbraw/zinc/90/42/75/1134904275.db2.gz UWTSWLPZMNHCGI-UHFFFAOYSA-N 1 2 279.296 3.594 20 5 CHBDLO COc1ccc(C[N@@H+]2Cc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000353839736 533574262 /nfs/dbraw/zinc/57/42/62/533574262.db2.gz AZZICOYFLNZNRX-LBPRGKRZSA-N 1 2 298.342 3.680 20 5 CHBDLO COc1ccc(C[N@H+]2Cc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000353839736 533574263 /nfs/dbraw/zinc/57/42/63/533574263.db2.gz AZZICOYFLNZNRX-LBPRGKRZSA-N 1 2 298.342 3.680 20 5 CHBDLO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1Cc2ccccc2C1 ZINC000353381905 228093236 /nfs/dbraw/zinc/09/32/36/228093236.db2.gz BAONTUOFZBKBEZ-UHFFFAOYSA-N 1 2 298.342 3.509 20 5 CHBDLO O=[N+]([O-])c1ccccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414853657 263071345 /nfs/dbraw/zinc/07/13/45/263071345.db2.gz SJNNSBOELFIGNK-UHFFFAOYSA-N 1 2 283.331 3.565 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[NH2+]Cc1c(F)cccc1Cl ZINC000048068884 328040922 /nfs/dbraw/zinc/04/09/22/328040922.db2.gz NBAXCUPPEZBUEP-UHFFFAOYSA-N 1 2 294.713 3.677 20 5 CHBDLO Cc1ccc(Cn2ccc3c2cccc3[N+](=O)[O-])c(C)[nH+]1 ZINC000358693207 328892560 /nfs/dbraw/zinc/89/25/60/328892560.db2.gz ZJWZCBRBBBPUGH-UHFFFAOYSA-N 1 2 281.315 3.610 20 5 CHBDLO Cc1ccc(C)c2[nH+]c(-c3cccc([N+](=O)[O-])c3)[nH]c21 ZINC000430937037 330577048 /nfs/dbraw/zinc/57/70/48/330577048.db2.gz YRZHOSNSRCTNPY-UHFFFAOYSA-N 1 2 267.288 3.755 20 5 CHBDLO C[C@H]1C[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])c2[nH+]ccn21 ZINC000345366279 335318683 /nfs/dbraw/zinc/31/86/83/335318683.db2.gz ZNHOWTNSULTDRS-KWQFWETISA-N 1 2 292.726 3.563 20 5 CHBDLO C[C@@H]1C[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])c2[nH+]ccn21 ZINC000345366278 335318743 /nfs/dbraw/zinc/31/87/43/335318743.db2.gz ZNHOWTNSULTDRS-KCJUWKMLSA-N 1 2 292.726 3.563 20 5 CHBDLO Cc1cc([NH+](C)C)ccc1NCc1ccccc1[N+](=O)[O-] ZINC000057667797 1127271964 /nfs/dbraw/zinc/27/19/64/1127271964.db2.gz QWVPNNNJCJQMNB-UHFFFAOYSA-N 1 2 285.347 3.581 20 5 CHBDLO CCC(F)(F)C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000598996738 1127650899 /nfs/dbraw/zinc/65/08/99/1127650899.db2.gz MHTSGJGBQDMCAY-XFFZJAGNSA-N 1 2 284.306 3.633 20 5 CHBDLO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1cccc[nH+]1 ZINC000468631326 1128014174 /nfs/dbraw/zinc/01/41/74/1128014174.db2.gz KQQFAIBCTKGJDR-XFXZXTDPSA-N 1 2 269.304 3.505 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000301060798 1128295973 /nfs/dbraw/zinc/29/59/73/1128295973.db2.gz LHESSEXCDOZGOP-UHFFFAOYSA-N 1 2 294.314 3.583 20 5 CHBDLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000072629803 1117781329 /nfs/dbraw/zinc/78/13/29/1117781329.db2.gz UJNZSJIBQYJBJK-LLVKDONJSA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ncsc1C[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000072629803 1117781332 /nfs/dbraw/zinc/78/13/32/1117781332.db2.gz UJNZSJIBQYJBJK-LLVKDONJSA-N 1 2 291.376 3.553 20 5 CHBDLO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348540912 1120681641 /nfs/dbraw/zinc/68/16/41/1120681641.db2.gz NPAVDGBTYIOJRV-INIZCTEOSA-N 1 2 298.342 3.550 20 5 CHBDLO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000348540912 1120681645 /nfs/dbraw/zinc/68/16/45/1120681645.db2.gz NPAVDGBTYIOJRV-INIZCTEOSA-N 1 2 298.342 3.550 20 5 CHBDLO Cc1cc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)nc(C2CC2)[nH+]1 ZINC000895667953 1123504307 /nfs/dbraw/zinc/50/43/07/1123504307.db2.gz VRNMHQYHCDPWRH-LLVKDONJSA-N 1 2 298.346 3.744 20 5 CHBDLO Cc1ccc(NCc2ccc(Cl)c([N+](=O)[O-])c2)c(C)[nH+]1 ZINC000119078915 1123828001 /nfs/dbraw/zinc/82/80/01/1123828001.db2.gz CQBYSCLOMNLKOI-UHFFFAOYSA-N 1 2 291.738 3.872 20 5 CHBDLO C[C@@H]([NH2+]Cc1nc(Cl)cs1)c1cccc([N+](=O)[O-])c1 ZINC000876946402 1124991697 /nfs/dbraw/zinc/99/16/97/1124991697.db2.gz QQVNWXYERQFNEV-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000282671307 1129278410 /nfs/dbraw/zinc/27/84/10/1129278410.db2.gz JCXASOVEAXSIEA-NEPJUHHUSA-N 1 2 289.335 3.611 20 5 CHBDLO C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036962875 1131982793 /nfs/dbraw/zinc/98/27/93/1131982793.db2.gz OSOZXBKALKVUSY-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036962875 1131982798 /nfs/dbraw/zinc/98/27/98/1131982798.db2.gz OSOZXBKALKVUSY-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC(F)(F)C1 ZINC001173226076 1132412737 /nfs/dbraw/zinc/41/27/37/1132412737.db2.gz KZBBMAYYZWHZBI-LBPRGKRZSA-N 1 2 298.333 3.647 20 5 CHBDLO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC(F)(F)C1 ZINC001173226076 1132412740 /nfs/dbraw/zinc/41/27/40/1132412740.db2.gz KZBBMAYYZWHZBI-LBPRGKRZSA-N 1 2 298.333 3.647 20 5 CHBDLO C1=C(Nc2ccc3[nH+]c4ccccc4cc3c2)COC1 ZINC001203395017 1133322989 /nfs/dbraw/zinc/32/29/89/1133322989.db2.gz NDYXIMNNPLVAKY-UHFFFAOYSA-N 1 2 262.312 3.714 20 5 CHBDLO Cc1ccc2c(Nc3ccc(N)c([N+](=O)[O-])c3)cccc2[nH+]1 ZINC001209937698 1134104311 /nfs/dbraw/zinc/10/43/11/1134104311.db2.gz IHBGAYGVOMSFGR-UHFFFAOYSA-N 1 2 294.314 3.777 20 5 CHBDLO Cc1cc[nH+]c2cc(Nc3ccc(N)c([N+](=O)[O-])c3)ccc12 ZINC001209938239 1134104339 /nfs/dbraw/zinc/10/43/39/1134104339.db2.gz QPYIQCOKAQCFBI-UHFFFAOYSA-N 1 2 294.314 3.777 20 5 CHBDLO Cc1cn2c(cccc2Nc2cc([N+](=O)[O-])ccc2C)[nH+]1 ZINC001211285258 1134403100 /nfs/dbraw/zinc/40/31/00/1134403100.db2.gz VDJAVIWBDDOKRG-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO COc1ccc(C[N@@H+]2Cc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000353839734 533574009 /nfs/dbraw/zinc/57/40/09/533574009.db2.gz AZZICOYFLNZNRX-GFCCVEGCSA-N 1 2 298.342 3.680 20 5 CHBDLO COc1ccc(C[N@H+]2Cc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000353839734 533574014 /nfs/dbraw/zinc/57/40/14/533574014.db2.gz AZZICOYFLNZNRX-GFCCVEGCSA-N 1 2 298.342 3.680 20 5 CHBDLO Cc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c[nH+]1 ZINC000182909323 261955690 /nfs/dbraw/zinc/95/56/90/261955690.db2.gz WOSGNIKBRFGOEK-LBPRGKRZSA-N 1 2 271.320 3.780 20 5 CHBDLO O=[N+]([O-])c1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1 ZINC000414854414 263071171 /nfs/dbraw/zinc/07/11/71/263071171.db2.gz UDINVTOQHXXHRU-UHFFFAOYSA-N 1 2 283.331 3.565 20 5 CHBDLO C[C@]1(F)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000449347705 327166148 /nfs/dbraw/zinc/16/61/48/327166148.db2.gz DKCAHMZSVHSBGF-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO C[C@]1(F)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000449347705 327166149 /nfs/dbraw/zinc/16/61/49/327166149.db2.gz DKCAHMZSVHSBGF-ZDUSSCGKSA-N 1 2 286.734 3.572 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000389464761 328847154 /nfs/dbraw/zinc/84/71/54/328847154.db2.gz HTPAOXGOVUBFIN-CABZTGNLSA-N 1 2 272.295 3.679 20 5 CHBDLO CC[C@@H]([NH2+][C@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242964 331106395 /nfs/dbraw/zinc/10/63/95/331106395.db2.gz IRHHIWFCRJWPGM-VXGBXAGGSA-N 1 2 272.295 3.679 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000582014264 336192394 /nfs/dbraw/zinc/19/23/94/336192394.db2.gz MFPJIHRBPYIHRB-QWRGUYRKSA-N 1 2 291.376 3.772 20 5 CHBDLO CC(C)[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccco1 ZINC000299405377 519663879 /nfs/dbraw/zinc/66/38/79/519663879.db2.gz XJGWKWUZVBENFO-UHFFFAOYSA-N 1 2 280.349 3.660 20 5 CHBDLO CC(C)[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccco1 ZINC000299405377 519663881 /nfs/dbraw/zinc/66/38/81/519663881.db2.gz XJGWKWUZVBENFO-UHFFFAOYSA-N 1 2 280.349 3.660 20 5 CHBDLO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000292812918 520484616 /nfs/dbraw/zinc/48/46/16/520484616.db2.gz OZEQTJCZMFMZDZ-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000292812918 520484642 /nfs/dbraw/zinc/48/46/42/520484642.db2.gz OZEQTJCZMFMZDZ-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000116269869 524396504 /nfs/dbraw/zinc/39/65/04/524396504.db2.gz LECUADSMXMQHNG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000116269869 524396511 /nfs/dbraw/zinc/39/65/11/524396511.db2.gz LECUADSMXMQHNG-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000037775645 527033177 /nfs/dbraw/zinc/03/31/77/527033177.db2.gz NUHGHGXDESZBCQ-VHSXEESVSA-N 1 2 291.376 3.772 20 5 CHBDLO CC(C)[N@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1F ZINC000352691801 528959901 /nfs/dbraw/zinc/95/99/01/528959901.db2.gz BGEDDSLACCKDKI-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO CC(C)[N@@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1F ZINC000352691801 528959906 /nfs/dbraw/zinc/95/99/06/528959906.db2.gz BGEDDSLACCKDKI-UHFFFAOYSA-N 1 2 292.310 3.738 20 5 CHBDLO Cc1cn2c(cccc2Nc2ccc(C)cc2[N+](=O)[O-])[nH+]1 ZINC001214164946 1125506111 /nfs/dbraw/zinc/50/61/11/1125506111.db2.gz GRZSWGQQCJDZFM-UHFFFAOYSA-N 1 2 282.303 3.603 20 5 CHBDLO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000483330149 1126782652 /nfs/dbraw/zinc/78/26/52/1126782652.db2.gz IDUAQYFIYIVEDC-CYBMUJFWSA-N 1 2 282.343 3.980 20 5 CHBDLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000483330149 1126782654 /nfs/dbraw/zinc/78/26/54/1126782654.db2.gz IDUAQYFIYIVEDC-CYBMUJFWSA-N 1 2 282.343 3.980 20 5 CHBDLO Cc1cc(Nc2ccc(N3CCCC3)[nH+]c2)ccc1[N+](=O)[O-] ZINC000301088848 1128329257 /nfs/dbraw/zinc/32/92/57/1128329257.db2.gz IPHQSZJRNVNTFE-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2)C2CC2)cs1 ZINC000047265758 1118298023 /nfs/dbraw/zinc/29/80/23/1118298023.db2.gz XATNHLLEVQOMCS-UHFFFAOYSA-N 1 2 288.372 3.821 20 5 CHBDLO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccccc2)C2CC2)cs1 ZINC000047265758 1118298025 /nfs/dbraw/zinc/29/80/25/1118298025.db2.gz XATNHLLEVQOMCS-UHFFFAOYSA-N 1 2 288.372 3.821 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610504839 1118585622 /nfs/dbraw/zinc/58/56/22/1118585622.db2.gz APOMSBYAKUYAKT-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610504839 1118585623 /nfs/dbraw/zinc/58/56/23/1118585623.db2.gz APOMSBYAKUYAKT-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO C[N@H+](Cc1ccsc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611772991 1119191700 /nfs/dbraw/zinc/19/17/00/1119191700.db2.gz MXCIYFDHZKKAFL-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1ccsc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611772991 1119191703 /nfs/dbraw/zinc/19/17/03/1119191703.db2.gz MXCIYFDHZKKAFL-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(O)ccc1[N+](=O)[O-] ZINC001193649697 1122706719 /nfs/dbraw/zinc/70/67/19/1122706719.db2.gz VNQLHGHYXPQZLV-IUODEOHRSA-N 1 2 292.379 3.749 20 5 CHBDLO Cc1ccc(F)c(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000507133362 1122928420 /nfs/dbraw/zinc/92/84/20/1122928420.db2.gz XHPKBHHHOKORHJ-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1ccc(F)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000507133362 1122928425 /nfs/dbraw/zinc/92/84/25/1122928425.db2.gz XHPKBHHHOKORHJ-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1cccnc1 ZINC000872017457 1124656953 /nfs/dbraw/zinc/65/69/53/1124656953.db2.gz CCGVYDICYRLJKK-QWRGUYRKSA-N 1 2 289.310 3.541 20 5 CHBDLO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000105503981 1125436995 /nfs/dbraw/zinc/43/69/95/1125436995.db2.gz JCNAXGJFOZRCQE-LBPRGKRZSA-N 1 2 291.376 3.601 20 5 CHBDLO C[N@H+](CCC(F)(F)F)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116273891 1129844910 /nfs/dbraw/zinc/84/49/10/1129844910.db2.gz BMTVOVATCRUSNY-UHFFFAOYSA-N 1 2 296.676 3.632 20 5 CHBDLO C[N@@H+](CCC(F)(F)F)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116273891 1129844912 /nfs/dbraw/zinc/84/49/12/1129844912.db2.gz BMTVOVATCRUSNY-UHFFFAOYSA-N 1 2 296.676 3.632 20 5 CHBDLO Cc1[nH]c2ccc(O[C@H](C)c3ccccc3[N+](=O)[O-])cc2[nH+]1 ZINC001228330273 1131858166 /nfs/dbraw/zinc/85/81/66/1131858166.db2.gz WPYMYEOKWMHKRP-SNVBAGLBSA-N 1 2 297.314 3.920 20 5 CHBDLO Cc1cc(NCc2cccc([N+](=O)[O-])c2)nc(C2CCC2)[nH+]1 ZINC001162537137 1133090728 /nfs/dbraw/zinc/09/07/28/1133090728.db2.gz OWIXYAFXEIODPY-UHFFFAOYSA-N 1 2 298.346 3.573 20 5 CHBDLO Cc1ccc(Nc2cccc(-n3cc[nH+]c3)c2)c([N+](=O)[O-])c1 ZINC001214171922 1134516280 /nfs/dbraw/zinc/51/62/80/1134516280.db2.gz OSXSWPGEOJNFKI-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO O=[N+]([O-])c1cc(F)cc(Nc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001216482030 1134904820 /nfs/dbraw/zinc/90/48/20/1134904820.db2.gz QIGFJOOBXYQYFV-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO O=[N+]([O-])c1ccccc1NCc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000341928629 130159337 /nfs/dbraw/zinc/15/93/37/130159337.db2.gz FXEFPPWDLVKFOM-UHFFFAOYSA-N 1 2 294.314 3.597 20 5 CHBDLO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(C)(F)F)cc1[N+](=O)[O-] ZINC000389462259 328848356 /nfs/dbraw/zinc/84/83/56/328848356.db2.gz DZGWLJFWZIKZRE-NXEZZACHSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cc(CNc2cccc(C)c2[N+](=O)[O-])cc(C)[nH+]1 ZINC000420659176 329780915 /nfs/dbraw/zinc/78/09/15/329780915.db2.gz ZQPVIQJFXHKUII-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1ccc(Nc2ccc3c(c2)[nH+]cn3C)c([N+](=O)[O-])c1 ZINC000514206013 330461602 /nfs/dbraw/zinc/46/16/02/330461602.db2.gz JLXJMHRDEFBVJM-UHFFFAOYSA-N 1 2 282.303 3.534 20 5 CHBDLO COc1cc(-c2[nH]c3c([nH+]2)c(C)ccc3C)ccc1[N+](=O)[O-] ZINC000430937754 330577056 /nfs/dbraw/zinc/57/70/56/330577056.db2.gz FBAILRVJGSWASF-UHFFFAOYSA-N 1 2 297.314 3.764 20 5 CHBDLO C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000081574288 334197579 /nfs/dbraw/zinc/19/75/79/334197579.db2.gz OGZMAUFXCNEEPY-NHYWBVRUSA-N 1 2 288.372 3.849 20 5 CHBDLO C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000081574288 334197581 /nfs/dbraw/zinc/19/75/81/334197581.db2.gz OGZMAUFXCNEEPY-NHYWBVRUSA-N 1 2 288.372 3.849 20 5 CHBDLO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3F)CC2)cs1 ZINC000130525307 527329844 /nfs/dbraw/zinc/32/98/44/527329844.db2.gz UWDFADVHDMOLFS-UHFFFAOYSA-N 1 2 292.335 3.574 20 5 CHBDLO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC=C(F)C1 ZINC000470203429 1128065704 /nfs/dbraw/zinc/06/57/04/1128065704.db2.gz PZXRHEZBRUMHHZ-WQLSENKSSA-N 1 2 276.311 3.557 20 5 CHBDLO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC=C(F)C1 ZINC000470203429 1128065708 /nfs/dbraw/zinc/06/57/08/1128065708.db2.gz PZXRHEZBRUMHHZ-WQLSENKSSA-N 1 2 276.311 3.557 20 5 CHBDLO Cc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000072578505 1117770067 /nfs/dbraw/zinc/77/00/67/1117770067.db2.gz SGMHIJRSQKUFIU-JTQLQIEISA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000072578505 1117770070 /nfs/dbraw/zinc/77/00/70/1117770070.db2.gz SGMHIJRSQKUFIU-JTQLQIEISA-N 1 2 291.376 3.553 20 5 CHBDLO CC(F)(F)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000579097636 1118298927 /nfs/dbraw/zinc/29/89/27/1118298927.db2.gz FCJUIXRHTRTSMM-ZDUSSCGKSA-N 1 2 284.306 3.607 20 5 CHBDLO Cc1ccc([C@H](C)[NH2+]C/C(Cl)=C\Cl)cc1[N+](=O)[O-] ZINC000588384065 1118484901 /nfs/dbraw/zinc/48/49/01/1118484901.db2.gz ZQEOZAIXLOZRJZ-CAXXOGMASA-N 1 2 289.162 3.873 20 5 CHBDLO Cc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC000094664050 1120053743 /nfs/dbraw/zinc/05/37/43/1120053743.db2.gz HOLSOXGWRQWMLS-LLVKDONJSA-N 1 2 271.320 3.780 20 5 CHBDLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000092223838 1120121156 /nfs/dbraw/zinc/12/11/56/1120121156.db2.gz OEBACGXXJWKUEQ-ZDUSSCGKSA-N 1 2 291.376 3.634 20 5 CHBDLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000092223838 1120121161 /nfs/dbraw/zinc/12/11/61/1120121161.db2.gz OEBACGXXJWKUEQ-ZDUSSCGKSA-N 1 2 291.376 3.634 20 5 CHBDLO CCc1ccc[nH+]c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175898971 1121492103 /nfs/dbraw/zinc/49/21/03/1121492103.db2.gz HFUSNSUQYHNAHK-PKNBQFBNSA-N 1 2 269.304 3.635 20 5 CHBDLO CCOc1cc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)cc(C)[nH+]1 ZINC001175900672 1121493513 /nfs/dbraw/zinc/49/35/13/1121493513.db2.gz CPTZCFJNQWYRCF-CMDGGOBGSA-N 1 2 299.330 3.780 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000730818165 1121829134 /nfs/dbraw/zinc/82/91/34/1121829134.db2.gz IZRLEROIYMCPRZ-SNVBAGLBSA-N 1 2 291.376 3.519 20 5 CHBDLO CC[N@H+](Cc1occc1C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000839661686 1123222633 /nfs/dbraw/zinc/22/26/33/1123222633.db2.gz QBGQGOFABFZQPY-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO CC[N@@H+](Cc1occc1C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000839661686 1123222637 /nfs/dbraw/zinc/22/26/37/1123222637.db2.gz QBGQGOFABFZQPY-UHFFFAOYSA-N 1 2 292.310 3.657 20 5 CHBDLO CC(C)=CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788464963 1130188288 /nfs/dbraw/zinc/18/82/88/1130188288.db2.gz VPLOOWQOPZSDRE-UHFFFAOYSA-N 1 2 268.744 3.646 20 5 CHBDLO CC(C)=CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788464963 1130188285 /nfs/dbraw/zinc/18/82/85/1130188285.db2.gz VPLOOWQOPZSDRE-UHFFFAOYSA-N 1 2 268.744 3.646 20 5 CHBDLO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000748820951 1130249049 /nfs/dbraw/zinc/24/90/49/1130249049.db2.gz ZVBYEVDAELDHEM-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000748820951 1130249053 /nfs/dbraw/zinc/24/90/53/1130249053.db2.gz ZVBYEVDAELDHEM-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001211288199 1134403703 /nfs/dbraw/zinc/40/37/03/1134403703.db2.gz JZHJGQBKHUYRQO-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)c([N+](=O)[O-])c1 ZINC001214169289 1134515886 /nfs/dbraw/zinc/51/58/86/1134515886.db2.gz FPKBBSOQUHJGGI-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353665973 228141727 /nfs/dbraw/zinc/14/17/27/228141727.db2.gz MTAYVEQHRDJKDG-NSHDSACASA-N 1 2 288.372 3.603 20 5 CHBDLO C[C@H]1Cc2ccccc2C[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353665973 228141729 /nfs/dbraw/zinc/14/17/29/228141729.db2.gz MTAYVEQHRDJKDG-NSHDSACASA-N 1 2 288.372 3.603 20 5 CHBDLO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037771887 260116292 /nfs/dbraw/zinc/11/62/92/260116292.db2.gz JCCPVUGWLMOAGL-MRVPVSSYSA-N 1 2 298.314 3.785 20 5 CHBDLO Cc1cc([N+](=O)[O-])ccc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414844565 263059034 /nfs/dbraw/zinc/05/90/34/263059034.db2.gz DTKUSLBRNDBQHO-UHFFFAOYSA-N 1 2 297.358 3.873 20 5 CHBDLO O=[N+]([O-])c1ccc(C[NH2+]C2(C(F)F)CCCCC2)cc1 ZINC000510108562 332892982 /nfs/dbraw/zinc/89/29/82/332892982.db2.gz LYAMZSTVDRGKFN-UHFFFAOYSA-N 1 2 284.306 3.652 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(F)F ZINC000453245500 331106737 /nfs/dbraw/zinc/10/67/37/331106737.db2.gz KXUXFUUHKACGQZ-GXSJLCMTSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(C(F)F)CCCCC1 ZINC000512852254 332989533 /nfs/dbraw/zinc/98/95/33/332989533.db2.gz TVRWDJNSNFXUJK-UHFFFAOYSA-N 1 2 298.333 3.961 20 5 CHBDLO CCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000183801006 333122534 /nfs/dbraw/zinc/12/25/34/333122534.db2.gz LSZNAWZDBQEPSL-UHFFFAOYSA-N 1 2 294.738 3.693 20 5 CHBDLO C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245431793 334192469 /nfs/dbraw/zinc/19/24/69/334192469.db2.gz OGZMAUFXCNEEPY-XHDPSFHLSA-N 1 2 288.372 3.849 20 5 CHBDLO C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245431793 334192470 /nfs/dbraw/zinc/19/24/70/334192470.db2.gz OGZMAUFXCNEEPY-XHDPSFHLSA-N 1 2 288.372 3.849 20 5 CHBDLO C[N@H+](Cc1sccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000194331457 336017280 /nfs/dbraw/zinc/01/72/80/336017280.db2.gz XXCYTMUIOXBDJI-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1sccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000194331457 336017282 /nfs/dbraw/zinc/01/72/82/336017282.db2.gz XXCYTMUIOXBDJI-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO Cc1ccsc1C[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054153170 1121721688 /nfs/dbraw/zinc/72/16/88/1121721688.db2.gz AWRQMJIVJMDDDC-UHFFFAOYSA-N 1 2 282.390 3.658 20 5 CHBDLO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000483312090 1126780971 /nfs/dbraw/zinc/78/09/71/1126780971.db2.gz RODRDCQMCNKJIG-CYBMUJFWSA-N 1 2 282.343 3.980 20 5 CHBDLO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000483312090 1126780974 /nfs/dbraw/zinc/78/09/74/1126780974.db2.gz RODRDCQMCNKJIG-CYBMUJFWSA-N 1 2 282.343 3.980 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000349768055 1127160160 /nfs/dbraw/zinc/16/01/60/1127160160.db2.gz MJYANLYPCRIYNH-INIZCTEOSA-N 1 2 298.342 3.638 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000349768055 1127160163 /nfs/dbraw/zinc/16/01/63/1127160163.db2.gz MJYANLYPCRIYNH-INIZCTEOSA-N 1 2 298.342 3.638 20 5 CHBDLO CC(C)c1ccc(C[NH+]2CC3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000594608999 1127425541 /nfs/dbraw/zinc/42/55/41/1127425541.db2.gz LMKJPOMWXLYXLA-UHFFFAOYSA-N 1 2 296.317 3.559 20 5 CHBDLO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000293880602 1127529356 /nfs/dbraw/zinc/52/93/56/1127529356.db2.gz JRWPGCDGXKPEES-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000293880602 1127529358 /nfs/dbraw/zinc/52/93/58/1127529358.db2.gz JRWPGCDGXKPEES-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)nc1 ZINC000030538162 1128085051 /nfs/dbraw/zinc/08/50/51/1128085051.db2.gz IOZBUYFGXRLOIL-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO CCC1CCC([N@H+](C)Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC001167586402 1119120231 /nfs/dbraw/zinc/12/02/31/1119120231.db2.gz MJSCNWADIYRUFP-UHFFFAOYSA-N 1 2 292.379 3.701 20 5 CHBDLO CCC1CCC([N@@H+](C)Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC001167586402 1119120233 /nfs/dbraw/zinc/12/02/33/1119120233.db2.gz MJSCNWADIYRUFP-UHFFFAOYSA-N 1 2 292.379 3.701 20 5 CHBDLO C[C@@H](c1ccccc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465208 1120252636 /nfs/dbraw/zinc/25/26/36/1120252636.db2.gz VVLFGMMILRAUNU-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@@H](c1ccccc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465208 1120252639 /nfs/dbraw/zinc/25/26/39/1120252639.db2.gz VVLFGMMILRAUNU-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO O=[N+]([O-])c1ccc(F)c(Nc2ccccc2-n2cc[nH+]c2)c1 ZINC001175736040 1121441515 /nfs/dbraw/zinc/44/15/15/1121441515.db2.gz UJMHISBQXFMYBG-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO Cc1ccoc1C[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000429404223 1121566275 /nfs/dbraw/zinc/56/62/75/1121566275.db2.gz LPUCIXZBXUCESJ-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccoc1C[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000429404223 1121566279 /nfs/dbraw/zinc/56/62/79/1121566279.db2.gz LPUCIXZBXUCESJ-UHFFFAOYSA-N 1 2 294.738 3.782 20 5 CHBDLO Cc1ccsc1C[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054153170 1121721681 /nfs/dbraw/zinc/72/16/81/1121721681.db2.gz AWRQMJIVJMDDDC-UHFFFAOYSA-N 1 2 282.390 3.658 20 5 CHBDLO Cc1c(CNc2c[nH+]cc3c2CCCC3)cccc1[N+](=O)[O-] ZINC001179148269 1121853626 /nfs/dbraw/zinc/85/36/26/1121853626.db2.gz MYBHMCBOGWGUDX-UHFFFAOYSA-N 1 2 297.358 3.789 20 5 CHBDLO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1Cc2ccccc2C1 ZINC000436130541 1122515470 /nfs/dbraw/zinc/51/54/70/1122515470.db2.gz XPNAABWKSGEGIQ-LBPRGKRZSA-N 1 2 268.316 3.672 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000449635564 1124832214 /nfs/dbraw/zinc/83/22/14/1124832214.db2.gz UHVJLRRQXVXURU-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000449635564 1124832222 /nfs/dbraw/zinc/83/22/22/1124832222.db2.gz UHVJLRRQXVXURU-INIZCTEOSA-N 1 2 298.342 3.915 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1F ZINC000801519556 1129923427 /nfs/dbraw/zinc/92/34/27/1129923427.db2.gz RJRRBWPSSVBBFD-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1F ZINC000801519556 1129923429 /nfs/dbraw/zinc/92/34/29/1129923429.db2.gz RJRRBWPSSVBBFD-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CC3(C2)CCCC3)c1 ZINC000813331150 1130759821 /nfs/dbraw/zinc/75/98/21/1130759821.db2.gz FXTIKNVKKQXSLU-UHFFFAOYSA-N 1 2 280.755 3.624 20 5 CHBDLO O=C1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001141727685 1132242112 /nfs/dbraw/zinc/24/21/12/1132242112.db2.gz BXHSBPWZTQECBZ-UHFFFAOYSA-N 1 2 275.351 3.768 20 5 CHBDLO O=C1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001141727685 1132242114 /nfs/dbraw/zinc/24/21/14/1132242114.db2.gz BXHSBPWZTQECBZ-UHFFFAOYSA-N 1 2 275.351 3.768 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2cccc(-n3cc[nH+]c3)c2)c1 ZINC001204455343 1133450389 /nfs/dbraw/zinc/45/03/89/1133450389.db2.gz AGYLGVCWMOGICY-UHFFFAOYSA-N 1 2 280.287 3.524 20 5 CHBDLO Nc1ccc(Nc2cccc(C3CCC3)[nH+]2)cc1[N+](=O)[O-] ZINC001209935212 1134104195 /nfs/dbraw/zinc/10/41/95/1134104195.db2.gz XLQGSPYGCLDUNU-UHFFFAOYSA-N 1 2 284.319 3.583 20 5 CHBDLO O=[N+]([O-])c1cc(F)ccc1Nc1cccc(-n2cc[nH+]c2)c1 ZINC001210956131 1134339102 /nfs/dbraw/zinc/33/91/02/1134339102.db2.gz QSKMQYDTMMNKEL-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO O=[N+]([O-])c1cc(Nc2ccc(-n3cc[nH+]c3)cc2)ccc1F ZINC001211192769 1134388788 /nfs/dbraw/zinc/38/87/88/1134388788.db2.gz MEIDBAIIWBRSCB-UHFFFAOYSA-N 1 2 298.277 3.663 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cc([N+](=O)[O-])ccc1C ZINC001211288317 1134403368 /nfs/dbraw/zinc/40/33/68/1134403368.db2.gz PLVSVAWIRNXLGL-UHFFFAOYSA-N 1 2 271.320 3.913 20 5 CHBDLO C[N@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035719172 172372860 /nfs/dbraw/zinc/37/28/60/172372860.db2.gz JRDQINUEGITJMC-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035719172 172372861 /nfs/dbraw/zinc/37/28/61/172372861.db2.gz JRDQINUEGITJMC-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(C)(F)F)cc1[N+](=O)[O-] ZINC000389462267 328848379 /nfs/dbraw/zinc/84/83/79/328848379.db2.gz DZGWLJFWZIKZRE-ZJUUUORDSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cc[nH+]c(NCCc2ccccc2[N+](=O)[O-])c1Cl ZINC000557582018 327013810 /nfs/dbraw/zinc/01/38/10/327013810.db2.gz QUUGYPIYWOMHMG-UHFFFAOYSA-N 1 2 291.738 3.606 20 5 CHBDLO CC1(C)C[C@@H]([NH2+]C2(C(F)F)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000503856069 332696732 /nfs/dbraw/zinc/69/67/32/332696732.db2.gz MWCVABGONIEUCV-GFCCVEGCSA-N 1 2 296.317 3.705 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)c1ncc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000220951377 333171190 /nfs/dbraw/zinc/17/11/90/333171190.db2.gz MIQMQWBLRCCMHW-FZMZJTMJSA-N 1 2 289.335 3.693 20 5 CHBDLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000134899395 334107671 /nfs/dbraw/zinc/10/76/71/334107671.db2.gz YITSVPHNJRDBRQ-QWRGUYRKSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1cc(N[C@@H](c2[nH]cc[nH+]2)C(C)C)c(F)cc1[N+](=O)[O-] ZINC000292348141 525294744 /nfs/dbraw/zinc/29/47/44/525294744.db2.gz BUGPNIJLMRVUJM-CYBMUJFWSA-N 1 2 292.314 3.575 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000041010459 526891575 /nfs/dbraw/zinc/89/15/75/526891575.db2.gz AUDUKSQIOPMUNE-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000266431411 1126982433 /nfs/dbraw/zinc/98/24/33/1126982433.db2.gz DESBRKIVOYDJSJ-NXEZZACHSA-N 1 2 291.376 3.772 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2c2ccc(F)cc2)cc1 ZINC000595705476 1127473187 /nfs/dbraw/zinc/47/31/87/1127473187.db2.gz ULBSQOKRAPUXQH-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2c2ccc(F)cc2)cc1 ZINC000595705476 1127473190 /nfs/dbraw/zinc/47/31/90/1127473190.db2.gz ULBSQOKRAPUXQH-INIZCTEOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccc[nH+]c2N2CCCCC2)c1 ZINC001204415617 1117781942 /nfs/dbraw/zinc/78/19/42/1117781942.db2.gz LIRCCGKZKATEKP-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO C[C@H]1c2ccccc2CC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353392928 1119555077 /nfs/dbraw/zinc/55/50/77/1119555077.db2.gz HSGRVUUEUQRDEJ-NSHDSACASA-N 1 2 288.372 3.776 20 5 CHBDLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353392928 1119555081 /nfs/dbraw/zinc/55/50/81/1119555081.db2.gz HSGRVUUEUQRDEJ-NSHDSACASA-N 1 2 288.372 3.776 20 5 CHBDLO Cc1cn2c(cccc2Nc2ccc(/C=C/[N+](=O)[O-])cc2)[nH+]1 ZINC001175901018 1121493639 /nfs/dbraw/zinc/49/36/39/1121493639.db2.gz WULYRIVPCALAKP-MDZDMXLPSA-N 1 2 294.314 3.634 20 5 CHBDLO CCCc1cc[nH+]c(Nc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC001176364293 1121615256 /nfs/dbraw/zinc/61/52/56/1121615256.db2.gz WZDVBYCLOCZFNX-UHFFFAOYSA-N 1 2 287.319 3.695 20 5 CHBDLO C[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc(Cl)c1 ZINC000047264911 1121617852 /nfs/dbraw/zinc/61/78/52/1121617852.db2.gz YTKGMXFKYQDLTC-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1cccc(Cl)c1 ZINC000047264911 1121617855 /nfs/dbraw/zinc/61/78/55/1121617855.db2.gz YTKGMXFKYQDLTC-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cs1 ZINC000126583274 1122705714 /nfs/dbraw/zinc/70/57/14/1122705714.db2.gz VBVONYGKYVHAQY-JTQLQIEISA-N 1 2 291.376 3.519 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000579623726 1123231507 /nfs/dbraw/zinc/23/15/07/1123231507.db2.gz OTHRNRSAQUZPEQ-GXFFZTMASA-N 1 2 291.376 3.853 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1ccc([N+](=O)[O-])cc1 ZINC001174478058 1132883067 /nfs/dbraw/zinc/88/30/67/1132883067.db2.gz KWNDVRJHERKMEP-UHFFFAOYSA-N 1 2 257.293 3.604 20 5 CHBDLO CC[N@H+](C)c1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC001174480270 1132884426 /nfs/dbraw/zinc/88/44/26/1132884426.db2.gz PIXOGBAIDCJGKH-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CC[N@@H+](C)c1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC001174480270 1132884435 /nfs/dbraw/zinc/88/44/35/1132884435.db2.gz PIXOGBAIDCJGKH-UHFFFAOYSA-N 1 2 271.320 3.795 20 5 CHBDLO CCc1ccc(C)[nH+]c1Nc1cccc([N+](=O)[O-])c1 ZINC001204406619 1133442899 /nfs/dbraw/zinc/44/28/99/1133442899.db2.gz GGDDNQSVENOVDS-UHFFFAOYSA-N 1 2 257.293 3.604 20 5 CHBDLO COc1ccc([N+](=O)[O-])cc1Nc1cccc2cc[nH+]cc21 ZINC001210446886 1134215875 /nfs/dbraw/zinc/21/58/75/1134215875.db2.gz RIGZQZCQNMIQQC-UHFFFAOYSA-N 1 2 295.298 3.895 20 5 CHBDLO CCOc1cc(Nc2ccc(F)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001211190217 1134387207 /nfs/dbraw/zinc/38/72/07/1134387207.db2.gz BCISHMYFGVYFRC-UHFFFAOYSA-N 1 2 291.282 3.580 20 5 CHBDLO Cc1ccc([N+](=O)[O-])cc1Nc1ccc[nH+]c1N1CCCC1 ZINC001211285349 1134402854 /nfs/dbraw/zinc/40/28/54/1134402854.db2.gz FYTAFRZWXBJBAX-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO Cc1ccc(Nc2ccc3c(c2)[nH+]cn3C)cc1[N+](=O)[O-] ZINC001213667058 1134476232 /nfs/dbraw/zinc/47/62/32/1134476232.db2.gz JWUORDRSVCAQEN-UHFFFAOYSA-N 1 2 282.303 3.534 20 5 CHBDLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000035164249 172025768 /nfs/dbraw/zinc/02/57/68/172025768.db2.gz LTFINTSFGPRRRW-LBPRGKRZSA-N 1 2 285.347 3.834 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+](CCC(F)(F)F)C1CC1 ZINC000355882861 228034867 /nfs/dbraw/zinc/03/48/67/228034867.db2.gz SUMPTLUWDBGCLB-UHFFFAOYSA-N 1 2 288.269 3.512 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+](CCC(F)(F)F)C1CC1 ZINC000355882861 228034870 /nfs/dbraw/zinc/03/48/70/228034870.db2.gz SUMPTLUWDBGCLB-UHFFFAOYSA-N 1 2 288.269 3.512 20 5 CHBDLO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])n1 ZINC000080272607 260179581 /nfs/dbraw/zinc/17/95/81/260179581.db2.gz OPWAKFKPXLASTQ-MNOVXSKESA-N 1 2 291.376 3.772 20 5 CHBDLO CCC[C@@H]([NH2+]Cc1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000108941660 262073982 /nfs/dbraw/zinc/07/39/82/262073982.db2.gz NQQBTWQHDVAPFY-CQSZACIVSA-N 1 2 291.376 3.682 20 5 CHBDLO Cc1occc1C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000414368158 328156217 /nfs/dbraw/zinc/15/62/17/328156217.db2.gz GNWVQXBGMVIPIO-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO Cc1occc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000414368158 328156218 /nfs/dbraw/zinc/15/62/18/328156218.db2.gz GNWVQXBGMVIPIO-UHFFFAOYSA-N 1 2 286.331 3.661 20 5 CHBDLO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000037562788 326855313 /nfs/dbraw/zinc/85/53/13/326855313.db2.gz IDQXXHOQZKNISL-MRVPVSSYSA-N 1 2 298.314 3.785 20 5 CHBDLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000559854292 327265293 /nfs/dbraw/zinc/26/52/93/327265293.db2.gz SRDVGVYPLRTQPP-JOYOIKCWSA-N 1 2 292.360 3.663 20 5 CHBDLO Cc1ccc(CNc2cccc([N+](=O)[O-])c2C)c(C)[nH+]1 ZINC000187704998 329362638 /nfs/dbraw/zinc/36/26/38/329362638.db2.gz FJMPWXUBKMHOGU-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1c[nH+]ccc1CCSCc1ccc([N+](=O)[O-])cc1 ZINC000421834056 330091572 /nfs/dbraw/zinc/09/15/72/330091572.db2.gz JUHJHGJIYMFTEZ-UHFFFAOYSA-N 1 2 288.372 3.774 20 5 CHBDLO Cc1cc(C)c(CNc2c(C)cccc2[N+](=O)[O-])c[nH+]1 ZINC000397132779 330239901 /nfs/dbraw/zinc/23/99/01/330239901.db2.gz ZSWZIDSPXCQVDC-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO CC1(C)C[C@H]([NH2+]C2(C(F)F)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000503856070 332696744 /nfs/dbraw/zinc/69/67/44/332696744.db2.gz MWCVABGONIEUCV-LBPRGKRZSA-N 1 2 296.317 3.705 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000348314753 1125533919 /nfs/dbraw/zinc/53/39/19/1125533919.db2.gz ZSSVLOIBONLBTE-ZJUUUORDSA-N 1 2 291.376 3.772 20 5 CHBDLO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1F ZINC000043626410 1127002090 /nfs/dbraw/zinc/00/20/90/1127002090.db2.gz CHMPNVCGDKMATB-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1F ZINC000043626410 1127002094 /nfs/dbraw/zinc/00/20/94/1127002094.db2.gz CHMPNVCGDKMATB-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO Cc1cc(NCCCc2cccc(C)[nH+]2)c([N+](=O)[O-])s1 ZINC000596234367 1127486257 /nfs/dbraw/zinc/48/62/57/1127486257.db2.gz PSAGBBQYQFAOTJ-UHFFFAOYSA-N 1 2 291.376 3.713 20 5 CHBDLO C[N@H+](Cc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494146085 1128157295 /nfs/dbraw/zinc/15/72/95/1128157295.db2.gz REPYGEOILKNONN-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[N@@H+](Cc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494146085 1128157298 /nfs/dbraw/zinc/15/72/98/1128157298.db2.gz REPYGEOILKNONN-UHFFFAOYSA-N 1 2 290.750 3.880 20 5 CHBDLO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1F ZINC000072555780 1117762203 /nfs/dbraw/zinc/76/22/03/1117762203.db2.gz WQODELWKJFUNGA-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1F ZINC000072555780 1117762207 /nfs/dbraw/zinc/76/22/07/1117762207.db2.gz WQODELWKJFUNGA-LBPRGKRZSA-N 1 2 288.322 3.927 20 5 CHBDLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072629802 1117781340 /nfs/dbraw/zinc/78/13/40/1117781340.db2.gz UJNZSJIBQYJBJK-NSHDSACASA-N 1 2 291.376 3.553 20 5 CHBDLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072629802 1117781342 /nfs/dbraw/zinc/78/13/42/1117781342.db2.gz UJNZSJIBQYJBJK-NSHDSACASA-N 1 2 291.376 3.553 20 5 CHBDLO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1cccc([N+](=O)[O-])c1 ZINC000579623725 1128753530 /nfs/dbraw/zinc/75/35/30/1128753530.db2.gz OTHRNRSAQUZPEQ-GWCFXTLKSA-N 1 2 291.376 3.853 20 5 CHBDLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000092223839 1120122630 /nfs/dbraw/zinc/12/26/30/1120122630.db2.gz OEBACGXXJWKUEQ-CYBMUJFWSA-N 1 2 291.376 3.634 20 5 CHBDLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000092223839 1120122632 /nfs/dbraw/zinc/12/26/32/1120122632.db2.gz OEBACGXXJWKUEQ-CYBMUJFWSA-N 1 2 291.376 3.634 20 5 CHBDLO C[N@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313853103 1120413650 /nfs/dbraw/zinc/41/36/50/1120413650.db2.gz SWIUSDMJRBZQDD-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO C[N@@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313853103 1120413653 /nfs/dbraw/zinc/41/36/53/1120413653.db2.gz SWIUSDMJRBZQDD-UHFFFAOYSA-N 1 2 292.285 3.505 20 5 CHBDLO CCc1cccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)[nH+]1 ZINC001175900936 1121493690 /nfs/dbraw/zinc/49/36/90/1121493690.db2.gz GADPCBZPNLQNAJ-ZHACJKMWSA-N 1 2 269.304 3.635 20 5 CHBDLO O=[N+]([O-])c1ccc(Oc2cccc(-n3cc[nH+]c3)c2)c(F)c1 ZINC000077982146 1121594419 /nfs/dbraw/zinc/59/44/19/1121594419.db2.gz SBHLULYXMIRBRO-UHFFFAOYSA-N 1 2 299.261 3.712 20 5 CHBDLO Cc1cccc(C[N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505912734 1122600450 /nfs/dbraw/zinc/60/04/50/1122600450.db2.gz NZTMPZOZNMVCGM-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO Cc1cccc(C[N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505912734 1122600451 /nfs/dbraw/zinc/60/04/51/1122600451.db2.gz NZTMPZOZNMVCGM-UHFFFAOYSA-N 1 2 288.322 3.674 20 5 CHBDLO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788858 1122615669 /nfs/dbraw/zinc/61/56/69/1122615669.db2.gz ARBAKKYXSVBECD-IUODEOHRSA-N 1 2 292.379 3.701 20 5 CHBDLO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788858 1122615672 /nfs/dbraw/zinc/61/56/72/1122615672.db2.gz ARBAKKYXSVBECD-IUODEOHRSA-N 1 2 292.379 3.701 20 5 CHBDLO Nc1ccc(Nc2cccc3nc4ccccc4nc32)c[nH+]1 ZINC001201292437 1123084398 /nfs/dbraw/zinc/08/43/98/1123084398.db2.gz OGSYOBNXOZGFDU-UHFFFAOYSA-N 1 2 287.326 3.504 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1F ZINC000801519555 1129923477 /nfs/dbraw/zinc/92/34/77/1129923477.db2.gz RJRRBWPSSVBBFD-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1F ZINC000801519555 1129923478 /nfs/dbraw/zinc/92/34/78/1129923478.db2.gz RJRRBWPSSVBBFD-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(Nc2cc(Cl)c3[nH+]ccn3c2)cc1 ZINC001174477811 1132882001 /nfs/dbraw/zinc/88/20/01/1132882001.db2.gz XDAMWKAJYVAQLD-UHFFFAOYSA-N 1 2 288.694 3.640 20 5 CHBDLO Cc1cc[nH+]c(C(C)C)c1Nc1ccc([N+](=O)[O-])nc1 ZINC001203571065 1133340506 /nfs/dbraw/zinc/34/05/06/1133340506.db2.gz FZWULGYCIZPQFT-UHFFFAOYSA-N 1 2 272.308 3.560 20 5 CHBDLO CCC[C@H]([NH2+]CC(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000574828115 335051204 /nfs/dbraw/zinc/05/12/04/335051204.db2.gz JHDBFHSFBCETII-LBPRGKRZSA-N 1 2 272.295 3.681 20 5 CHBDLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1[N+](=O)[O-] ZINC000342281009 130413356 /nfs/dbraw/zinc/41/33/56/130413356.db2.gz LXBGYASIHUMKPZ-LLVKDONJSA-N 1 2 297.314 3.587 20 5 CHBDLO C[C@H]1c2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000352619145 227116574 /nfs/dbraw/zinc/11/65/74/227116574.db2.gz ZMVPELIQUZWLCQ-NSHDSACASA-N 1 2 286.306 3.811 20 5 CHBDLO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000352619145 227116579 /nfs/dbraw/zinc/11/65/79/227116579.db2.gz ZMVPELIQUZWLCQ-NSHDSACASA-N 1 2 286.306 3.811 20 5 CHBDLO CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1[nH]cc[nH+]1 ZINC000139795252 263037686 /nfs/dbraw/zinc/03/76/86/263037686.db2.gz VUFPCJWZBCIKER-VIFPVBQESA-N 1 2 280.715 3.535 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000292718899 263134310 /nfs/dbraw/zinc/13/43/10/263134310.db2.gz FCEKFAULSGPSKD-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000292718899 263134311 /nfs/dbraw/zinc/13/43/11/263134311.db2.gz FCEKFAULSGPSKD-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CCCCNc1cc(C)[nH+]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000301117364 328826584 /nfs/dbraw/zinc/82/65/84/328826584.db2.gz XBDGZRCJRQDTTE-UHFFFAOYSA-N 1 2 286.335 3.572 20 5 CHBDLO Cc1ccc(COc2ccc([N+](=O)[O-])cc2Cl)c(C)[nH+]1 ZINC000185235001 329269159 /nfs/dbraw/zinc/26/91/59/329269159.db2.gz DSMVUJCDXPYWIS-UHFFFAOYSA-N 1 2 292.722 3.839 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(F)c1 ZINC000491900915 332374341 /nfs/dbraw/zinc/37/43/41/332374341.db2.gz IWQKXVMXHMITRT-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)c(F)c1 ZINC000491900915 332374343 /nfs/dbraw/zinc/37/43/43/332374343.db2.gz IWQKXVMXHMITRT-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000220951686 333171140 /nfs/dbraw/zinc/17/11/40/333171140.db2.gz RTVCQCDJYQSOGP-VXGBXAGGSA-N 1 2 289.335 3.611 20 5 CHBDLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000134899442 334107507 /nfs/dbraw/zinc/10/75/07/334107507.db2.gz YITSVPHNJRDBRQ-MNOVXSKESA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000135126366 334116848 /nfs/dbraw/zinc/11/68/48/334116848.db2.gz WBDJMFVHWXUEOU-VIFPVBQESA-N 1 2 291.376 3.519 20 5 CHBDLO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)c2[nH+]ccn21 ZINC000345355400 335317450 /nfs/dbraw/zinc/31/74/50/335317450.db2.gz LTFSHWGFWOTGAV-PRHODGIISA-N 1 2 292.726 3.563 20 5 CHBDLO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)c2[nH+]ccn21 ZINC000345355402 335317535 /nfs/dbraw/zinc/31/75/35/335317535.db2.gz LTFSHWGFWOTGAV-UFBFGSQYSA-N 1 2 292.726 3.563 20 5 CHBDLO CC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C(F)F ZINC000578596444 335652386 /nfs/dbraw/zinc/65/23/86/335652386.db2.gz MCGCRVAGVATLGO-BXKDBHETSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000037775646 527066329 /nfs/dbraw/zinc/06/63/29/527066329.db2.gz NUHGHGXDESZBCQ-UWVGGRQHSA-N 1 2 291.376 3.772 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000349768056 1127160399 /nfs/dbraw/zinc/16/03/99/1127160399.db2.gz MJYANLYPCRIYNH-MRXNPFEDSA-N 1 2 298.342 3.638 20 5 CHBDLO O=[N+]([O-])c1ccc(O)cc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000349768056 1127160402 /nfs/dbraw/zinc/16/04/02/1127160402.db2.gz MJYANLYPCRIYNH-MRXNPFEDSA-N 1 2 298.342 3.638 20 5 CHBDLO O=[N+]([O-])c1cccnc1Nc1ccc([NH+]2CCCCC2)cc1 ZINC000007185881 1127684181 /nfs/dbraw/zinc/68/41/81/1127684181.db2.gz FDXNJBHMPPPLDQ-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917392675 1128497222 /nfs/dbraw/zinc/49/72/22/1128497222.db2.gz LSLMOGJPIYDBNN-LLVKDONJSA-N 1 2 288.372 3.776 20 5 CHBDLO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000917392675 1128497224 /nfs/dbraw/zinc/49/72/24/1128497224.db2.gz LSLMOGJPIYDBNN-LLVKDONJSA-N 1 2 288.372 3.776 20 5 CHBDLO O=[N+]([O-])c1ccccc1Oc1cccc(-n2cc[nH+]c2)c1 ZINC000301374402 1118195683 /nfs/dbraw/zinc/19/56/83/1118195683.db2.gz RMEYHJJPSOLHBC-UHFFFAOYSA-N 1 2 281.271 3.573 20 5 CHBDLO Cc1c[nH+]c(Nc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC001213663779 1119271345 /nfs/dbraw/zinc/27/13/45/1119271345.db2.gz XVWCCRAHJLUJIU-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(NCCCc2cccc(C)[nH+]2)c1 ZINC000343225792 1119357976 /nfs/dbraw/zinc/35/79/76/1119357976.db2.gz PPNRUCCHWJBEKV-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO Cc1cccc2c1C[N@H+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000429578664 1121338975 /nfs/dbraw/zinc/33/89/75/1121338975.db2.gz JHKBFXWTXYOQTQ-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO Cc1cccc2c1C[N@@H+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000429578664 1121338984 /nfs/dbraw/zinc/33/89/84/1121338984.db2.gz JHKBFXWTXYOQTQ-UHFFFAOYSA-N 1 2 288.372 3.523 20 5 CHBDLO CC(C)(C)c1cn(Cc2ccc(Cl)c([N+](=O)[O-])c2)c[nH+]1 ZINC000865376219 1123976229 /nfs/dbraw/zinc/97/62/29/1123976229.db2.gz DXJOIBVAQYDSKV-UHFFFAOYSA-N 1 2 293.754 3.791 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)c1cscn1 ZINC000873134853 1124741738 /nfs/dbraw/zinc/74/17/38/1124741738.db2.gz DPSHIRLNPCJBNT-NSHDSACASA-N 1 2 291.376 3.519 20 5 CHBDLO C[C@@H]([NH2+]Cc1scnc1Cl)c1ccccc1[N+](=O)[O-] ZINC000878373206 1125146267 /nfs/dbraw/zinc/14/62/67/1125146267.db2.gz JPBKITGEESZEHE-MRVPVSSYSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000282671315 1129278362 /nfs/dbraw/zinc/27/83/62/1129278362.db2.gz JCXASOVEAXSIEA-VXGBXAGGSA-N 1 2 289.335 3.611 20 5 CHBDLO Cc1[nH]c2ccc(O[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2[nH+]1 ZINC001228328630 1131858400 /nfs/dbraw/zinc/85/84/00/1131858400.db2.gz HODRETZLUJMTPK-JTQLQIEISA-N 1 2 297.314 3.920 20 5 CHBDLO Cc1ccc(Nc2c[nH+]c(C)cc2C)c([N+](=O)[O-])c1 ZINC001214167708 1134514057 /nfs/dbraw/zinc/51/40/57/1134514057.db2.gz UPRHKCQNSTWMSO-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1ccc(Nc2c(F)ccc([N+](=O)[O-])c2F)c(C)[nH+]1 ZINC001215285603 1134614654 /nfs/dbraw/zinc/61/46/54/1134614654.db2.gz PVVPOWSLFBRXCZ-UHFFFAOYSA-N 1 2 279.246 3.628 20 5 CHBDLO Cc1cc[nH+]c(C)c1O[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001227264965 1135813311 /nfs/dbraw/zinc/81/33/11/1135813311.db2.gz QMKGVRZWXSBBMN-LBPRGKRZSA-N 1 2 272.304 3.747 20 5 CHBDLO Cc1ccc(CNc2ccc3c(c2)CCC[NH2+]3)cc1[N+](=O)[O-] ZINC000414847837 263063949 /nfs/dbraw/zinc/06/39/49/263063949.db2.gz JXZAPNVPRJVZIQ-UHFFFAOYSA-N 1 2 297.358 3.873 20 5 CHBDLO CC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)F ZINC000453229323 331104385 /nfs/dbraw/zinc/10/43/85/331104385.db2.gz CPJGYYMAMOWTNV-OLZOCXBDSA-N 1 2 284.306 3.606 20 5 CHBDLO CC[C@@H]([NH2+][C@@H](C)c1ncc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000220951325 333171151 /nfs/dbraw/zinc/17/11/51/333171151.db2.gz MIQMQWBLRCCMHW-SMDDNHRTSA-N 1 2 289.335 3.693 20 5 CHBDLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000134899374 334107620 /nfs/dbraw/zinc/10/76/20/334107620.db2.gz YITSVPHNJRDBRQ-WDEREUQCSA-N 1 2 291.376 3.772 20 5 CHBDLO Cc1nc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000135126383 334116823 /nfs/dbraw/zinc/11/68/23/334116823.db2.gz WBDJMFVHWXUEOU-SECBINFHSA-N 1 2 291.376 3.519 20 5 CHBDLO Cc1ccc(CNc2ccc([NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000057784630 524615307 /nfs/dbraw/zinc/61/53/07/524615307.db2.gz STODBOQPAGKVHY-UHFFFAOYSA-N 1 2 285.347 3.581 20 5 CHBDLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000037775648 527067418 /nfs/dbraw/zinc/06/74/18/527067418.db2.gz NUHGHGXDESZBCQ-ZJUUUORDSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000109784889 1125469210 /nfs/dbraw/zinc/46/92/10/1125469210.db2.gz WFIUQNUXGFXOLJ-SNVBAGLBSA-N 1 2 292.360 3.555 20 5 CHBDLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000109784889 1125469214 /nfs/dbraw/zinc/46/92/14/1125469214.db2.gz WFIUQNUXGFXOLJ-SNVBAGLBSA-N 1 2 292.360 3.555 20 5 CHBDLO CC(C)(C)c1c[nH+]c2ccc(-c3ccc([N+](=O)[O-])nc3)cn21 ZINC000906170676 1126933614 /nfs/dbraw/zinc/93/36/14/1126933614.db2.gz HSQFTTMGNNWBDC-UHFFFAOYSA-N 1 2 296.330 3.602 20 5 CHBDLO Cc1c[nH+]c(CCNc2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000594597696 1127423014 /nfs/dbraw/zinc/42/30/14/1127423014.db2.gz YTFVGTFPUFPYIN-UHFFFAOYSA-N 1 2 285.347 3.570 20 5 CHBDLO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000293936720 1127534688 /nfs/dbraw/zinc/53/46/88/1127534688.db2.gz NXRNOPGZLPLZKM-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000293936720 1127534691 /nfs/dbraw/zinc/53/46/91/1127534691.db2.gz NXRNOPGZLPLZKM-MRXNPFEDSA-N 1 2 297.358 3.573 20 5 CHBDLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccc([N+](=O)[O-])cc1 ZINC000296862051 1127683888 /nfs/dbraw/zinc/68/38/88/1127683888.db2.gz YYCDUBFYWHOBFR-KZSPTFSBSA-N 1 2 275.135 3.564 20 5 CHBDLO C[C@H]([NH2+]C/C(Cl)=C/Cl)c1ccccc1[N+](=O)[O-] ZINC000271704229 1128046806 /nfs/dbraw/zinc/04/68/06/1128046806.db2.gz HZWAJXRHGQVUPV-HWPCKVLBSA-N 1 2 275.135 3.564 20 5 CHBDLO CCc1[nH+]ccc(C)c1Nc1cccc([N+](=O)[O-])c1 ZINC001204449552 1118075787 /nfs/dbraw/zinc/07/57/87/1118075787.db2.gz ALFHJTDGFJJEHR-UHFFFAOYSA-N 1 2 257.293 3.604 20 5 CHBDLO C[C@H]1C[C@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000579977523 1118271224 /nfs/dbraw/zinc/27/12/24/1118271224.db2.gz ILAADMFPOMPHKX-IUCAKERBSA-N 1 2 288.269 3.596 20 5 CHBDLO CSc1cc(Nc2ccc(C)c([N+](=O)[O-])c2)cc[nH+]1 ZINC001213665593 1119275586 /nfs/dbraw/zinc/27/55/86/1119275586.db2.gz ASDBEQCMIZTOMT-UHFFFAOYSA-N 1 2 275.333 3.764 20 5 CHBDLO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1Cc2ccccc2C1 ZINC000436130540 1120293416 /nfs/dbraw/zinc/29/34/16/1120293416.db2.gz XPNAABWKSGEGIQ-GFCCVEGCSA-N 1 2 268.316 3.672 20 5 CHBDLO C[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(Cl)cc1 ZINC000054152802 1121724602 /nfs/dbraw/zinc/72/46/02/1121724602.db2.gz ZWCVPVNPGROIID-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(Cl)cc1 ZINC000054152802 1121724606 /nfs/dbraw/zinc/72/46/06/1121724606.db2.gz ZWCVPVNPGROIID-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788862 1122615696 /nfs/dbraw/zinc/61/56/96/1122615696.db2.gz ARBAKKYXSVBECD-WFASDCNBSA-N 1 2 292.379 3.701 20 5 CHBDLO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1cc(O)ccc1[N+](=O)[O-] ZINC001191788862 1122615700 /nfs/dbraw/zinc/61/57/00/1122615700.db2.gz ARBAKKYXSVBECD-WFASDCNBSA-N 1 2 292.379 3.701 20 5 CHBDLO Cc1cc([NH+](C)C)ccc1NCc1cccc([N+](=O)[O-])c1C ZINC000864004138 1123908379 /nfs/dbraw/zinc/90/83/79/1123908379.db2.gz KVWKBCDIPFTUEG-UHFFFAOYSA-N 1 2 299.374 3.890 20 5 CHBDLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccns1 ZINC000872090201 1124680709 /nfs/dbraw/zinc/68/07/09/1124680709.db2.gz NUFXJGAORJTOSN-BDAKNGLRSA-N 1 2 295.339 3.602 20 5 CHBDLO C[C@H]([NH2+]C/C(Cl)=C\Cl)c1ccccc1[N+](=O)[O-] ZINC000880091784 1125249376 /nfs/dbraw/zinc/24/93/76/1125249376.db2.gz HZWAJXRHGQVUPV-CYXIBPNKSA-N 1 2 275.135 3.564 20 5 CHBDLO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNc1cccc[nH+]1 ZINC000811476101 1130613905 /nfs/dbraw/zinc/61/39/05/1130613905.db2.gz YUZAKIJUNVHHLA-UHFFFAOYSA-N 1 2 298.129 3.909 20 5 CHBDLO Cc1cc(C)c(Nc2c(F)ccc([N+](=O)[O-])c2F)c[nH+]1 ZINC001215287582 1131555925 /nfs/dbraw/zinc/55/59/25/1131555925.db2.gz QTEQVZTWWCGDHI-UHFFFAOYSA-N 1 2 279.246 3.628 20 5 CHBDLO Cc1cc(NCc2cccc([N+](=O)[O-])c2C)c[nH+]c1C ZINC001203490927 1133332854 /nfs/dbraw/zinc/33/28/54/1133332854.db2.gz FDNFZLTWVVNUJS-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1ccc(Nc2cc([N+](=O)[O-])ccc2C)c(C)[nH+]1 ZINC001211285183 1134402964 /nfs/dbraw/zinc/40/29/64/1134402964.db2.gz SXJKZJUCHDTBIW-UHFFFAOYSA-N 1 2 257.293 3.659 20 5 CHBDLO Cc1ccc(Nc2ccccc2-n2cc[nH+]c2)cc1[N+](=O)[O-] ZINC001213665714 1134475334 /nfs/dbraw/zinc/47/53/34/1134475334.db2.gz HUUVDOLLUPSIOH-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1ccc(Nc2ccc(N3CCCC3)[nH+]c2)cc1[N+](=O)[O-] ZINC001213665982 1134476286 /nfs/dbraw/zinc/47/62/86/1134476286.db2.gz VYGSNPXVLYUENP-UHFFFAOYSA-N 1 2 298.346 3.642 20 5 CHBDLO CC(C)[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1[nH]cc[nH+]1 ZINC000357543241 266318706 /nfs/dbraw/zinc/31/87/06/266318706.db2.gz BQEAPMGKHILHJY-LBPRGKRZSA-N 1 2 294.742 3.781 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000361045992 266774390 /nfs/dbraw/zinc/77/43/90/266774390.db2.gz NEJXCPVKIQBHCC-LLVKDONJSA-N 1 2 286.306 3.811 20 5 CHBDLO C[C@@H]1c2ccccc2C[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000361045992 266774392 /nfs/dbraw/zinc/77/43/92/266774392.db2.gz NEJXCPVKIQBHCC-LLVKDONJSA-N 1 2 286.306 3.811 20 5 CHBDLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000449349038 327166619 /nfs/dbraw/zinc/16/66/19/327166619.db2.gz OCSHGJBYTMWYSV-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO Cc1cc[nH+]c(NCc2cccc([N+](=O)[O-])c2)c1Cl ZINC000561158288 327370373 /nfs/dbraw/zinc/37/03/73/327370373.db2.gz CSDDBGUMCAPFJR-UHFFFAOYSA-N 1 2 277.711 3.564 20 5 CHBDLO O=[N+]([O-])c1cccc(C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000051634427 328626311 /nfs/dbraw/zinc/62/63/11/328626311.db2.gz VOHWNNJIBRGRCA-UHFFFAOYSA-N 1 2 294.713 3.677 20 5 CHBDLO Cc1ccc(CNc2cc([N+](=O)[O-])c(C)cc2C)c(C)[nH+]1 ZINC000187705026 329362506 /nfs/dbraw/zinc/36/25/06/329362506.db2.gz PVZDOMAGTJZIHY-UHFFFAOYSA-N 1 2 285.347 3.836 20 5 CHBDLO Cc1ccc([N+](=O)[O-])c(NCc2c[nH+]c(C)cc2C)c1 ZINC000397083775 330237710 /nfs/dbraw/zinc/23/77/10/330237710.db2.gz IFEYLHCWDQUCOW-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO Cc1ccc(NCc2c[nH+]c(C)cc2C)c([N+](=O)[O-])c1 ZINC000397109948 330239328 /nfs/dbraw/zinc/23/93/28/330239328.db2.gz RCRJSPRVSAIPNH-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(F)F ZINC000453245501 331106643 /nfs/dbraw/zinc/10/66/43/331106643.db2.gz KXUXFUUHKACGQZ-KOLCDFICSA-N 1 2 272.295 3.598 20 5 CHBDLO Cc1cc([N+](=O)[O-])ccc1CNc1c[nH+]c2c(c1)CCCC2 ZINC000543620929 333885161 /nfs/dbraw/zinc/88/51/61/333885161.db2.gz WIZRTFNPWLOPEE-UHFFFAOYSA-N 1 2 297.358 3.789 20 5 CHBDLO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000292812913 520484194 /nfs/dbraw/zinc/48/41/94/520484194.db2.gz OZEQTJCZMFMZDZ-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000292812913 520484205 /nfs/dbraw/zinc/48/42/05/520484205.db2.gz OZEQTJCZMFMZDZ-INIZCTEOSA-N 1 2 297.358 3.573 20 5 CHBDLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000037775647 527034057 /nfs/dbraw/zinc/03/40/57/527034057.db2.gz NUHGHGXDESZBCQ-NXEZZACHSA-N 1 2 291.376 3.772 20 5 CHBDLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1cccc([N+](=O)[O-])c1 ZINC000180399789 1126843839 /nfs/dbraw/zinc/84/38/39/1126843839.db2.gz PJHWQRJTNBOZAG-NDVARNPJSA-N 1 2 275.135 3.564 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c1 ZINC000595704425 1127472832 /nfs/dbraw/zinc/47/28/32/1127472832.db2.gz QXGXKLDXIXNMJS-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H]2c2ccc(F)cc2)c1 ZINC000595704425 1127472834 /nfs/dbraw/zinc/47/28/34/1127472834.db2.gz QXGXKLDXIXNMJS-MRXNPFEDSA-N 1 2 286.306 3.681 20 5 CHBDLO C[N@H+](Cc1ccc(Cl)s1)Cc1ccccc1[N+](=O)[O-] ZINC000061759371 1127716307 /nfs/dbraw/zinc/71/63/07/1127716307.db2.gz DGTYMOZCAAHPSO-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccccc1[N+](=O)[O-] ZINC000061759371 1127716308 /nfs/dbraw/zinc/71/63/08/1127716308.db2.gz DGTYMOZCAAHPSO-UHFFFAOYSA-N 1 2 296.779 3.942 20 5 CHBDLO C[C@@H]([NH2+]C/C(Cl)=C/Cl)c1ccc([N+](=O)[O-])cc1 ZINC000932178313 1128398924 /nfs/dbraw/zinc/39/89/24/1128398924.db2.gz YYCDUBFYWHOBFR-NDVARNPJSA-N 1 2 275.135 3.564 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610504858 1118586367 /nfs/dbraw/zinc/58/63/67/1118586367.db2.gz CBTBDUOVAMVZDP-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610504858 1118586368 /nfs/dbraw/zinc/58/63/68/1118586368.db2.gz CBTBDUOVAMVZDP-OAHLLOKOSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610504857 1118586394 /nfs/dbraw/zinc/58/63/94/1118586394.db2.gz CBTBDUOVAMVZDP-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610504857 1118586397 /nfs/dbraw/zinc/58/63/97/1118586397.db2.gz CBTBDUOVAMVZDP-HNNXBMFYSA-N 1 2 286.306 3.681 20 5 CHBDLO Cc1cccc(CCCNc2ccc([N+](=O)[O-])c(C)c2)[nH+]1 ZINC000343225961 1119357658 /nfs/dbraw/zinc/35/76/58/1119357658.db2.gz KTILQJSJRZVVAT-UHFFFAOYSA-N 1 2 285.347 3.651 20 5 CHBDLO CC[N@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611777721 1119377442 /nfs/dbraw/zinc/37/74/42/1119377442.db2.gz QRZGQDNCDHHCCU-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO CC[N@@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611777721 1119377446 /nfs/dbraw/zinc/37/74/46/1119377446.db2.gz QRZGQDNCDHHCCU-UHFFFAOYSA-N 1 2 294.738 3.863 20 5 CHBDLO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348540913 1120681296 /nfs/dbraw/zinc/68/12/96/1120681296.db2.gz NPAVDGBTYIOJRV-MRXNPFEDSA-N 1 2 298.342 3.550 20 5 CHBDLO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348540913 1120681298 /nfs/dbraw/zinc/68/12/98/1120681298.db2.gz NPAVDGBTYIOJRV-MRXNPFEDSA-N 1 2 298.342 3.550 20 5 CHBDLO Cc1cc(C)c(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c[nH+]1 ZINC001175899198 1121493570 /nfs/dbraw/zinc/49/35/70/1121493570.db2.gz NWNURXLIOAEEEP-BQYQJAHWSA-N 1 2 269.304 3.689 20 5 CHBDLO CSc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC001119446298 1121781263 /nfs/dbraw/zinc/78/12/63/1121781263.db2.gz RICOBVRROHYMFQ-UHFFFAOYSA-N 1 2 292.360 3.542 20 5 CHBDLO CSc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC001119446298 1121781271 /nfs/dbraw/zinc/78/12/71/1121781271.db2.gz RICOBVRROHYMFQ-UHFFFAOYSA-N 1 2 292.360 3.542 20 5 CHBDLO Cc1cc(CNc2c(C)cccc2[N+](=O)[O-])cc(C)[nH+]1 ZINC000420647698 1122028212 /nfs/dbraw/zinc/02/82/12/1122028212.db2.gz CLDVFIBASKZADX-UHFFFAOYSA-N 1 2 271.320 3.527 20 5 CHBDLO CCCC1CC[NH+](Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001191358523 1122593256 /nfs/dbraw/zinc/59/32/56/1122593256.db2.gz MDCZDEBIOCBJPH-UHFFFAOYSA-N 1 2 298.333 3.885 20 5 CHBDLO CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(O)ccc1[N+](=O)[O-] ZINC001193649696 1122706470 /nfs/dbraw/zinc/70/64/70/1122706470.db2.gz VNQLHGHYXPQZLV-DOMZBBRYSA-N 1 2 292.379 3.749 20 5 CHBDLO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964280 1123496699 /nfs/dbraw/zinc/49/66/99/1123496699.db2.gz XVHKPTBIOQZORD-NEPJUHHUSA-N 1 2 292.379 3.699 20 5 CHBDLO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cc(O)ccc1[N+](=O)[O-])C1CC1 ZINC000338964280 1123496701 /nfs/dbraw/zinc/49/67/01/1123496701.db2.gz XVHKPTBIOQZORD-NEPJUHHUSA-N 1 2 292.379 3.699 20 5 CHBDLO C[C@H]([NH2+]Cc1scnc1Cl)c1ccccc1[N+](=O)[O-] ZINC000878373207 1125145801 /nfs/dbraw/zinc/14/58/01/1125145801.db2.gz JPBKITGEESZEHE-QMMMGPOBSA-N 1 2 297.767 3.556 20 5 CHBDLO O=[N+]([O-])c1ccccc1Nc1cccc2cc[nH+]cc21 ZINC001206164307 1132196878 /nfs/dbraw/zinc/19/68/78/1132196878.db2.gz GPWVWTAIESWENG-UHFFFAOYSA-N 1 2 265.272 3.887 20 5 CHBDLO O=[N+]([O-])c1cccc(Nc2ccc(N3CCCCC3)[nH+]c2)c1 ZINC001204414592 1133444159 /nfs/dbraw/zinc/44/41/59/1133444159.db2.gz ANKVCSJNENRCQF-UHFFFAOYSA-N 1 2 298.346 3.724 20 5 CHBDLO Cc1ccc(Nc2ccc(-n3cc[nH+]c3)cc2)cc1[N+](=O)[O-] ZINC001213665765 1134476362 /nfs/dbraw/zinc/47/63/62/1134476362.db2.gz KLBJNIJZNNLPRN-UHFFFAOYSA-N 1 2 294.314 3.833 20 5 CHBDLO Cc1cc(CO[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001223426126 1135344480 /nfs/dbraw/zinc/34/44/80/1135344480.db2.gz ZFFDDMKNGBFTIP-ZDUSSCGKSA-N 1 2 286.331 3.884 20 5 CHBDLO O=[N+]([O-])c1cc(CNc2ccc3c(c2)CCC[NH2+]3)cs1 ZINC000414850965 263067391 /nfs/dbraw/zinc/06/73/91/263067391.db2.gz NPQDSBWZNBKMIB-UHFFFAOYSA-N 1 2 289.360 3.627 20 5 CHBDLO CC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)F ZINC000453229320 331104319 /nfs/dbraw/zinc/10/43/19/331104319.db2.gz CPJGYYMAMOWTNV-CHWSQXEVSA-N 1 2 284.306 3.606 20 5 CHBDLO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(C)(F)F ZINC000453296042 331112430 /nfs/dbraw/zinc/11/24/30/331112430.db2.gz QPJPOUWBWJPOMU-NOZJJQNGSA-N 1 2 284.306 3.606 20 5 CHBDLO CC(F)(F)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000549862872 334207174 /nfs/dbraw/zinc/20/71/74/334207174.db2.gz GEBTUSCPJMJZHD-UHFFFAOYSA-N 1 2 296.273 3.600 20 5 CHBDLO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000290370336 521444640 /nfs/dbraw/zinc/44/46/40/521444640.db2.gz HIUOZEQOSODFDT-NSHDSACASA-N 1 2 291.376 3.634 20 5 CHBDLO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000290370336 521444647 /nfs/dbraw/zinc/44/46/47/521444647.db2.gz HIUOZEQOSODFDT-NSHDSACASA-N 1 2 291.376 3.634 20 5 CHBDLO